data_2jv4_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 2jv4 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 22.8 m . . . . . 0 N--CA 1.48 1.05 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 22.0 m120 -94.37 133.83 37.53 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.312 1.045 . . . . 0.0 110.468 168.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 24.6 p -134.89 128.26 32.27 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.471 1.509 . . . . 0.0 108.635 174.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -73.25 47.65 1.37 Allowed Glycine 0 CA--C 1.525 0.69 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.871 158.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.8 mt -82.83 171.15 12.4 Favored Pre-proline 0 CA--C 1.545 0.765 0 O-C-N 121.586 -0.95 . . . . 0.0 109.711 171.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -66.39 153.0 79.68 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 N-CA-C 108.656 -1.325 . . . . 0.0 108.656 171.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.28 -25.65 3.96 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 116.067 1.877 . . . . 0.0 116.067 -165.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -77.36 57.03 3.72 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 125.028 1.299 . . . . 0.0 112.612 166.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 2.4 p90 -96.33 149.84 21.23 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.368 1.067 . . . . 0.0 113.343 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 174.42 99.16 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 130.089 3.355 . . . . 0.0 107.27 168.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 39.4 t -69.46 115.53 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 CA-C-N 119.112 0.869 . . . . 0.0 111.066 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -106.05 176.61 5.11 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.223 1.809 . . . . 0.0 109.636 165.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 16.9 p80 -161.84 147.21 13.28 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.954 -1.092 . . . . 0.0 112.299 -178.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.2 m -70.14 156.59 38.98 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -177.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -62.3 -46.14 90.1 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.349 1.06 . . . . 0.0 112.762 -176.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.1 m -130.17 -28.11 2.17 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.933 1.293 . . . . 0.0 112.936 -170.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.3 mttm -74.87 149.68 39.46 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 126.0 1.72 . . . . 0.0 111.476 172.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -96.07 -5.88 39.9 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 118.466 2.765 . . . . 0.0 118.466 -153.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -100.02 158.13 32.61 Favored Pre-proline 0 N--CA 1.481 1.114 0 CA-C-N 120.876 1.671 . . . . 0.0 112.374 177.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -77.41 174.99 11.86 Favored 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 124.018 3.145 . . . . 0.0 110.934 169.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 16.8 p90 -142.17 137.23 30.71 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.912 0.885 . . . . 0.0 110.247 159.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -98.76 102.62 14.41 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.057 -1.027 . . . . 0.0 110.378 -171.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -75.54 131.3 39.95 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.428 1.091 . . . . 0.0 111.287 -177.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 60.5 t-20 -87.66 121.18 71.1 Favored Pre-proline 0 CA--C 1.546 0.807 0 CA-C-O 118.652 -0.689 . . . . 0.0 109.648 167.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -76.63 -35.09 2.2 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 122.595 2.196 . . . . 0.0 113.204 174.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -90.51 -15.88 29.91 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 -169.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.0 m -132.47 138.88 47.75 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.538 1.935 . . . . 0.0 107.207 171.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 35.7 mtp-105 -70.41 87.74 0.64 Allowed 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 118.554 0.616 . . . . 0.0 110.421 175.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -165.79 170.54 13.83 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.96 2.104 . . . . 0.0 111.7 -172.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 79.6 p -152.97 155.86 37.77 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.01 1.324 . . . . 0.0 112.043 177.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -124.85 147.23 48.88 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 126.741 2.016 . . . . 0.0 109.315 -177.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -113.57 -34.61 5.49 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 113.221 0.822 . . . . 0.0 113.221 -160.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -144.03 167.11 16.17 Favored Pre-proline 0 CA--C 1.554 1.126 0 C-N-CA 129.416 3.087 . . . . 0.0 106.878 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -65.12 116.99 4.16 Favored 'Trans proline' 0 CA--C 1.553 1.448 0 C-N-CA 123.06 2.507 . . . . 0.0 113.029 -175.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -87.4 179.94 2.91 Favored 'Trans proline' 0 C--N 1.357 1.003 1 C-N-CA 125.468 4.112 . . . . 0.0 114.036 -175.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.76 -29.72 70.27 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.452 1.278 . . . . 0.0 114.452 175.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -76.82 0.04 22.2 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.89 1.276 . . . . 0.0 114.105 177.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.4 169.88 14.13 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.521 1.529 . . . . 0.0 112.458 -173.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -125.72 56.53 1.39 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.283 1.833 . . . . 0.0 110.907 -171.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 62.5 mtm -25.97 -42.44 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.424 0 C-N-CA 127.771 2.428 . . . . 0.0 116.538 171.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -53.57 -53.83 46.13 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 121.787 2.085 . . . . 0.0 112.032 172.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.8 m -71.95 -6.73 44.14 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 126.51 1.924 . . . . 0.0 112.238 173.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 71.7 mt -95.81 -20.9 18.47 Favored 'General case' 0 CA--C 1.507 -0.681 0 O-C-N 120.254 -1.529 . . . . 0.0 113.954 166.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -68.15 -38.17 81.85 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 121.812 2.096 . . . . 0.0 109.707 -172.173 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 23.7 ptm -60.16 -13.01 9.98 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 128.422 2.689 . . . . 0.0 115.342 165.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -110.42 -65.44 1.16 Allowed 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.016 1.726 . . . . 0.0 112.348 -177.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 55.5 mtp -63.17 -17.19 62.11 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 128.102 2.561 . . . . 0.0 114.752 -172.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -128.23 148.48 50.63 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.071 1.348 . . . . 0.0 111.081 173.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 90.6 m . . . . . 0 N--CA 1.478 0.961 0 C-N-CA 124.947 1.299 . . . . 0.0 110.924 -176.836 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 17.7 m . . . . . 0 N--CA 1.479 0.977 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 37.8 t-20 -95.0 154.58 17.11 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.121 1.368 . . . . 0.0 109.766 159.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 70.4 p -134.22 135.4 42.95 Favored 'General case' 0 CA--C 1.509 -0.626 0 C-N-CA 124.735 1.214 . . . . 0.0 109.129 170.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -81.01 45.24 3.15 Favored Glycine 0 CA--C 1.526 0.745 0 CA-C-N 114.528 -1.215 . . . . 0.0 111.966 155.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.9 mt -93.41 165.56 18.0 Favored Pre-proline 0 CA--C 1.553 1.093 0 CA-C-N 119.831 1.815 . . . . 0.0 110.256 173.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_endo -77.48 -153.86 0.05 OUTLIER 'Trans proline' 0 CA--C 1.548 1.188 0 C-N-CA 123.797 2.998 . . . . 0.0 111.457 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.12 -15.93 38.65 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.246 1.418 . . . . 0.0 114.733 173.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -108.29 83.2 0.32 Allowed Glycine 0 C--N 1.337 0.603 0 C-N-CA 126.524 2.012 . . . . 0.0 110.568 173.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -124.22 0.42 8.39 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 115.157 1.539 . . . . 0.0 115.157 -179.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -80.51 102.55 9.8 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.786 0.721 . . . . 0.0 110.438 -172.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 75.8 t -66.3 131.06 32.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 O-C-N 121.572 -0.705 . . . . 0.0 111.422 -172.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.7 mmt-85 -131.11 120.66 23.69 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.339 1.856 . . . . 0.0 109.312 172.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -92.03 14.03 17.07 Favored 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 -176.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.6 m -73.07 107.29 5.34 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.539 -1.35 . . . . 0.0 111.049 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 55.0 t-20 174.85 135.7 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 128.714 2.806 . . . . 0.0 107.133 -172.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 42.4 m -59.21 -24.92 63.54 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.09 1.356 . . . . 0.0 113.376 168.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.5 mmtt -103.01 141.06 36.44 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.14 1.376 . . . . 0.0 110.532 178.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -79.16 24.52 0.33 Allowed 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 -154.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -111.97 146.0 33.91 Favored Pre-proline 0 CA--C 1.544 0.726 0 C-N-CA 124.921 1.289 . . . . 0.0 110.509 171.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -76.87 166.71 26.48 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 123.587 2.858 . . . . 0.0 112.208 176.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 46.0 p90 -107.43 159.24 16.55 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.306 153.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -100.93 125.4 47.5 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 171.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.439 ' CE2' ' HA ' ' A' ' 27' ' ' PRO . 24.7 t80 -83.35 142.59 30.94 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 121.433 -0.792 . . . . 0.0 111.388 177.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -96.46 92.39 1.07 Allowed Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 126.041 1.736 . . . . 0.0 110.117 170.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.439 ' HA ' ' CE2' ' A' ' 25' ' ' PHE . 9.8 Cg_endo -54.7 -22.72 29.99 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.691 2.928 . . . . 0.0 115.827 -176.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -94.57 -4.85 47.13 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 115.402 1.63 . . . . 0.0 115.402 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.6 m -143.68 149.05 36.65 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 119.701 1.137 . . . . 0.0 111.11 -164.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 55.0 mtp180 -83.97 67.75 9.75 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 121.05 -1.031 . . . . 0.0 110.346 171.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -159.14 169.08 24.97 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 126.748 2.019 . . . . 0.0 109.777 -176.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 92.6 p -140.68 161.15 38.45 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.93 -1.106 . . . . 0.0 113.394 172.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -120.08 158.18 27.38 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.505 1.922 . . . . 0.0 110.221 178.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -144.5 -17.16 0.55 Allowed 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 114.368 1.248 . . . . 0.0 114.368 -160.101 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -154.7 161.4 29.47 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 128.159 2.584 . . . . 0.0 107.12 -173.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -70.64 117.52 5.18 Favored 'Trans proline' 0 CA--C 1.548 1.199 0 C-N-CA 123.05 2.5 . . . . 0.0 111.956 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -83.73 -161.07 0.13 Allowed 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 124.77 3.647 . . . . 0.0 112.476 -178.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -95.1 -21.82 18.29 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 120.51 -1.368 . . . . 0.0 114.02 -178.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -76.99 0.13 22.33 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.998 1.719 . . . . 0.0 112.862 169.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -82.63 172.75 12.61 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 126.968 2.107 . . . . 0.0 111.973 -178.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -129.94 65.72 1.49 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.103 1.761 . . . . 0.0 111.253 -173.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 41.1 mtm -37.83 -35.88 0.16 Allowed 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 116.582 2.067 . . . . 0.0 116.582 174.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -68.28 -12.71 61.47 Favored 'General case' 0 CA--C 1.56 1.346 0 CA-C-N 121.481 1.946 . . . . 0.0 114.081 176.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 31.9 m -107.42 -2.41 20.54 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 128.019 2.528 . . . . 0.0 111.837 166.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 79.4 mt -98.68 -18.43 18.05 Favored 'General case' 0 CA--C 1.507 -0.698 0 CA-C-O 115.871 -2.014 . . . . 0.0 114.48 171.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 7.4 mmpt? -68.85 -37.28 79.02 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 123.392 2.814 . . . . 0.0 110.601 -175.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 23.1 ptp -51.86 -22.43 3.75 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.469 1.908 . . . . 0.0 114.054 164.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -104.11 -70.03 0.78 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 126.497 1.919 . . . . 0.0 112.66 -178.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 12.9 mtt -66.05 -15.53 63.14 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 128.129 2.572 . . . . 0.0 115.265 -174.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -162.5 60.3 0.22 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.97 1.308 . . . . 0.0 111.351 -177.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 5.8 m . . . . . 0 N--CA 1.48 1.051 0 C-N-CA 128.877 2.871 . . . . 0.0 115.187 -159.537 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.479 0.994 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -70.55 146.37 50.2 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.496 0.719 . . . . 0.0 111.713 169.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 63.6 p -136.83 142.55 42.87 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.857 1.663 . . . . 0.0 109.257 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -75.24 16.98 3.3 Favored Glycine 0 CA--C 1.535 1.29 0 CA-C-O 118.486 -1.175 . . . . 0.0 115.635 152.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 16.4 mt -71.88 156.12 91.34 Favored Pre-proline 0 CA--C 1.547 0.865 0 CA-C-N 120.391 2.095 . . . . 0.0 110.252 -177.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -78.67 -150.82 0.04 OUTLIER 'Trans proline' 0 CA--C 1.548 1.198 0 C-N-CA 122.872 2.382 . . . . 0.0 111.503 -172.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.73 -22.97 58.91 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 120.517 -1.364 . . . . 0.0 114.678 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -102.53 81.53 0.39 Allowed Glycine 0 C--N 1.34 0.761 0 C-N-CA 126.445 1.974 . . . . 0.0 110.542 174.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 10.2 p-90 -130.33 -6.96 4.26 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.73 1.381 . . . . 0.0 114.73 -175.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.2 tp10 -75.67 103.25 5.69 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 118.993 0.815 . . . . 0.0 109.191 -175.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.0 p -66.47 134.78 29.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.179 0.591 . . . . 0.0 111.589 -174.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -130.5 125.83 35.33 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.667 1.587 . . . . 0.0 110.179 176.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 28.1 p-80 -88.04 -11.52 46.98 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.248 1.419 . . . . 0.0 114.668 -173.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 44.6 m -51.19 108.09 0.23 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.918 1.287 . . . . 0.0 112.997 -174.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.1 p30 152.26 140.78 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 131.619 3.967 . . . . 0.0 109.835 -179.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 38.0 m -70.07 -15.9 63.06 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.709 1.604 . . . . 0.0 112.897 168.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.4 ttmt -79.1 -166.17 0.88 Allowed 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.71 1.204 . . . . 0.0 112.463 -179.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.1 m120 -94.93 -30.32 14.21 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 -154.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -114.77 156.16 45.3 Favored Pre-proline 0 N--CA 1.475 0.782 0 C-N-CA 124.662 1.185 . . . . 0.0 111.776 -177.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -79.57 -173.68 1.97 Allowed 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 123.828 3.018 . . . . 0.0 110.562 171.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 45.7 p90 -133.39 149.87 51.82 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.281 1.432 . . . . 0.0 110.05 161.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -93.34 132.13 37.85 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 121.313 -0.867 . . . . 0.0 110.312 174.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -100.42 147.92 25.31 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.514 1.125 . . . . 0.0 111.681 178.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.4 t-20 -102.47 110.02 61.96 Favored Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 123.914 0.885 . . . . 0.0 110.265 162.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -63.97 -29.94 66.81 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 123.137 2.558 . . . . 0.0 114.613 177.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.4 -30.77 57.6 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 -172.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 95.6 m -147.1 105.39 3.77 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 126.248 1.819 . . . . 0.0 107.616 177.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -47.18 104.56 0.05 Allowed 'General case' 0 C--O 1.237 0.419 0 C-N-CA 128.147 2.579 . . . . 0.0 111.927 -171.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -171.59 158.09 4.97 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.968 1.707 . . . . 0.0 109.799 -171.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 92.6 p -127.3 162.19 26.84 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 174.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 8.1 tpp85 -134.31 150.21 50.94 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 126.725 2.01 . . . . 0.0 109.249 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -142.54 -18.28 0.7 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.561 1.144 . . . . 0.0 112.863 -156.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -149.54 155.96 39.03 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 128.179 2.592 . . . . 0.0 107.504 -175.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -66.03 121.75 9.14 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.823 2.349 . . . . 0.0 110.87 178.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -80.07 167.91 19.4 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 123.545 2.83 . . . . 0.0 111.494 175.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.39 -28.17 68.42 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -176.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -71.48 -24.89 62.07 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.24 1.816 . . . . 0.0 113.859 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.41 164.38 23.14 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 127.034 2.134 . . . . 0.0 113.96 -163.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -107.88 53.42 0.69 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.216 1.407 . . . . 0.0 111.24 -162.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 77.4 mtm -27.2 -40.38 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 129.045 2.938 . . . . 0.0 115.103 166.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -50.61 -47.58 58.21 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 121.555 1.979 . . . . 0.0 113.542 173.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 21.5 m -78.52 -21.04 49.45 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 128.04 2.536 . . . . 0.0 112.162 176.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.3 tp -117.48 -21.4 8.64 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 123.976 0.91 . . . . 0.0 111.3 -150.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.9 -35.48 69.03 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 120.598 1.544 . . . . 0.0 111.015 157.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 8.5 mmt -60.43 -24.96 65.61 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 172.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -97.36 -45.48 6.45 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.858 1.663 . . . . 0.0 112.78 -178.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 35.1 mtt -76.33 -17.25 59.51 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.268 1.827 . . . . 0.0 112.697 -177.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -104.3 165.01 11.33 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.044 1.338 . . . . 0.0 110.398 157.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.48 1.072 0 C-N-CA 125.078 1.351 . . . . 0.0 113.343 178.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 18.5 t . . . . . 0 N--CA 1.472 0.65 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.8 m120 -53.26 131.02 36.63 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 122.093 -0.38 . . . . 0.0 111.29 168.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 44.7 p -129.39 146.59 51.23 Favored 'General case' 0 CA--C 1.508 -0.668 0 C-N-CA 125.508 1.523 . . . . 0.0 108.337 171.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -94.47 52.92 2.08 Favored Glycine 0 CA--C 1.524 0.616 0 CA-C-N 113.795 -1.548 . . . . 0.0 111.5 154.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 15.0 mt -88.63 169.06 14.24 Favored Pre-proline 0 CA--C 1.551 1.013 0 CA-C-N 118.699 1.25 . . . . 0.0 110.311 175.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -75.8 -158.34 0.08 OUTLIER 'Trans proline' 0 CA--C 1.548 1.209 0 C-N-CA 121.726 1.618 . . . . 0.0 110.801 177.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.4 12.8 0.54 Allowed 'General case' 0 CA--C 1.551 1.002 0 N-CA-C 115.657 1.725 . . . . 0.0 115.657 -172.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -142.14 102.32 0.3 Allowed Glycine 0 C--N 1.334 0.472 0 C-N-CA 126.046 1.784 . . . . 0.0 109.276 173.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 52.7 p-90 -141.64 -2.47 1.21 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.411 1.484 . . . . 0.0 114.264 -171.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.09 161.25 11.21 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.576 0.751 . . . . 0.0 110.927 159.487 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.5 m -118.51 149.28 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.37 1.068 . . . . 0.0 112.866 -173.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.9 mmt85 -141.44 118.89 11.53 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.473 1.909 . . . . 0.0 110.196 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 16.4 p-80 -74.52 166.16 23.99 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 113.631 0.974 . . . . 0.0 113.631 175.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 29.0 t -160.49 130.88 5.34 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 125.46 1.504 . . . . 0.0 110.176 176.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -58.9 -24.44 62.32 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 -176.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 69.5 m -71.94 -15.79 62.09 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.944 1.298 . . . . 0.0 114.063 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -108.21 168.03 9.59 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.566 1.546 . . . . 0.0 113.045 -171.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -92.97 -9.94 38.15 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 169.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -160.77 164.64 18.82 Favored Pre-proline 0 CA--C 1.55 0.947 0 C-N-CA 126.906 2.082 . . . . 0.0 109.598 -177.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.57 162.68 40.69 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 122.782 2.321 . . . . 0.0 113.125 -177.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 33.2 p90 -95.24 157.57 15.84 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.805 0.842 . . . . 0.0 110.953 160.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -83.0 143.42 30.65 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 121.683 -0.636 . . . . 0.0 110.388 171.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -116.83 145.2 43.7 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.301 1.04 . . . . 0.0 112.493 -174.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -101.13 98.15 8.31 Favored Pre-proline 0 CA--C 1.552 1.031 0 C-N-CA 124.702 1.201 . . . . 0.0 110.447 176.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -66.72 -29.67 42.55 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 122.692 2.261 . . . . 0.0 115.137 -167.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.73 -24.38 41.66 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.868 1.432 . . . . 0.0 114.868 -176.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.8 m -146.47 126.68 13.85 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 125.274 1.43 . . . . 0.0 109.51 178.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -50.36 101.12 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.196 1.798 . . . . 0.0 112.736 -176.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -168.08 154.48 7.54 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 127.019 2.128 . . . . 0.0 110.749 179.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 82.4 p -129.53 151.55 50.02 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.878 1.271 . . . . 0.0 112.735 176.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 18.0 tpp180 -126.34 146.35 50.07 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 127.471 2.308 . . . . 0.0 109.831 -176.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -130.62 -36.33 1.43 Allowed 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -158.228 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -146.28 150.53 41.52 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 126.554 1.942 . . . . 0.0 107.861 -178.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -48.27 112.61 0.62 Allowed 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 124.817 3.678 . . . . 0.0 114.391 -174.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -80.14 163.45 22.66 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 123.488 2.792 . . . . 0.0 112.203 -177.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.84 -22.71 66.87 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.058 1.132 . . . . 0.0 114.058 -178.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -90.75 -1.03 57.88 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.207 1.803 . . . . 0.0 113.998 -174.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.86 -173.6 1.93 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 126.009 1.723 . . . . 0.0 113.794 -170.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -119.09 60.27 0.82 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 126.149 1.78 . . . . 0.0 110.229 177.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 59.6 mtt -31.96 -46.33 0.12 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.901 1.68 . . . . 0.0 113.93 168.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -53.6 -36.58 62.11 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 120.351 1.432 . . . . 0.0 113.995 177.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 75.9 m -85.65 -28.19 24.91 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.28 1.432 . . . . 0.0 111.822 171.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 81.3 mt -72.31 -14.19 61.68 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 119.818 1.19 . . . . 0.0 112.536 174.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.24 -18.18 64.49 Favored 'General case' 0 CA--C 1.55 0.954 0 CA-C-N 120.624 1.556 . . . . 0.0 111.988 -175.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 93.3 mmm -79.84 -8.77 59.48 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 128.146 2.578 . . . . 0.0 113.688 168.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -121.27 -56.25 1.91 Allowed 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.786 2.034 . . . . 0.0 113.095 -166.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 88.3 mmm -67.16 -11.79 58.26 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.986 2.115 . . . . 0.0 113.267 178.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.3 151.0 40.0 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.636 1.974 . . . . 0.0 110.338 159.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 5.0 m . . . . . 0 N--CA 1.47 0.543 0 C-N-CA 124.929 1.292 . . . . 0.0 110.229 -175.156 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 17.0 m . . . . . 0 N--CA 1.474 0.774 0 CA-C-O 121.035 0.445 . . . . 0.0 111.475 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.7 m120 -111.24 128.66 56.0 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.113 0.965 . . . . 0.0 109.667 164.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 24.4 p -115.37 127.98 55.76 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.664 1.586 . . . . 0.0 108.217 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -76.33 55.0 3.23 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 110.797 -0.921 . . . . 0.0 110.797 158.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.8 mt -93.07 166.66 15.85 Favored Pre-proline 0 CA--C 1.55 0.964 0 CA-C-N 118.745 1.273 . . . . 0.0 110.905 176.264 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -77.24 -141.45 0.02 OUTLIER 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 123.526 2.817 . . . . 0.0 110.211 176.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.09 -21.43 64.97 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 120.451 -1.406 . . . . 0.0 113.675 177.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -98.52 81.33 0.6 Allowed Glycine 0 C--N 1.337 0.603 0 C-N-CA 126.974 2.226 . . . . 0.0 110.146 172.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 52.0 p-90 -119.46 -16.5 8.92 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 116.69 2.108 . . . . 0.0 116.69 -171.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -80.96 127.13 32.22 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 118.91 0.777 . . . . 0.0 110.759 -175.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.8 m -89.16 130.67 38.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 O-C-N 121.412 -0.805 . . . . 0.0 111.633 -166.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 80.8 mmt-85 -141.28 158.61 43.66 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.215 1.006 . . . . 0.0 112.254 -173.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 8.6 p80 -172.39 137.6 0.87 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.73 2.012 . . . . 0.0 112.118 177.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.9 m -70.18 159.3 34.21 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.672 -0.642 . . . . 0.0 111.968 175.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -68.47 -20.23 64.6 Favored 'General case' 0 CA--C 1.547 0.83 0 O-C-N 120.664 -1.272 . . . . 0.0 114.389 -176.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.4 m -78.89 -0.95 32.84 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.415 1.486 . . . . 0.0 113.756 173.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 59.9 mmtt -135.41 169.87 16.82 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.619 1.968 . . . . 0.0 112.751 -171.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -131.52 -29.76 1.73 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.435 1.494 . . . . 0.0 113.111 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -77.99 128.2 79.53 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 126.369 1.868 . . . . 0.0 110.071 178.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -80.99 159.26 20.86 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 123.188 2.592 . . . . 0.0 114.829 -170.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 34.1 p90 -116.63 153.26 32.59 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.816 1.647 . . . . 0.0 109.824 154.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 33.3 m-85 -110.84 112.2 23.89 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.167 0.987 . . . . 0.0 110.192 -172.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -79.84 137.25 36.9 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.071 1.748 . . . . 0.0 112.928 -171.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -93.35 109.87 43.07 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 124.479 1.112 . . . . 0.0 110.048 171.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.43 -37.21 10.28 Favored 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 121.771 1.647 . . . . 0.0 112.322 175.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.42 -21.81 62.78 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 116.028 1.862 . . . . 0.0 116.028 -170.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 31.6 m -153.67 146.46 24.33 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.256 1.823 . . . . 0.0 108.613 -173.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -70.86 87.08 0.71 Allowed 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.008 0.822 . . . . 0.0 111.844 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -166.23 178.98 5.93 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.839 2.056 . . . . 0.0 109.766 176.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 26.1 p -156.96 149.85 23.7 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.297 1.439 . . . . 0.0 112.552 170.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.7 tpp180 -101.32 135.67 42.43 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.626 2.37 . . . . 0.0 109.664 -176.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -102.03 -30.77 11.0 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 121.114 -0.991 . . . . 0.0 113.513 -167.172 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -148.58 156.7 41.92 Favored Pre-proline 0 CA--C 1.539 0.55 0 C-N-CA 126.938 2.095 . . . . 0.0 108.087 -161.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -67.27 120.72 7.8 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 122.195 1.93 . . . . 0.0 110.69 -173.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -78.19 170.13 19.15 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 122.873 2.382 . . . . 0.0 110.776 173.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -72.65 -27.9 62.4 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.554 -0.716 . . . . 0.0 111.768 164.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -65.23 -0.18 1.64 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 127.716 2.407 . . . . 0.0 114.648 179.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -88.53 172.84 9.03 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 126.658 1.983 . . . . 0.0 113.547 -170.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -107.09 48.43 0.84 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 127.288 2.235 . . . . 0.0 111.178 -171.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 69.1 mtm -29.38 -43.19 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 118.099 2.629 . . . . 0.0 118.099 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -49.29 -47.29 47.03 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 123.062 2.665 . . . . 0.0 111.912 174.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 36.6 m -77.66 -22.07 51.18 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 126.028 1.731 . . . . 0.0 111.713 178.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 66.8 mt -82.19 -21.46 36.46 Favored 'General case' 0 CA--C 1.506 -0.741 0 CA-C-O 117.625 -1.179 . . . . 0.0 113.245 171.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.71 -10.13 57.1 Favored 'General case' 0 CA--C 1.554 1.134 0 CA-C-N 121.197 1.817 . . . . 0.0 111.38 176.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.2 mmm -89.33 5.64 44.1 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 127.922 2.489 . . . . 0.0 113.066 167.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 49.6 t80 -135.42 -58.35 0.78 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 126.36 1.864 . . . . 0.0 113.031 -172.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 36.0 mtp -72.29 -4.68 31.09 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 127.829 2.452 . . . . 0.0 112.322 172.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -154.6 -165.99 2.21 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 129.168 2.987 . . . . 0.0 108.055 166.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 29.1 p . . . . . 0 N--CA 1.474 0.73 0 C-N-CA 124.497 1.119 . . . . 0.0 111.23 170.874 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.0 m . . . . . 0 N--CA 1.469 0.514 0 CA-C-O 121.499 0.666 . . . . 0.0 110.541 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.2 m120 -78.48 132.5 37.28 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.407 0.683 . . . . 0.0 109.503 166.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.423 ' HB ' ' H ' ' A' ' 7' ' ' LEU . 71.9 p -132.59 144.21 50.22 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 126.733 2.013 . . . . 0.0 108.588 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -81.22 8.69 57.32 Favored Glycine 0 CA--C 1.536 1.366 0 CA-C-N 115.093 -0.958 . . . . 0.0 113.622 156.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.423 ' H ' ' HB ' ' A' ' 5' ' ' THR . 30.4 mt -61.96 155.17 64.76 Favored Pre-proline 0 CA--C 1.542 0.669 0 CA-C-N 119.902 1.851 . . . . 0.0 110.696 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -70.36 179.18 4.21 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 121.098 1.199 . . . . 0.0 112.308 -169.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.88 -39.74 69.01 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.453 1.101 . . . . 0.0 113.049 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -82.15 68.16 3.56 Favored Glycine 0 CA--C 1.526 0.747 0 C-N-CA 125.405 1.479 . . . . 0.0 111.649 174.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -143.25 163.8 31.95 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 171.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 175.73 140.85 0.06 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 131.22 3.808 . . . . 0.0 106.231 164.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 9.1 p -81.54 141.74 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 CA-C-N 120.195 1.361 . . . . 0.0 112.172 -174.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -142.74 102.54 4.06 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.704 1.202 . . . . 0.0 111.934 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 76.5 m-70 -72.41 112.45 8.48 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.938 0.895 . . . . 0.0 111.892 175.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 29.2 t -59.63 151.23 25.28 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 -167.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -73.88 -36.95 64.86 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.053 1.341 . . . . 0.0 111.451 165.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.2 t -86.29 -25.13 25.64 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -175.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -133.67 153.45 51.67 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.299 1.039 . . . . 0.0 112.002 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -80.63 52.61 1.7 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 124.424 1.09 . . . . 0.0 111.471 176.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -154.16 135.29 8.69 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 125.245 1.418 . . . . 0.0 110.16 -158.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -82.04 131.37 6.88 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 123.33 2.687 . . . . 0.0 112.635 174.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 53.8 p90 -96.36 165.48 12.17 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 122.892 0.477 . . . . 0.0 110.11 151.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -105.19 129.84 53.48 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.321 -0.862 . . . . 0.0 110.65 170.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -87.86 139.41 30.55 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.579 1.151 . . . . 0.0 110.44 174.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -99.13 108.0 47.33 Favored Pre-proline 0 CA--C 1.551 1.015 0 O-C-N 121.855 -0.528 . . . . 0.0 109.858 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -73.48 -36.62 3.78 Favored 'Trans proline' 0 C--N 1.354 0.853 0 C-N-CA 122.512 2.141 . . . . 0.0 112.581 174.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.26 -26.24 64.67 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -174.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 76.9 m -150.21 132.0 15.04 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 127.904 2.482 . . . . 0.0 106.861 -176.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -65.0 97.89 0.26 Allowed 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.604 1.093 . . . . 0.0 110.633 -177.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -171.63 172.65 4.91 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 126.472 1.909 . . . . 0.0 110.542 -167.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 36.6 p -140.02 143.96 36.68 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 120.823 -1.173 . . . . 0.0 111.862 166.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 20.2 tpp180 -107.33 143.49 35.53 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 126.788 2.035 . . . . 0.0 110.218 -178.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -127.3 -6.54 5.91 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.41 1.484 . . . . 0.0 114.528 -166.025 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -165.98 168.92 7.25 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 127.763 2.425 . . . . 0.0 107.941 -173.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -68.01 122.38 9.47 Favored 'Trans proline' 0 CA--C 1.546 1.093 0 C-N-CA 122.07 1.846 . . . . 0.0 111.239 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -82.12 174.77 9.77 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 124.505 3.47 . . . . 0.0 111.465 176.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.37 -44.46 88.87 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 176.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -68.96 -11.48 60.74 Favored 'General case' 0 CA--C 1.553 1.066 0 N-CA-C 115.645 1.72 . . . . 0.0 115.645 -167.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.3 t -75.83 164.29 26.38 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 126.382 1.873 . . . . 0.0 114.872 -164.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -115.17 56.57 0.74 Allowed 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.749 2.02 . . . . 0.0 111.174 -163.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 27.0 mtt -30.86 -40.75 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.87 1.668 . . . . 0.0 114.805 169.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -39.65 -54.75 1.99 Allowed 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 126.412 1.885 . . . . 0.0 114.082 166.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 95.6 m -78.79 -31.06 45.85 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.961 2.104 . . . . 0.0 111.409 170.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.03 -19.99 46.38 Favored 'General case' 0 C--O 1.224 -0.251 0 O-C-N 121.171 -0.956 . . . . 0.0 112.58 -162.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.25 -27.41 67.93 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 120.707 1.594 . . . . 0.0 112.17 175.387 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 95.6 mmm -62.05 -8.03 4.79 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.714 1.205 . . . . 0.0 113.816 167.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -115.85 -59.55 1.98 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.615 1.966 . . . . 0.0 111.547 178.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -7.45 41.81 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.247 1.819 . . . . 0.0 113.99 -178.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -138.45 53.58 1.79 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.469 1.508 . . . . 0.0 110.238 167.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 7.4 m . . . . . 0 N--CA 1.476 0.874 0 C-N-CA 125.245 1.418 . . . . 0.0 110.647 -174.426 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 3.4 t . . . . . 0 N--CA 1.474 0.758 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -70.32 128.72 37.19 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 122.09 -0.382 . . . . 0.0 111.188 175.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 24.5 p -133.03 132.49 41.9 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 127.206 2.202 . . . . 0.0 107.843 -176.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -68.86 34.12 0.29 Allowed Glycine 0 CA--C 1.532 1.142 0 CA-C-O 118.435 -1.203 . . . . 0.0 115.651 155.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.7 mt -83.77 165.04 41.84 Favored Pre-proline 0 CA--C 1.548 0.872 0 CA-C-N 119.633 1.716 . . . . 0.0 109.61 177.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -77.95 -147.15 0.03 OUTLIER 'Trans proline' 0 CA--C 1.545 1.036 0 C-N-CA 121.608 1.539 . . . . 0.0 109.128 174.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.28 -21.04 64.82 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.212 -1.555 . . . . 0.0 112.91 173.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -80.94 68.79 3.36 Favored Glycine 0 CA--C 1.527 0.805 0 C-N-CA 126.025 1.774 . . . . 0.0 111.545 170.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 12.1 p-90 -120.37 -12.43 8.99 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 116.588 2.07 . . . . 0.0 116.588 -173.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -70.3 114.91 8.9 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 120.077 1.308 . . . . 0.0 110.448 -179.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 6.0 t -72.16 134.17 30.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 CA-C-N 119.168 0.895 . . . . 0.0 109.826 178.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.2 mmt85 -131.9 128.98 39.71 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 125.087 1.355 . . . . 0.0 111.331 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 38.0 p-80 -62.8 137.57 58.3 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 121.771 -0.58 . . . . 0.0 110.476 159.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.8 t -97.69 150.93 20.64 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.037 -1.04 . . . . 0.0 112.391 -174.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -69.03 -41.41 77.72 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.388 -0.82 . . . . 0.0 110.156 162.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 85.1 p -106.91 -3.73 19.9 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 115.691 1.738 . . . . 0.0 115.691 -158.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.5 ttmm -138.43 146.34 42.03 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.484 1.038 . . . . 0.0 113.564 -169.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -88.1 46.67 1.41 Allowed 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.74 1.616 . . . . 0.0 111.946 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 16.6 tp -170.63 151.9 3.67 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 128.258 2.623 . . . . 0.0 107.322 -171.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -71.18 166.37 29.42 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 121.607 1.538 . . . . 0.0 110.645 169.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 17.2 p90 -127.86 160.93 30.27 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.725 1.21 . . . . 0.0 109.949 164.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -103.98 139.44 39.11 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.6 -0.688 . . . . 0.0 110.537 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -118.04 142.19 47.66 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.658 1.583 . . . . 0.0 111.581 -172.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 65.0 t-20 -98.15 109.41 51.84 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 124.576 1.15 . . . . 0.0 110.362 171.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -75.79 -26.22 9.92 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 123.087 2.525 . . . . 0.0 113.243 177.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.83 -29.4 40.17 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 118.948 0.795 . . . . 0.0 112.771 -175.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.9 m -143.27 88.99 2.06 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.144 1.378 . . . . 0.0 108.707 174.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -32.7 103.1 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 128.557 2.743 . . . . 0.0 114.005 -173.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -173.19 165.13 4.87 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.299 1.84 . . . . 0.0 109.821 -170.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 57.1 p -120.38 173.4 7.17 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.482 1.513 . . . . 0.0 113.352 175.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.05 141.28 17.48 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.837 2.055 . . . . 0.0 109.254 -178.268 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -134.5 -25.92 1.46 Allowed 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -151.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -142.91 152.75 59.64 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 127.976 2.51 . . . . 0.0 107.556 172.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -51.04 113.0 0.91 Allowed 'Trans proline' 0 CA--C 1.544 1.012 0 C-N-CA 124.19 3.26 . . . . 0.0 112.923 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -79.15 169.39 19.17 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 123.34 2.693 . . . . 0.0 111.924 -176.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.94 -38.02 81.2 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -78.44 0.13 27.04 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 127.463 2.305 . . . . 0.0 114.5 -175.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.78 174.7 10.19 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 126.008 1.723 . . . . 0.0 111.063 178.214 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -103.6 -35.6 8.23 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 120.949 -1.095 . . . . 0.0 112.402 -166.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . 0.263 33.7 mtt 60.99 -40.05 0.11 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 128.542 2.737 . . . . 0.0 115.741 -176.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -62.23 -51.99 65.53 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 122.343 2.338 . . . . 0.0 111.783 177.288 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.0 m -66.53 -11.16 51.34 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 125.91 1.684 . . . . 0.0 112.175 169.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 8.6 tp -105.06 -23.76 12.89 Favored 'General case' 0 N--CA 1.447 -0.602 0 O-C-N 120.942 -1.099 . . . . 0.0 111.225 -170.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.24 -37.7 88.26 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 120.957 1.708 . . . . 0.0 110.213 169.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 25.1 ptp -69.87 18.31 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 126.101 1.761 . . . . 0.0 114.573 166.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -138.28 -32.38 0.72 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.691 1.997 . . . . 0.0 112.297 171.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 93.4 mmm -95.12 -8.95 34.99 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 127.287 2.235 . . . . 0.0 115.095 -179.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -141.23 165.6 27.07 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 120.327 1.421 . . . . 0.0 113.179 -176.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 10.9 t . . . . . 0 N--CA 1.479 0.989 0 C-N-CA 125.118 1.367 . . . . 0.0 113.288 -170.116 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.8 m . . . . . 0 N--CA 1.479 1.01 0 CA-C-O 120.616 0.246 . . . . 0.0 111.459 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -83.39 140.65 32.27 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.201 0.6 . . . . 0.0 110.345 167.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.472 ' HB ' ' H ' ' A' ' 7' ' ' LEU . 63.1 p -139.98 141.76 36.36 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 122.727 1.251 . . . . 0.0 109.714 170.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -73.76 4.14 31.17 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-N 113.785 -1.552 . . . . 0.0 116.074 152.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.472 ' H ' ' HB ' ' A' ' 5' ' ' THR . 15.1 mt -71.02 153.9 94.43 Favored Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 120.708 2.254 . . . . 0.0 109.074 -173.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -77.3 -152.23 0.04 OUTLIER 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 122.253 1.969 . . . . 0.0 109.989 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.09 -30.98 71.38 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 120.871 -1.143 . . . . 0.0 113.198 -178.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -91.74 74.26 1.54 Allowed Glycine 0 C--N 1.339 0.737 0 C-N-CA 126.799 2.142 . . . . 0.0 112.271 174.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 55.1 p-90 -109.71 -19.56 13.13 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 117.237 2.31 . . . . 0.0 117.237 -174.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -87.04 116.62 25.21 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 119.821 1.192 . . . . 0.0 111.198 -167.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.8 p -67.41 131.36 32.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 119.449 1.022 . . . . 0.0 112.306 -177.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.3 mmt180 -139.36 162.01 36.06 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.109 1.763 . . . . 0.0 111.469 -173.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . 0.804 ' HD1' ' H ' ' A' ' 16' ' ' SER . 2.1 t-80 -142.78 165.01 28.56 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.118 1.367 . . . . 0.0 111.74 179.726 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.804 ' H ' ' HD1' ' A' ' 15' ' ' HIS . 68.4 m -136.08 173.9 11.21 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.27 1.428 . . . . 0.0 112.877 -169.349 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 10.4 p-10 -81.92 -11.51 58.86 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 115.581 1.697 . . . . 0.0 115.581 -171.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.3 t -127.27 -31.84 2.52 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -178.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.5 tttp -60.14 155.16 17.86 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.513 1.525 . . . . 0.0 112.208 170.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -106.63 -28.2 10.37 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.126 0.97 . . . . 0.0 113.502 175.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 8.5 mp -95.64 160.49 30.25 Favored Pre-proline 0 N--CA 1.476 0.843 0 C-N-CA 125.604 1.562 . . . . 0.0 111.972 175.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -79.11 174.26 12.34 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 123.324 2.683 . . . . 0.0 112.272 168.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 39.7 p90 -147.75 152.22 37.37 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.72 2.408 . . . . 0.0 109.876 172.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 -87.06 141.51 28.61 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.129 -0.982 . . . . 0.0 110.689 173.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -124.16 146.15 48.85 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.78 1.632 . . . . 0.0 111.52 -170.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 57.4 t-20 -97.94 113.73 64.14 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 124.066 0.947 . . . . 0.0 111.401 177.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -70.41 -30.37 19.36 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 123.159 2.573 . . . . 0.0 113.552 178.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.28 -51.25 10.42 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.231 0.923 . . . . 0.0 112.036 -176.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 23.2 m -117.55 125.63 51.15 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.584 1.554 . . . . 0.0 107.917 177.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 46.4 mtm105 -62.89 107.56 1.01 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.956 1.253 . . . . 0.0 109.873 177.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -174.06 162.77 3.86 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 129.304 3.042 . . . . 0.0 109.127 -173.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 30.9 p -128.51 175.66 8.36 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.781 1.233 . . . . 0.0 114.234 -179.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.55 145.24 25.0 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 127.298 2.239 . . . . 0.0 109.06 174.057 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 2.0 m-90 -111.7 -23.26 10.74 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 121.295 -0.878 . . . . 0.0 113.162 -155.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -157.77 167.41 14.55 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 131.545 3.938 . . . . 0.0 106.373 -175.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -62.12 120.09 7.51 Favored 'Trans proline' 0 CA--C 1.551 1.328 0 CA-C-N 121.954 1.734 . . . . 0.0 110.201 172.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -85.37 -167.99 0.46 Allowed 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 124.391 3.394 . . . . 0.0 112.486 -171.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -75.06 -47.0 31.03 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 121.282 -0.886 . . . . 0.0 113.35 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -63.65 -13.08 39.3 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.03 1.332 . . . . 0.0 114.315 -175.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -71.0 164.94 24.52 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 127.872 2.469 . . . . 0.0 112.646 -171.114 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -110.05 24.87 12.45 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.267 -0.895 . . . . 0.0 112.482 -154.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.436 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 51.6 mtt -5.35 -45.39 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.508 1 C-N-CA 132.103 4.161 . . . . 0.0 120.059 -176.122 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -55.65 -42.66 75.34 Favored 'General case' 0 CA--C 1.55 0.96 0 CA-C-N 122.657 2.48 . . . . 0.0 112.564 170.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.3 m -73.33 -7.9 53.58 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 127.876 2.47 . . . . 0.0 113.25 172.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.436 ' HB3' ' HA ' ' A' ' 42' ' ' MET . 11.4 tp -121.71 -24.16 5.36 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 120.994 -1.066 . . . . 0.0 111.734 -163.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -57.81 -42.95 85.33 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 120.163 1.347 . . . . 0.0 110.091 163.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 21.7 ptp -61.83 -9.48 6.8 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.518 1.527 . . . . 0.0 114.521 172.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.0 t80 -109.65 -44.03 3.94 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.456 1.503 . . . . 0.0 112.885 176.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 12.2 mmt -78.22 -36.42 47.17 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.369 1.868 . . . . 0.0 113.328 -175.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -95.4 161.8 13.93 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.458 1.103 . . . . 0.0 112.557 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 38.0 p . . . . . 0 N--CA 1.479 1.016 0 N-CA-C 115.482 1.66 . . . . 0.0 115.482 -174.353 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.8 m . . . . . 0 N--CA 1.478 0.958 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 56.0 m-80 -72.17 135.82 46.27 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.658 0.742 . . . . 0.0 111.887 173.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 77.1 p -124.02 148.41 47.04 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 126.751 2.02 . . . . 0.0 107.349 174.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . 0.44 ' H ' ' CD1' ' A' ' 45' ' ' LEU . . . -76.62 2.47 58.54 Favored Glycine 0 CA--C 1.532 1.15 0 CA-C-O 118.681 -1.066 . . . . 0.0 114.545 157.257 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.7 mt -61.31 153.71 66.86 Favored Pre-proline 0 CA--C 1.541 0.611 0 CA-C-N 119.383 1.592 . . . . 0.0 110.012 -171.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -71.42 162.25 42.93 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 CA-C-N 120.009 1.039 . . . . 0.0 109.632 -176.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.77 -25.82 8.36 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 115.555 1.687 . . . . 0.0 115.555 -169.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -82.38 72.27 2.84 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 124.181 0.896 . . . . 0.0 111.119 166.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 2.1 p-90 -142.3 153.09 43.6 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.603 1.161 . . . . 0.0 114.113 169.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 174.72 124.96 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 130.589 3.556 . . . . 0.0 105.254 176.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 35.4 t -73.99 129.65 36.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 CA-C-N 121.329 1.877 . . . . 0.0 110.586 -174.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.0 mmt-85 -114.09 132.94 55.86 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 126.029 1.732 . . . . 0.0 111.349 171.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -102.85 25.45 9.27 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.564 1.546 . . . . 0.0 112.201 170.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.1 m -77.98 54.24 1.28 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.21 1.804 . . . . 0.0 114.151 -171.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -155.59 138.0 14.91 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 126.468 1.907 . . . . 0.0 108.452 -177.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 17.6 t -62.45 -32.88 73.82 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 125.715 1.606 . . . . 0.0 111.706 170.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -70.73 143.12 51.38 Favored 'General case' 0 CA--C 1.547 0.865 0 O-C-N 121.049 -1.032 . . . . 0.0 110.828 167.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -82.17 32.78 0.39 Allowed 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.366 1.466 . . . . 0.0 114.475 -165.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -107.6 157.88 34.71 Favored Pre-proline 0 N--CA 1.474 0.741 0 C-N-CA 125.821 1.648 . . . . 0.0 110.869 175.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -86.92 172.18 6.53 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 123.622 2.882 . . . . 0.0 110.329 164.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 49.0 p90 -142.21 165.54 27.15 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.027 1.331 . . . . 0.0 109.214 151.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -98.8 125.08 44.07 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 120.782 -1.199 . . . . 0.0 110.475 176.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -74.11 149.23 41.16 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 120.64 -1.288 . . . . 0.0 110.709 168.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -99.02 96.91 4.48 Favored Pre-proline 0 CA--C 1.545 0.765 0 C-N-CA 122.996 0.518 . . . . 0.0 110.365 173.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -66.49 -29.45 44.77 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.453 2.102 . . . . 0.0 112.519 171.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.54 -19.11 62.92 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 -174.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.5 m -174.27 130.31 0.37 Allowed 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 129.042 2.937 . . . . 0.0 106.476 177.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 55.5 mtt85 -61.33 108.55 0.95 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.946 0.898 . . . . 0.0 111.011 -170.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -170.98 -180.0 2.93 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 130.552 3.541 . . . . 0.0 106.752 -170.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 14.8 m -149.97 130.25 13.71 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 119.463 -2.023 . . . . 0.0 111.963 165.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 12.8 tpp180 -86.91 121.72 29.77 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 127.583 2.353 . . . . 0.0 110.557 -178.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -76.16 -32.99 59.35 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 127.105 2.162 . . . . 0.0 114.209 -168.339 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -166.21 168.9 7.09 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 127.304 2.241 . . . . 0.0 108.565 -172.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -55.66 124.75 17.06 Favored 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 122.69 2.26 . . . . 0.0 112.551 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -85.29 -168.86 0.54 Allowed 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 124.761 3.641 . . . . 0.0 111.644 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.0 -42.75 31.66 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.061 0.945 . . . . 0.0 113.461 177.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -78.87 5.64 11.0 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 -172.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.5 t -74.41 152.02 39.57 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.188 1.795 . . . . 0.0 112.241 177.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -105.14 48.3 0.84 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.384 1.074 . . . . 0.0 112.905 -155.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.419 ' O ' ' HE3' ' A' ' 46' ' ' LYS . 65.2 mtm -22.07 -47.2 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 118.792 2.886 . . . . 0.0 118.792 -169.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -51.65 -42.61 62.2 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 123.335 2.788 . . . . 0.0 113.328 175.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 55.9 m -75.07 -23.08 57.97 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.098 1.359 . . . . 0.0 112.023 173.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.44 ' CD1' ' H ' ' A' ' 6' ' ' GLY . 3.2 mm? -79.87 -19.84 47.33 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 116.781 -1.58 . . . . 0.0 113.139 171.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.419 ' HE3' ' O ' ' A' ' 42' ' ' MET . 8.0 mmpt? -69.01 -23.37 64.08 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 122.289 2.313 . . . . 0.0 111.751 -172.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.2 ptm -70.21 -17.89 63.16 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.485 1.514 . . . . 0.0 113.998 168.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 47.1 t80 -107.2 -61.75 1.51 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.967 2.507 . . . . 0.0 112.157 -171.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 27.9 mtp -66.74 -7.73 23.16 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.967 2.107 . . . . 0.0 114.489 -178.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -151.69 152.56 32.95 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.371 1.468 . . . . 0.0 109.997 163.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 6.4 t . . . . . 0 N--CA 1.474 0.741 0 CA-C-O 118.022 -0.989 . . . . 0.0 112.929 170.438 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.5 m . . . . . 0 N--CA 1.475 0.795 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -95.49 142.79 27.43 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 125.029 1.332 . . . . 0.0 109.514 159.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.483 ' HB ' ' H ' ' A' ' 7' ' ' LEU . 76.2 p -133.93 144.14 48.65 Favored 'General case' 0 CA--C 1.514 -0.416 0 C-N-CA 126.085 1.754 . . . . 0.0 108.814 174.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . 0.496 ' H ' HD23 ' A' ' 45' ' ' LEU . . . -78.44 3.11 64.15 Favored Glycine 0 CA--C 1.534 1.249 0 CA-C-O 119.015 -0.88 . . . . 0.0 113.141 155.143 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.483 ' H ' ' HB ' ' A' ' 5' ' ' THR . 37.6 mt -61.91 153.78 71.13 Favored Pre-proline 0 CA--C 1.545 0.775 0 CA-C-N 119.881 1.841 . . . . 0.0 110.594 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -80.52 -149.5 0.04 OUTLIER 'Trans proline' 0 CA--C 1.544 1.0 0 C-N-CA 122.695 2.263 . . . . 0.0 110.419 -176.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.24 4.65 0.2 Allowed 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 115.825 1.787 . . . . 0.0 115.825 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -127.92 97.34 0.45 Allowed Glycine 0 C--N 1.338 0.648 0 C-N-CA 127.115 2.293 . . . . 0.0 109.501 171.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 61.8 p-90 -139.47 -23.84 0.87 Allowed 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 116.445 2.017 . . . . 0.0 116.445 -165.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -83.14 105.22 13.94 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 119.131 0.878 . . . . 0.0 109.366 -169.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 6.1 p -70.49 128.18 33.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 CA-C-N 119.219 0.918 . . . . 0.0 112.732 -169.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -128.46 165.09 21.34 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.767 2.027 . . . . 0.0 110.895 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 3.1 p80 -168.02 -179.52 4.17 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 126.121 1.769 . . . . 0.0 112.06 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.2 m -145.95 166.42 26.07 Favored 'General case' 0 N--CA 1.476 0.868 0 O-C-N 120.48 -1.387 . . . . 0.0 112.499 177.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -60.13 -44.22 95.07 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.844 1.257 . . . . 0.0 113.812 -174.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.5 m -87.16 -5.82 58.86 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.527 1.131 . . . . 0.0 112.751 174.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -133.8 67.75 1.51 Allowed 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.566 1.546 . . . . 0.0 110.642 -174.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -65.37 -24.81 67.34 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.407 1.483 . . . . 0.0 113.892 -174.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -74.14 119.41 76.19 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 123.819 0.847 . . . . 0.0 108.866 178.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -76.99 166.32 26.96 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 123.145 2.564 . . . . 0.0 113.98 -165.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 44.1 p90 -137.48 146.08 43.82 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 126.154 1.782 . . . . 0.0 110.959 171.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -93.65 118.46 31.41 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.157 -0.964 . . . . 0.0 110.578 178.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -81.33 138.67 35.65 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.719 1.208 . . . . 0.0 112.055 -175.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -92.69 117.83 67.73 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 124.424 1.089 . . . . 0.0 109.101 172.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -69.87 -46.1 1.3 Allowed 'Trans proline' 0 C--N 1.35 0.623 0 C-N-CA 121.907 1.738 . . . . 0.0 112.664 179.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -90.73 9.48 29.79 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 115.254 1.576 . . . . 0.0 115.254 -170.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 92.6 m -151.85 140.89 21.19 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.906 1.683 . . . . 0.0 109.715 -176.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 64.7 mtp85 -70.95 95.71 1.21 Allowed 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.593 0.757 . . . . 0.0 108.994 168.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -174.66 157.42 2.53 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.608 1.963 . . . . 0.0 110.452 -169.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.3 p -139.84 133.19 29.97 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 123.804 0.842 . . . . 0.0 110.394 159.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 4.3 tpp180 -81.87 117.31 22.04 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 122.231 1.015 . . . . 0.0 109.767 174.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -88.25 -22.25 24.05 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.573 1.549 . . . . 0.0 113.975 -170.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -160.55 156.28 22.13 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 127.608 2.363 . . . . 0.0 108.537 -164.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.32 119.46 6.46 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.058 2.505 . . . . 0.0 112.141 -170.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_endo -84.07 -168.04 0.51 Allowed 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 124.628 3.552 . . . . 0.0 111.92 -177.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -88.21 -31.43 19.08 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.062 1.345 . . . . 0.0 112.896 171.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -69.83 -3.13 14.32 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 125.302 1.441 . . . . 0.0 113.492 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.1 t -80.92 159.4 24.97 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.743 2.017 . . . . 0.0 112.112 176.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -123.68 59.7 1.11 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 127.151 2.18 . . . . 0.0 111.333 -162.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.2 mpp? -32.92 -38.15 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 116.922 2.193 . . . . 0.0 116.922 173.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.09 -40.5 67.29 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 121.269 1.85 . . . . 0.0 113.002 171.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 55.2 m -80.46 -26.31 38.39 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.918 1.687 . . . . 0.0 111.712 168.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.496 HD23 ' H ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -94.1 -24.57 17.52 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 -161.558 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.75 -13.79 62.46 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 121.744 2.066 . . . . 0.0 112.101 172.361 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 23.7 mmt -71.15 -12.17 61.34 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.171 0.988 . . . . 0.0 113.518 164.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -113.1 -50.82 2.86 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.213 1.805 . . . . 0.0 112.118 -179.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 82.8 mmm -77.09 -4.28 43.57 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.696 1.998 . . . . 0.0 114.174 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -148.28 172.66 14.01 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.325 1.85 . . . . 0.0 109.856 170.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 3.9 t . . . . . 0 N--CA 1.478 0.949 0 C-N-CA 124.935 1.294 . . . . 0.0 110.198 177.478 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 14.9 m . . . . . 0 N--CA 1.475 0.787 0 CA-C-O 120.734 0.302 . . . . 0.0 111.759 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -98.55 122.08 41.3 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.435 1.094 . . . . 0.0 109.525 168.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 32.6 p -117.02 124.15 48.61 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.343 1.457 . . . . 0.0 108.701 -175.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -69.78 41.45 0.43 Allowed Glycine 0 CA--C 1.532 1.128 0 CA-C-O 118.768 -1.018 . . . . 0.0 115.381 158.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.1 mt -85.67 168.18 21.07 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 125.858 1.663 . . . . 0.0 110.432 179.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -75.26 -157.29 0.06 OUTLIER 'Trans proline' 0 CA--C 1.548 1.196 0 C-N-CA 122.576 2.184 . . . . 0.0 111.197 176.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.02 -33.98 74.12 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.541 -1.35 . . . . 0.0 112.645 173.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -80.24 62.25 4.29 Favored Glycine 0 CA--C 1.526 0.772 0 C-N-CA 125.522 1.534 . . . . 0.0 112.398 171.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 36.0 p-90 -108.14 -17.65 13.97 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 115.445 1.646 . . . . 0.0 115.445 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -72.45 103.22 3.41 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 119.282 0.946 . . . . 0.0 110.113 -167.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.3 p -67.86 120.85 15.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-N 118.589 0.632 . . . . 0.0 110.708 -174.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -107.12 139.12 42.03 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.852 1.261 . . . . 0.0 108.812 166.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 3.6 p80 -157.19 -178.95 7.74 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.53 1.132 . . . . 0.0 111.523 -169.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.6 m -135.49 174.18 10.89 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.318 1.447 . . . . 0.0 111.608 177.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -112.21 -27.62 8.27 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.729 1.211 . . . . 0.0 111.747 166.058 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.8 m -82.2 -6.16 59.01 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.534 1.134 . . . . 0.0 113.538 171.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -133.75 165.26 25.37 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 128.231 2.613 . . . . 0.0 108.794 163.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 49.3 t-20 -136.94 65.79 1.49 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.142 0.977 . . . . 0.0 111.947 -179.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -156.17 123.99 2.82 Favored Pre-proline 0 CA--C 1.549 0.906 0 C-N-CA 125.015 1.326 . . . . 0.0 109.43 173.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -88.6 168.21 5.98 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.73 2.953 . . . . 0.0 112.634 -173.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 44.4 p90 -139.19 132.71 30.32 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.887 0.875 . . . . 0.0 110.759 156.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -86.73 116.51 24.87 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.943 0.897 . . . . 0.0 109.242 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -101.19 142.62 32.35 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.567 1.147 . . . . 0.0 112.61 -165.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 58.5 t-20 -98.53 114.78 65.68 Favored Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 124.975 1.31 . . . . 0.0 109.3 166.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -81.34 -23.13 5.31 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 123.371 2.714 . . . . 0.0 114.298 178.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.85 -33.11 46.16 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.384 0.993 . . . . 0.0 112.115 -176.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 70.9 m -134.56 110.74 9.54 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 126.201 1.8 . . . . 0.0 106.36 170.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.3 mtt85 -57.24 106.9 0.37 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.615 0.766 . . . . 0.0 111.025 -172.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -166.6 153.65 9.24 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.208 1.803 . . . . 0.0 109.896 -168.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 97.4 p -124.11 163.64 21.08 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 114.439 1.274 . . . . 0.0 114.439 178.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.37 152.05 48.07 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 128.632 2.773 . . . . 0.0 108.483 176.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -125.3 -26.88 3.56 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -153.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 -154.15 170.49 8.36 Favored Pre-proline 0 CA--C 1.552 1.033 0 C-N-CA 130.181 3.392 . . . . 0.0 106.316 177.286 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -54.11 122.05 10.74 Favored 'Trans proline' 0 CA--C 1.546 1.118 0 C-N-CA 122.803 2.335 . . . . 0.0 112.129 172.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -90.29 -162.1 0.11 Allowed 'Trans proline' 0 CA--C 1.546 1.082 0 C-N-CA 124.215 3.276 . . . . 0.0 110.658 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -102.1 -27.06 13.13 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -178.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -80.87 10.1 5.49 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 125.637 1.575 . . . . 0.0 113.19 177.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -77.08 -177.94 4.75 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 129.687 3.195 . . . . 0.0 112.924 -177.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -90.42 -54.27 4.08 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-O 122.975 1.369 . . . . 0.0 109.548 -175.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 8.7 ttp 86.6 -43.0 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 129.711 3.204 . . . . 0.0 114.078 170.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -64.8 -48.37 74.7 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 121.494 1.952 . . . . 0.0 111.904 178.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 16.0 m -60.72 -21.58 63.09 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 125.656 1.582 . . . . 0.0 111.463 167.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 11.1 tp -93.69 -21.66 19.21 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 118.014 -0.993 . . . . 0.0 111.197 -170.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.434 ' HA ' ' HE2' ' A' ' 46' ' ' LYS . 7.9 mmpt? -60.97 -40.62 94.09 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 120.889 1.677 . . . . 0.0 111.229 171.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.7 ptt? -67.88 6.95 0.59 Allowed 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 172.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -124.11 -44.4 2.04 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.106 1.762 . . . . 0.0 112.572 172.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 92.4 mtp -66.25 -24.67 66.63 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.819 2.048 . . . . 0.0 112.496 177.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -128.61 158.44 38.48 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.588 1.555 . . . . 0.0 111.772 172.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 87.1 m . . . . . 0 N--CA 1.474 0.755 0 C-N-CA 125.167 1.387 . . . . 0.0 108.625 168.608 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.0 m . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 120.371 0.129 . . . . 0.0 110.87 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -84.1 122.59 29.02 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 122.07 -0.393 . . . . 0.0 110.351 172.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 73.7 p -126.5 146.68 50.02 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.268 1.427 . . . . 0.0 108.396 168.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -80.94 16.32 16.22 Favored Glycine 0 CA--C 1.532 1.148 0 N-CA-C 115.537 0.975 . . . . 0.0 115.537 150.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.4 mt -68.82 157.41 88.86 Favored Pre-proline 0 CA--C 1.548 0.894 0 CA-C-N 119.995 1.898 . . . . 0.0 110.292 -176.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -73.98 -170.48 0.71 Allowed 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 122.927 2.418 . . . . 0.0 109.494 177.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.43 -23.15 9.16 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -175.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -88.45 77.47 1.82 Allowed Glycine 0 CA--C 1.527 0.833 0 C-N-CA 126.173 1.844 . . . . 0.0 111.864 165.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 1.7 p90 -110.83 -8.69 14.51 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 -177.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -89.18 110.25 21.02 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 120.228 1.376 . . . . 0.0 111.338 -172.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.6 p -61.15 136.72 24.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 O-C-N 121.101 -1.0 . . . . 0.0 112.658 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -133.28 112.97 12.1 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.892 1.677 . . . . 0.0 109.848 174.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 31.1 p80 -103.77 155.2 18.78 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.415 1.086 . . . . 0.0 112.122 173.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 99.4 p -161.35 158.2 26.57 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 125.126 1.371 . . . . 0.0 110.707 -172.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.9 p30 -75.27 -18.91 59.96 Favored 'General case' 0 CA--C 1.548 0.878 0 O-C-N 120.416 -1.428 . . . . 0.0 113.538 177.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.7 m -75.86 -30.05 58.76 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.456 1.502 . . . . 0.0 112.811 -175.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -109.08 146.11 34.54 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.262 1.425 . . . . 0.0 111.239 -176.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -88.69 12.29 15.22 Favored 'General case' 0 CA--C 1.555 1.15 0 N-CA-C 114.313 1.227 . . . . 0.0 114.313 -178.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -166.33 159.26 12.16 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 127.335 2.254 . . . . 0.0 109.338 172.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -75.16 169.45 22.53 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.964 2.443 . . . . 0.0 111.576 -178.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 52.9 p90 -126.49 148.05 49.74 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.404 1.082 . . . . 0.0 111.125 168.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -103.73 107.25 18.03 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.582 0.753 . . . . 0.0 109.836 -175.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -95.3 149.75 21.0 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.929 1.692 . . . . 0.0 112.959 -165.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 61.0 t-20 -99.34 113.73 65.04 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 125.135 1.374 . . . . 0.0 110.018 171.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.2 -29.67 14.06 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.871 2.381 . . . . 0.0 113.533 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -80.91 -38.24 28.25 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -171.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 92.2 m -127.85 138.92 52.87 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.264 1.826 . . . . 0.0 107.898 169.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 84.8 mtm-85 -61.67 104.43 0.43 Allowed 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.127 0.876 . . . . 0.0 111.071 178.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -163.62 153.56 15.16 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.915 1.286 . . . . 0.0 111.983 178.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 31.4 t -133.69 152.75 51.96 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.369 1.467 . . . . 0.0 111.093 176.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.7 tpp180 -128.0 136.82 51.81 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.612 1.565 . . . . 0.0 110.486 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -126.11 0.88 7.19 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.587 1.555 . . . . 0.0 113.324 -157.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -169.17 156.28 6.69 Favored Pre-proline 0 CA--C 1.544 0.714 0 C-N-CA 128.772 2.829 . . . . 0.0 107.69 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -62.09 113.37 1.85 Allowed 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.282 2.655 . . . . 0.0 110.483 175.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -85.56 159.28 10.8 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.773 2.315 . . . . 0.0 112.253 -171.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.48 -22.02 41.2 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 178.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -81.36 -15.32 55.63 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 126.279 1.832 . . . . 0.0 113.797 -179.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.62 179.01 4.97 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.597 1.559 . . . . 0.0 112.989 -170.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -130.12 51.33 2.11 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 122.105 0.955 . . . . 0.0 111.363 -160.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.41 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 32.6 mtt -27.3 -42.28 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 128.195 2.598 . . . . 0.0 116.113 169.62 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -48.24 -42.44 30.39 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 121.316 1.871 . . . . 0.0 113.751 173.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.3 m -82.87 -26.25 31.76 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 127.216 2.207 . . . . 0.0 112.399 173.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.41 ' HB3' ' HA ' ' A' ' 42' ' ' MET . 43.9 tp -109.9 -16.51 13.84 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 124.423 1.089 . . . . 0.0 112.244 -151.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.33 -34.17 66.32 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.673 -1.267 . . . . 0.0 111.336 159.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.7 mmt -60.9 -22.31 64.21 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.614 0.766 . . . . 0.0 112.751 173.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -103.51 -36.05 8.1 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.306 1.842 . . . . 0.0 112.801 -177.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 29.2 mtp -95.34 -1.37 51.38 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.046 1.738 . . . . 0.0 114.824 -178.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -151.11 67.24 0.91 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.188 1.795 . . . . 0.0 111.686 170.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 2.1 t . . . . . 0 N--CA 1.477 0.905 0 N-CA-C 115.139 1.533 . . . . 0.0 115.139 -172.095 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 3.4 m . . . . . 0 N--CA 1.476 0.844 0 N-CA-C 110.606 -0.146 . . . . 0.0 110.606 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 -69.61 123.46 21.39 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 121.777 -0.577 . . . . 0.0 110.386 175.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 73.9 p -127.99 149.69 50.24 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.666 1.586 . . . . 0.0 108.304 173.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -77.57 6.04 48.25 Favored Glycine 0 CA--C 1.529 0.938 0 CA-C-O 118.223 -1.321 . . . . 0.0 115.125 155.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 27.9 mt -62.13 150.2 84.58 Favored Pre-proline 0 CA--C 1.544 0.714 0 CA-C-N 120.141 1.971 . . . . 0.0 111.986 -168.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -70.47 159.95 51.15 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 122.17 1.913 . . . . 0.0 109.868 -176.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -52.31 -35.62 51.02 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 116.717 2.117 . . . . 0.0 116.717 -154.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -93.22 74.0 1.26 Allowed Glycine 0 CA--C 1.524 0.655 0 C-N-CA 125.894 1.711 . . . . 0.0 111.362 -177.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 11.4 p-90 -136.04 154.19 51.12 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.933 1.293 . . . . 0.0 113.556 178.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -169.76 128.07 0.93 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 129.575 3.15 . . . . 0.0 104.578 177.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.9 t -79.93 130.6 35.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 CA-C-N 120.044 1.293 . . . . 0.0 109.814 -171.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.1 mmt180 -138.07 156.95 47.27 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.808 1.243 . . . . 0.0 111.839 177.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 10.7 p-80 -168.59 152.29 5.63 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.243 1.017 . . . . 0.0 113.156 -169.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 82.6 p -171.37 163.68 6.96 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 125.772 1.629 . . . . 0.0 109.987 -170.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -65.25 -5.74 7.86 Favored 'General case' 0 CA--C 1.554 1.128 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 179.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.6 t -73.77 -19.96 60.62 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.131 1.772 . . . . 0.0 113.089 170.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.81 138.87 24.65 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 120.436 -1.415 . . . . 0.0 113.905 -178.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -76.11 -40.85 51.98 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.179 0.992 . . . . 0.0 112.854 -170.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 7.9 mp -100.92 155.21 36.58 Favored Pre-proline 0 CA--C 1.54 0.573 0 C-N-CA 125.157 1.383 . . . . 0.0 109.91 169.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -63.29 155.21 63.2 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 122.91 2.407 . . . . 0.0 111.113 175.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 34.0 p90 -116.04 140.87 48.83 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 125.832 1.653 . . . . 0.0 109.429 171.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -94.9 95.67 8.8 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.9 0.857 . . . . 0.0 108.745 -175.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -63.21 137.9 58.37 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.929 1.692 . . . . 0.0 110.171 177.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 56.3 t-20 -82.58 116.9 66.44 Favored Pre-proline 0 CA--C 1.553 1.079 0 O-C-N 121.531 -0.731 . . . . 0.0 110.044 173.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.9 -19.87 34.89 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 123.611 2.874 . . . . 0.0 114.358 -179.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -88.45 -97.71 0.09 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.708 0.803 . . . . 0.0 109.865 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.8 p -63.91 150.54 44.77 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.367 1.467 . . . . 0.0 110.696 171.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -79.74 95.25 5.92 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 121.602 -0.686 . . . . 0.0 109.243 -178.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -159.73 -177.65 6.51 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.223 1.409 . . . . 0.0 110.243 -179.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 80.3 p -158.09 146.15 18.64 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 120.422 -1.424 . . . . 0.0 112.595 177.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 15.8 tpp180 -101.26 131.69 47.15 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 127.071 2.148 . . . . 0.0 108.953 172.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 1.4 m-90 -86.05 -37.38 18.96 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 122.276 1.036 . . . . 0.0 113.476 -163.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -154.11 162.96 25.58 Favored Pre-proline 0 CA--C 1.54 0.577 0 C-N-CA 129.112 2.965 . . . . 0.0 106.709 -167.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -57.95 117.72 4.48 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 122.343 2.029 . . . . 0.0 110.547 176.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -78.79 168.63 20.71 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 124.077 3.185 . . . . 0.0 111.165 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.27 -30.28 69.35 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.648 -0.657 . . . . 0.0 112.656 170.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -65.17 -9.44 23.17 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 127.092 2.157 . . . . 0.0 115.781 -176.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.2 t -87.72 167.45 13.84 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 126.02 1.728 . . . . 0.0 112.748 -170.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -95.53 54.54 1.59 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 125.506 1.522 . . . . 0.0 110.687 -176.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 33.5 mtt -30.36 -39.0 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 127.416 2.286 . . . . 0.0 115.921 173.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -54.53 -39.19 67.41 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 121.505 1.957 . . . . 0.0 114.01 172.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 84.8 m -82.37 -16.02 50.66 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 127.616 2.366 . . . . 0.0 112.735 172.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -123.48 -20.17 5.65 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.218 -0.926 . . . . 0.0 112.833 -151.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.63 -26.34 66.95 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 120.16 -1.588 . . . . 0.0 111.524 156.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 4.4 mmt -67.09 -19.55 65.66 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.758 0.823 . . . . 0.0 112.906 170.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -104.39 -54.02 2.61 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.31 1.444 . . . . 0.0 112.139 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 68.5 mmm -65.48 -17.43 64.55 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.598 1.959 . . . . 0.0 113.448 -179.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -139.14 178.93 6.82 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.337 1.855 . . . . 0.0 110.197 172.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 20.2 p . . . . . 0 N--CA 1.476 0.871 0 C-N-CA 124.369 1.067 . . . . 0.0 112.265 -172.604 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.477 0.923 0 CA-C-O 120.948 0.404 . . . . 0.0 111.94 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -82.94 93.78 7.6 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.283 1.033 . . . . 0.0 110.337 172.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.5 p -100.15 135.0 42.25 Favored 'General case' 0 CA--C 1.506 -0.731 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 176.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -76.29 26.39 1.55 Allowed Glycine 0 CA--C 1.532 1.127 0 CA-C-O 117.924 -1.487 . . . . 0.0 116.101 151.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 16.0 mt -71.58 160.36 82.81 Favored Pre-proline 0 CA--C 1.547 0.84 0 CA-C-N 121.135 2.468 . . . . 0.0 110.533 -178.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -72.94 168.98 23.28 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 120.992 1.128 . . . . 0.0 111.147 -175.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.35 -21.15 5.27 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 118.305 2.706 . . . . 0.0 118.305 -157.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -138.32 94.34 0.21 Allowed Glycine 0 N--CA 1.468 0.777 0 C-N-CA 124.87 1.224 . . . . 0.0 112.692 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 33.5 p-90 -135.06 159.59 41.02 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.095 1.358 . . . . 0.0 114.028 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -150.43 150.28 31.15 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 127.418 2.287 . . . . 0.0 107.829 166.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.3 p -87.85 146.75 5.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 CA-C-N 120.774 1.625 . . . . 0.0 110.852 172.342 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -127.98 113.17 15.49 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.73 1.612 . . . . 0.0 110.779 174.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 45.1 p-80 -78.7 149.61 32.73 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.659 0.784 . . . . 0.0 110.92 160.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.9 t -162.81 132.59 4.39 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 121.27 -0.894 . . . . 0.0 112.015 178.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 10.5 m-20 -68.28 -7.92 35.04 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.708 1.203 . . . . 0.0 113.337 176.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.8 t -75.59 -19.5 59.21 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.956 1.303 . . . . 0.0 112.833 167.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -116.78 161.02 19.92 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.67 1.588 . . . . 0.0 111.863 -170.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -89.69 -39.1 13.41 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.625 0.77 . . . . 0.0 112.247 173.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -104.69 176.43 1.75 Allowed Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 127.127 2.171 . . . . 0.0 110.102 176.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -69.58 157.91 59.06 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.456 2.104 . . . . 0.0 110.832 155.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 47.6 p90 -120.07 163.89 16.98 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.889 0.876 . . . . 0.0 109.963 157.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.9 m-85 -101.61 137.88 39.33 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 120.938 -1.102 . . . . 0.0 110.973 176.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -97.42 150.59 20.86 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.724 1.209 . . . . 0.0 109.977 169.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -115.2 99.13 51.95 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 124.486 1.114 . . . . 0.0 110.97 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -69.31 -22.75 33.7 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 122.419 2.079 . . . . 0.0 115.05 -173.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -75.81 -41.58 52.36 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 119.762 1.164 . . . . 0.0 113.517 -177.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 23.0 m -131.19 100.42 5.19 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 168.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -47.82 110.12 0.29 Allowed 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.533 1.533 . . . . 0.0 112.198 -171.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -174.23 177.14 2.34 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 127.834 2.453 . . . . 0.0 107.839 -169.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 69.5 p -117.69 171.53 7.97 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.898 -1.127 . . . . 0.0 112.846 170.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.5 139.69 40.69 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 127.13 2.172 . . . . 0.0 109.103 175.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -126.02 -46.57 1.67 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.155 -0.929 . . . . 0.0 112.444 -152.228 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -144.56 150.84 48.78 Favored Pre-proline 0 CA--C 1.542 0.657 0 C-N-CA 127.917 2.487 . . . . 0.0 107.478 -179.438 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -56.53 115.38 2.44 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 123.597 2.865 . . . . 0.0 112.956 -159.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -74.43 163.81 35.38 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 123.657 2.905 . . . . 0.0 112.147 -172.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.11 -21.85 65.84 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 -172.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -78.82 -21.38 47.79 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.127 1.371 . . . . 0.0 112.899 172.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -71.18 156.47 39.53 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.528 1.531 . . . . 0.0 112.926 -170.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -108.95 49.53 0.81 Allowed 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.544 1.538 . . . . 0.0 110.723 -164.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.402 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 72.3 mtm -25.29 -47.42 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 127.029 2.132 . . . . 0.0 115.296 173.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -50.19 -46.82 54.64 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 121.694 2.043 . . . . 0.0 114.5 174.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 99.2 m -68.39 -38.44 81.34 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.189 1.796 . . . . 0.0 111.665 169.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.402 ' HB3' ' HA ' ' A' ' 42' ' ' MET . 54.2 tp -94.27 -16.68 23.36 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 124.67 1.188 . . . . 0.0 110.964 -153.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.09 -28.78 66.82 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 120.512 -1.367 . . . . 0.0 112.093 161.23 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 20.3 mmt -65.46 -16.66 63.87 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 119.633 1.106 . . . . 0.0 112.509 172.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -105.61 -44.49 4.67 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.185 1.794 . . . . 0.0 112.701 177.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.6 mtp -78.61 -8.04 58.22 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.842 1.657 . . . . 0.0 113.607 -176.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -130.96 153.83 48.78 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.154 1.382 . . . . 0.0 112.044 175.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 9.7 t . . . . . 0 N--CA 1.476 0.842 0 C-N-CA 124.49 1.116 . . . . 0.0 111.766 179.175 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 15.9 m . . . . . 0 N--CA 1.476 0.84 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -81.45 136.06 35.65 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.983 0.913 . . . . 0.0 110.561 164.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 62.9 p -134.84 133.15 39.43 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.659 1.584 . . . . 0.0 108.43 178.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -66.58 16.41 0.27 Allowed Glycine 0 CA--C 1.531 1.038 0 N-CA-C 115.523 0.969 . . . . 0.0 115.523 157.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 28.3 mt -67.23 156.66 87.59 Favored Pre-proline 0 CA--C 1.549 0.92 0 CA-C-N 119.909 1.855 . . . . 0.0 110.648 -176.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -80.35 -133.08 0.01 OUTLIER 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 123.17 2.58 . . . . 0.0 110.017 -179.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.99 -26.12 67.4 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -102.22 86.65 0.58 Allowed Glycine 0 C--N 1.339 0.711 0 C-N-CA 126.275 1.893 . . . . 0.0 109.534 176.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 69.5 p-90 -127.06 -28.01 2.93 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 117.226 2.306 . . . . 0.0 117.226 -167.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -83.96 112.04 19.81 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.313 0.961 . . . . 0.0 110.489 -168.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 24.1 t -61.84 132.2 27.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 O-C-N 121.615 -0.678 . . . . 0.0 111.048 -177.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 60.7 mmt-85 -132.65 132.69 42.7 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.787 1.635 . . . . 0.0 110.567 174.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -130.7 2.51 4.47 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 115.065 1.506 . . . . 0.0 115.065 -172.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.6 t -72.71 82.11 1.14 Allowed 'General case' 0 N--CA 1.473 0.682 0 O-C-N 120.855 -1.153 . . . . 0.0 108.054 156.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -178.19 116.57 0.08 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 127.335 2.254 . . . . 0.0 109.381 -165.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.2 m -76.5 -2.18 30.94 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 115.901 1.815 . . . . 0.0 115.901 -170.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.452 ' HG3' ' H ' ' A' ' 20' ' ' ASN . 2.0 tppp? -71.42 179.64 2.87 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 119.522 1.056 . . . . 0.0 111.983 178.257 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.452 ' H ' ' HG3' ' A' ' 19' ' ' LYS . 10.6 m120 -61.99 -43.11 99.54 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.7 1.6 . . . . 0.0 113.729 -175.042 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 10.3 mp -122.96 162.68 37.74 Favored Pre-proline 0 CA--C 1.547 0.827 0 C-N-CA 126.415 1.886 . . . . 0.0 110.866 -177.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.86 159.96 50.93 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 123.184 2.589 . . . . 0.0 111.098 168.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 34.1 p90 -108.21 146.08 33.31 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.504 1.121 . . . . 0.0 111.627 177.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -92.25 101.16 13.66 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 121.452 0.644 . . . . 0.0 109.377 177.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . 0.412 ' CE2' ' HA ' ' A' ' 27' ' ' PRO . 40.5 t80 -67.13 145.86 54.85 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.43 1.092 . . . . 0.0 111.8 -178.605 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -104.71 85.08 1.08 Allowed Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 125.944 1.697 . . . . 0.0 109.828 178.075 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.412 ' HA ' ' CE2' ' A' ' 25' ' ' PHE . 21.1 Cg_endo -62.39 -24.61 75.76 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.601 2.201 . . . . 0.0 115.694 -170.265 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.33 -13.64 60.13 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.129 1.159 . . . . 0.0 114.129 -179.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.7 m -169.54 124.44 0.82 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 127.082 2.153 . . . . 0.0 108.375 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 24.8 mmt85 -52.15 98.08 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.825 0 CA-C-O 122.702 1.239 . . . . 0.0 112.838 -174.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -163.67 178.05 8.24 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 127.572 2.349 . . . . 0.0 109.825 -174.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.3 p -149.48 174.01 12.95 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 120.531 -1.355 . . . . 0.0 113.877 173.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 20.3 tpp180 -138.5 158.7 43.76 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 128.218 2.607 . . . . 0.0 107.948 171.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -140.48 -58.73 0.53 Allowed 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.777 -0.577 . . . . 0.0 111.305 -158.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -107.55 153.89 41.09 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 126.003 1.721 . . . . 0.0 109.446 166.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -69.17 121.95 8.78 Favored 'Trans proline' 0 CA--C 1.544 1.018 0 C-N-CA 123.337 2.691 . . . . 0.0 112.059 -167.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -83.88 166.27 13.24 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 124.47 3.447 . . . . 0.0 112.358 -172.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.32 -20.81 64.77 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 115.236 1.569 . . . . 0.0 115.236 -174.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -80.96 -7.54 59.55 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 125.177 1.391 . . . . 0.0 113.773 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -74.59 170.12 16.4 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.151 1.78 . . . . 0.0 114.726 -168.311 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -105.18 50.69 0.78 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.811 1.645 . . . . 0.0 110.965 -171.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 10.2 mtm -30.02 -35.54 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 127.164 2.186 . . . . 0.0 116.238 172.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.1 -27.35 69.04 Favored 'General case' 0 CA--C 1.553 1.092 0 CA-C-N 122.734 2.516 . . . . 0.0 114.183 175.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 69.4 m -94.52 -5.16 46.67 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 128.119 2.568 . . . . 0.0 112.297 171.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 26.1 tp -131.07 -20.2 2.78 Favored 'General case' 0 C--O 1.219 -0.528 0 O-C-N 120.844 -1.16 . . . . 0.0 111.69 -155.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.01 -36.32 76.96 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 120.607 1.549 . . . . 0.0 111.308 157.092 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 15.2 ptt? -67.65 -9.68 45.47 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.347 1.059 . . . . 0.0 113.485 171.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -104.66 -46.32 4.37 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.037 1.335 . . . . 0.0 112.077 173.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 83.4 mmm -72.85 -8.61 56.37 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 127.493 2.317 . . . . 0.0 113.536 -175.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -161.42 146.98 13.89 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.734 2.014 . . . . 0.0 109.679 166.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 22.3 m . . . . . 0 N--CA 1.474 0.77 0 O-C-N 121.441 -0.787 . . . . 0.0 110.304 -178.0 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 15.7 t . . . . . 0 N--CA 1.472 0.653 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 27.4 m120 -59.39 120.95 10.29 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 122.925 0.49 . . . . 0.0 110.731 173.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 75.5 p -113.11 149.48 33.47 Favored 'General case' 0 CA--C 1.509 -0.623 0 C-N-CA 125.308 1.443 . . . . 0.0 108.1 171.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . 0.499 ' H ' ' CD1' ' A' ' 45' ' ' LEU . . . -84.65 9.52 64.88 Favored Glycine 0 CA--C 1.534 1.266 0 CA-C-N 113.827 -1.533 . . . . 0.0 115.749 158.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.4 mt -65.59 150.56 95.93 Favored Pre-proline 0 CA--C 1.546 0.801 0 CA-C-N 118.946 1.373 . . . . 0.0 110.925 -168.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -77.45 177.58 8.67 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.896 1.731 . . . . 0.0 110.978 -175.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.93 -32.94 55.25 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 115.331 1.604 . . . . 0.0 115.331 -170.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -79.1 42.54 2.35 Favored Glycine 0 CA--C 1.533 1.175 0 CA-C-O 118.443 -1.198 . . . . 0.0 115.118 -177.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 1.3 p-90 -122.95 152.54 40.75 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 -176.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 179.51 119.91 0.05 Allowed 'General case' 0 CA--C 1.54 0.569 1 C-N-CA 131.753 4.021 . . . . 0.0 104.085 175.55 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 5.7 t -78.59 126.93 38.97 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 120.604 1.547 . . . . 0.0 110.979 -169.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -119.43 113.7 21.18 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.451 1.501 . . . . 0.0 110.319 172.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -88.03 163.68 16.16 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.244 1.017 . . . . 0.0 112.049 165.163 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.4 t -159.64 144.44 15.25 Favored 'General case' 0 N--CA 1.467 0.409 0 O-C-N 120.924 -1.11 . . . . 0.0 113.022 -168.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 60.5 m-20 -71.89 -7.74 50.26 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.694 0.798 . . . . 0.0 113.066 169.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.0 m -91.7 -14.64 29.67 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 120.787 -1.196 . . . . 0.0 113.511 175.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -123.71 146.79 48.0 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.637 1.108 . . . . 0.0 113.425 -162.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -81.6 -9.38 59.69 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 175.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 23.3 mt -140.98 167.9 15.96 Favored Pre-proline 0 CA--C 1.539 0.553 0 C-N-CA 126.936 2.095 . . . . 0.0 109.117 176.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -68.41 167.04 23.5 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 122.118 1.879 . . . . 0.0 110.207 163.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 39.8 p90 -126.84 157.85 38.19 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.889 1.275 . . . . 0.0 109.416 160.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -103.09 115.16 30.06 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.336 -0.852 . . . . 0.0 109.663 -177.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -76.03 134.29 40.14 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.569 1.148 . . . . 0.0 110.312 176.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 60.2 t-20 -87.54 114.23 57.89 Favored Pre-proline 0 CA--C 1.547 0.839 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 168.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -74.14 -34.64 4.75 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.072 1.848 . . . . 0.0 112.569 176.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -80.15 -19.23 47.69 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.023 1.12 . . . . 0.0 114.023 -171.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 26.3 m -147.63 143.83 27.97 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.847 1.659 . . . . 0.0 108.725 -174.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -70.52 44.07 0.07 Allowed 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 116.863 2.171 . . . . 0.0 116.863 -170.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.447 ' HG3' ' H ' ' A' ' 32' ' ' SER . 6.3 tp10 -129.07 -175.64 3.62 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.815 2.046 . . . . 0.0 111.312 -176.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.447 ' H ' ' HG3' ' A' ' 31' ' ' GLU . 78.1 p -145.68 164.96 30.15 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 126.068 1.747 . . . . 0.0 110.804 172.498 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.3 tpp180 -118.64 132.34 56.18 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.66 1.584 . . . . 0.0 109.307 177.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 1.8 m-90 -98.84 -47.54 5.25 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.472 0.709 . . . . 0.0 112.278 -156.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -128.56 173.31 5.73 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 127.259 2.224 . . . . 0.0 108.397 165.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -57.67 120.21 7.97 Favored 'Trans proline' 0 CA--C 1.55 1.313 0 C-N-CA 122.509 2.139 . . . . 0.0 111.872 172.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -81.18 167.21 17.95 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 125.211 3.941 . . . . 0.0 113.025 -173.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -69.93 -4.65 21.54 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 177.314 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -93.66 -6.08 47.18 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 127.469 2.307 . . . . 0.0 113.025 177.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.1 t -85.54 176.35 8.27 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.28 1.432 . . . . 0.0 113.171 -171.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -107.67 36.79 2.62 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.287 1.035 . . . . 0.0 111.8 -166.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 56.7 mtt -18.41 -43.33 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 130.29 3.436 . . . . 0.0 119.186 -173.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -52.28 -45.73 65.58 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-N 122.121 2.237 . . . . 0.0 112.222 170.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 23.6 m -74.65 -15.46 60.81 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 127.457 2.303 . . . . 0.0 112.894 173.221 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.499 ' CD1' ' H ' ' A' ' 6' ' ' GLY . 3.5 mm? -88.67 -17.17 30.56 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 120.127 1.33 . . . . 0.0 112.08 167.838 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.11 -17.74 62.56 Favored 'General case' 0 CA--C 1.553 1.062 0 CA-C-N 121.377 1.898 . . . . 0.0 111.931 -174.343 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 24.0 ptp -82.88 -7.52 59.65 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 127.864 2.466 . . . . 0.0 114.14 167.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -116.07 -55.07 2.44 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.65 1.98 . . . . 0.0 112.833 -173.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 93.5 mmm -68.85 5.77 1.04 Allowed 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 127.976 2.51 . . . . 0.0 113.439 173.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -158.66 151.06 21.69 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 128.346 2.659 . . . . 0.0 109.316 171.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 46.1 p . . . . . 0 N--CA 1.48 1.035 0 C-N-CA 125.828 1.651 . . . . 0.0 114.315 -166.489 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 25.9 m . . . . . 0 N--CA 1.48 1.031 0 CA-C-O 121.267 0.556 . . . . 0.0 111.854 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -81.64 136.51 35.52 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.291 1.036 . . . . 0.0 109.735 165.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 67.4 p -146.32 150.91 36.64 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-O 122.204 1.002 . . . . 0.0 110.434 170.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . 0.491 ' H ' ' CD1' ' A' ' 45' ' ' LEU . . . -92.42 18.71 53.93 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-N 113.974 -1.466 . . . . 0.0 114.796 156.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 16.5 mt -70.38 148.93 95.73 Favored Pre-proline 0 CA--C 1.546 0.796 0 CA-C-N 119.61 1.705 . . . . 0.0 110.919 -170.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -74.61 158.0 44.0 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 121.978 1.785 . . . . 0.0 110.538 -175.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.75 -11.77 5.86 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 117.195 2.294 . . . . 0.0 117.195 -160.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -94.37 59.66 1.91 Allowed Glycine 0 CA--C 1.53 0.995 0 C-N-CA 125.148 1.356 . . . . 0.0 111.871 171.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 9.7 p-90 -133.24 165.07 25.65 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 115.534 1.679 . . . . 0.0 115.534 -177.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 176.09 172.97 0.36 Allowed 'General case' 0 CA--C 1.543 0.676 1 C-N-CA 132.564 4.345 . . . . 0.0 106.127 -177.026 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.5 t -123.99 142.99 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 125.371 1.468 . . . . 0.0 110.072 -178.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -138.68 149.09 44.76 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.935 1.694 . . . . 0.0 110.596 177.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -141.94 162.74 34.72 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -169.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.4 t -173.37 151.29 1.97 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.283 1.833 . . . . 0.0 111.714 -177.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -63.95 -15.98 60.45 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.541 1.136 . . . . 0.0 112.525 167.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.4 t -66.27 -13.99 61.28 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.752 1.621 . . . . 0.0 113.921 -177.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.3 ptmt -150.42 161.88 41.64 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.028 1.331 . . . . 0.0 112.87 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -71.9 -35.1 69.61 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 -170.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.3 mp -122.51 173.51 4.15 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 127.431 2.292 . . . . 0.0 111.151 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -75.86 171.27 18.49 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 123.269 2.646 . . . . 0.0 111.737 169.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 46.2 p90 -126.24 162.49 25.32 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.894 1.678 . . . . 0.0 110.731 166.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -105.23 150.13 25.37 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 121.388 -0.82 . . . . 0.0 112.359 -176.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 84.2 t80 -136.13 143.42 44.51 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.515 1.126 . . . . 0.0 112.969 -168.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 62.8 t-20 -95.18 118.0 66.59 Favored Pre-proline 0 CA--C 1.556 1.185 0 C-N-CA 123.198 0.599 . . . . 0.0 111.319 170.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -75.15 -19.61 17.37 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.205 2.604 . . . . 0.0 114.414 174.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -93.29 -15.6 25.64 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -172.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 88.5 m -154.02 142.63 20.82 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 128.113 2.565 . . . . 0.0 107.485 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 49.1 mmm-85 -68.17 100.63 1.04 Allowed 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.496 1.044 . . . . 0.0 110.666 177.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -165.73 149.59 8.08 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.099 1.759 . . . . 0.0 110.495 176.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 57.5 p -114.97 -179.47 3.64 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.302 1.041 . . . . 0.0 113.192 169.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 17.8 tpp180 -149.65 137.73 20.46 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.734 1.613 . . . . 0.0 109.801 178.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -129.81 -33.13 1.83 Allowed 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.069 0.948 . . . . 0.0 112.987 -154.253 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -145.43 160.09 46.25 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 129.198 2.999 . . . . 0.0 106.887 177.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -67.69 121.42 8.48 Favored 'Trans proline' 0 CA--C 1.546 1.113 0 C-N-CA 122.008 1.805 . . . . 0.0 112.43 -167.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -77.6 165.32 27.23 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 124.063 3.175 . . . . 0.0 111.799 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.63 -41.18 76.7 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 179.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -71.37 -0.99 11.46 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.27 1.428 . . . . 0.0 114.46 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -85.52 157.17 20.49 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.231 1.013 . . . . 0.0 111.404 177.582 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -88.46 -29.38 20.21 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-O 121.934 0.873 . . . . 0.0 113.085 -163.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 43.6 mtt 69.57 -43.71 0.53 Allowed 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 129.792 3.237 . . . . 0.0 113.72 176.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -55.99 -52.29 64.72 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 120.009 1.277 . . . . 0.0 110.9 170.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.0 m -75.13 1.24 13.75 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 172.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.491 ' CD1' ' H ' ' A' ' 6' ' ' GLY . 2.7 mm? -104.12 -22.15 13.46 Favored 'General case' 0 CA--C 1.508 -0.655 0 O-C-N 120.257 -1.527 . . . . 0.0 113.963 169.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.29 -22.92 64.7 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 120.895 1.68 . . . . 0.0 111.082 -176.562 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 22.6 ptp -76.76 -6.12 50.93 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.484 2.314 . . . . 0.0 114.731 168.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -122.69 -58.1 1.69 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.21 1.804 . . . . 0.0 113.342 -169.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 54.9 mtp -67.66 -47.74 68.66 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.891 1.277 . . . . 0.0 111.178 -175.058 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -88.74 143.64 26.78 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 148.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 2.0 t . . . . . 0 N--CA 1.474 0.771 0 CA-C-O 121.318 0.58 . . . . 0.0 112.431 -176.129 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.5 m . . . . . 0 N--CA 1.473 0.697 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -74.3 143.65 44.89 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.435 1.094 . . . . 0.0 111.765 166.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.8 p -147.27 143.49 28.15 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.524 1.53 . . . . 0.0 109.369 169.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . 0.431 ' H ' ' CD1' ' A' ' 45' ' ' LEU . . . -82.19 7.67 63.15 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 125.864 1.697 . . . . 0.0 116.231 160.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 15.5 mt -65.11 155.85 82.81 Favored Pre-proline 0 CA--C 1.553 1.088 0 CA-C-N 119.703 1.751 . . . . 0.0 111.228 -169.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -70.16 174.57 9.65 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.071 1.847 . . . . 0.0 111.67 -175.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.11 -9.48 0.4 Allowed 'General case' 0 CA--C 1.554 1.101 0 N-CA-C 117.992 2.59 . . . . 0.0 117.992 -166.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -105.07 63.95 0.31 Allowed Glycine 0 CA--C 1.531 1.092 0 C-N-CA 125.715 1.626 . . . . 0.0 112.143 170.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 66.5 p-90 -109.91 146.75 34.63 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 -171.009 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 169.2 174.14 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.749 1 C-N-CA 132.314 4.245 . . . . 0.0 106.71 173.544 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.6 p -141.36 143.06 28.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 CA-C-N 119.581 1.082 . . . . 0.0 112.289 175.014 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -137.72 162.91 32.63 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.958 1.703 . . . . 0.0 111.189 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -145.86 172.34 13.48 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.98 1.312 . . . . 0.0 112.245 178.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.2 p -157.4 172.74 18.05 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.871 -1.143 . . . . 0.0 113.152 -177.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -73.48 -14.38 61.22 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 121.304 -0.872 . . . . 0.0 112.497 170.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 26.6 m -79.55 -31.04 41.95 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 -171.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -143.6 146.47 33.31 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.308 1.843 . . . . 0.0 110.056 -173.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -79.26 -27.64 42.34 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.222 1.409 . . . . 0.0 112.864 179.14 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -75.62 149.42 83.59 Favored Pre-proline 0 CA--C 1.546 0.824 0 O-C-N 121.4 -0.813 . . . . 0.0 111.043 170.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -73.99 -179.55 4.75 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 123.891 3.061 . . . . 0.0 110.302 167.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 54.1 p90 -135.64 140.81 44.83 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.041 0.936 . . . . 0.0 110.85 159.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -84.58 119.66 25.46 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -90.54 127.96 36.41 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 124.097 0.959 . . . . 0.0 111.699 -169.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 59.7 t-20 -89.94 118.0 68.56 Favored Pre-proline 0 CA--C 1.549 0.931 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 170.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -79.32 -33.91 1.24 Allowed 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.609 2.206 . . . . 0.0 113.034 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -90.77 -18.2 25.35 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -168.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.7 m -138.31 137.56 37.52 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 126.989 2.116 . . . . 0.0 107.643 172.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.25 88.79 0.85 Allowed 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.778 0.831 . . . . 0.0 110.143 -175.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -161.04 170.82 19.75 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.391 1.477 . . . . 0.0 110.383 -172.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 18.4 p -151.01 137.14 18.34 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.296 1.039 . . . . 0.0 111.227 173.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 19.7 tpp180 -99.29 149.38 23.18 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.534 1.934 . . . . 0.0 109.641 -178.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -120.79 -30.0 4.54 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.666 1.186 . . . . 0.0 113.502 -165.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -149.49 153.27 36.79 Favored Pre-proline 0 CA--C 1.541 0.626 0 C-N-CA 126.477 1.911 . . . . 0.0 109.636 -172.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -64.47 117.08 4.16 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 123.932 3.088 . . . . 0.0 112.171 -169.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -78.78 170.76 17.63 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.856 3.037 . . . . 0.0 111.852 -179.446 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.57 -32.7 74.46 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -178.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -76.15 -10.79 59.69 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 -177.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -76.86 178.59 6.74 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 125.977 1.711 . . . . 0.0 114.491 -171.118 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -126.57 58.64 1.39 Allowed 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.408 1.483 . . . . 0.0 111.991 -168.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -29.62 -40.62 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.075 1.75 . . . . 0.0 114.802 163.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 65.3 tt0 -45.51 -46.56 13.95 Favored 'General case' 0 CA--C 1.551 0.996 0 CA-C-N 120.479 1.49 . . . . 0.0 114.436 169.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 98.1 m -86.17 -13.21 47.71 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 127.556 2.342 . . . . 0.0 113.337 175.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.431 ' CD1' ' H ' ' A' ' 6' ' ' GLY . 37.1 tp -123.94 -17.36 6.31 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 121.3 -0.875 . . . . 0.0 112.211 -151.536 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.34 -39.17 72.39 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.371 -1.456 . . . . 0.0 109.749 153.227 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.8 mmt -63.36 8.13 0.08 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.062 1.745 . . . . 0.0 113.856 171.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -133.75 -44.28 0.81 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.233 1.813 . . . . 0.0 112.46 176.408 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.1 mtt -85.94 -21.82 27.72 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.719 2.008 . . . . 0.0 114.266 -177.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -165.37 66.29 0.12 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.281 1.832 . . . . 0.0 110.173 -177.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.8 m . . . . . 0 N--CA 1.473 0.696 0 C-N-CA 124.58 1.152 . . . . 0.0 113.768 -159.67 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.1 t . . . . . 0 N--CA 1.479 1.025 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -70.44 148.55 48.2 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.544 -0.722 . . . . 0.0 111.08 165.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 77.9 p -141.55 150.56 42.26 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.016 1.726 . . . . 0.0 108.057 173.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . 0.476 ' H ' ' CD1' ' A' ' 45' ' ' LEU . . . -87.35 28.8 5.53 Favored Glycine 0 CA--C 1.525 0.671 0 CA-C-O 117.548 -1.695 . . . . 0.0 114.359 154.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.7 mt -76.0 159.65 80.19 Favored Pre-proline 0 CA--C 1.547 0.828 0 CA-C-N 120.333 2.067 . . . . 0.0 110.75 -175.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -68.86 174.97 7.94 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 122.644 2.23 . . . . 0.0 111.575 -179.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.61 33.37 0.05 Allowed 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 116.28 1.956 . . . . 0.0 116.28 -167.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -166.08 99.25 0.16 Allowed Glycine 0 CA--C 1.532 1.153 0 C-N-CA 125.968 1.747 . . . . 0.0 111.872 170.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 19.4 p-90 -155.58 147.46 23.28 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 115.208 1.558 . . . . 0.0 115.208 -175.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -159.9 150.52 18.96 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 128.843 2.857 . . . . 0.0 106.809 168.364 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 18.9 t -102.85 120.2 52.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 CA-C-N 120.561 1.528 . . . . 0.0 110.862 -170.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.4 mmp_? -111.86 115.75 29.51 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.572 0.749 . . . . 0.0 111.623 176.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 4.0 p80 -155.74 158.94 39.03 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.775 2.03 . . . . 0.0 110.945 175.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 41.7 p -137.53 170.31 16.29 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.586 0.708 . . . . 0.0 112.815 -173.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -58.87 -24.71 62.52 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.13 0.972 . . . . 0.0 113.452 167.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 67.9 m -91.47 -6.42 52.68 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.205 1.402 . . . . 0.0 113.7 176.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -163.16 111.59 1.27 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.499 1.519 . . . . 0.0 111.034 173.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -64.06 -33.28 75.39 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.714 0.806 . . . . 0.0 112.888 175.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.44 114.3 20.93 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 123.186 0.595 . . . . 0.0 111.239 -167.613 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -77.37 139.61 18.68 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 123.208 2.605 . . . . 0.0 111.425 -172.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 55.9 p90 -105.19 135.34 46.74 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 153.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -90.15 100.4 13.23 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 121.67 -0.644 . . . . 0.0 110.212 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -63.5 129.4 40.03 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.049 1.34 . . . . 0.0 110.979 -179.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 58.4 t-20 -88.29 121.52 70.31 Favored Pre-proline 0 CA--C 1.556 1.193 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 174.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -79.27 -19.96 10.11 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 124.509 3.472 . . . . 0.0 113.559 178.124 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -91.67 -40.74 11.12 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.834 0.854 . . . . 0.0 111.969 -175.031 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.8 m -120.33 142.23 49.32 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.614 1.966 . . . . 0.0 109.104 175.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 -65.09 97.67 0.26 Allowed 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.277 1.031 . . . . 0.0 110.265 168.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -175.21 158.5 2.4 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.892 2.077 . . . . 0.0 109.542 -172.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 88.1 p -134.16 118.28 17.49 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 120.789 -1.194 . . . . 0.0 112.568 168.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 11.2 tpp180 -70.02 128.5 36.54 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.898 1.679 . . . . 0.0 109.576 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -90.57 -45.76 8.72 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.922 1.289 . . . . 0.0 111.743 -167.061 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -152.67 163.22 24.22 Favored Pre-proline 0 CA--C 1.549 0.919 0 C-N-CA 128.128 2.571 . . . . 0.0 107.898 -165.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -60.63 123.37 12.88 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 122.942 2.428 . . . . 0.0 113.578 -168.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -87.12 162.45 8.63 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 124.612 3.541 . . . . 0.0 113.413 178.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.51 -6.92 2.67 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 125.441 1.496 . . . . 0.0 114.917 172.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -104.89 9.08 34.82 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.344 1.858 . . . . 0.0 113.613 179.302 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -90.13 -179.91 5.77 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.551 1.94 . . . . 0.0 111.314 179.115 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -103.54 -34.12 8.78 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 120.149 -1.594 . . . . 0.0 112.663 -169.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' MET . . . . . 0.4 ' HA ' ' HB3' ' A' ' 45' ' ' LEU 0.252 90.3 mtp 60.76 -38.45 0.1 Allowed 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 129.118 2.967 . . . . 0.0 115.577 -170.994 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -64.07 -53.33 51.5 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 122.382 2.355 . . . . 0.0 111.498 -178.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.2 m -65.3 -7.15 12.0 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 125.563 1.545 . . . . 0.0 112.937 170.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.476 ' CD1' ' H ' ' A' ' 6' ' ' GLY . 10.8 tp -112.6 -27.18 8.3 Favored 'General case' 0 C--O 1.217 -0.613 0 O-C-N 120.894 -1.128 . . . . 0.0 112.256 -166.461 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.68 -40.13 96.12 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 120.853 1.661 . . . . 0.0 110.378 170.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 14.6 ptm -63.72 -6.96 6.34 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 126.052 1.741 . . . . 0.0 114.941 169.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -108.7 -50.47 3.01 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.356 1.463 . . . . 0.0 111.985 174.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 85.1 mtp -62.62 -36.89 84.24 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 127.167 2.187 . . . . 0.0 112.029 -178.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.56 88.08 7.02 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 156.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 15.0 t . . . . . 0 N--CA 1.475 0.818 0 C-N-CA 125.497 1.519 . . . . 0.0 114.591 -165.311 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 32.9 m . . . . . 0 N--CA 1.48 1.047 0 CA-C-O 121.494 0.664 . . . . 0.0 111.541 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -139.49 154.11 47.65 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.678 0.791 . . . . 0.0 109.836 160.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 62.2 p -133.78 126.71 31.2 Favored 'General case' 0 CA--C 1.51 -0.567 0 C-N-CA 124.811 1.244 . . . . 0.0 109.046 -174.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -66.83 5.93 2.24 Favored Glycine 0 CA--C 1.532 1.124 0 C-N-CA 125.229 1.395 . . . . 0.0 114.445 163.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 31.8 mt -63.19 155.98 70.99 Favored Pre-proline 0 CA--C 1.551 0.983 0 CA-C-N 118.917 1.358 . . . . 0.0 110.391 175.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -79.35 -135.62 0.02 OUTLIER 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 123.452 2.768 . . . . 0.0 110.495 -178.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.97 -26.21 66.7 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 120.806 -1.184 . . . . 0.0 114.144 177.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -93.04 83.53 1.09 Allowed Glycine 0 C--N 1.338 0.651 0 C-N-CA 125.609 1.576 . . . . 0.0 109.493 176.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -136.38 -13.18 1.8 Allowed 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 117.583 2.438 . . . . 0.0 117.583 -166.8 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -92.09 117.85 30.25 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.834 1.197 . . . . 0.0 109.809 -170.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 20.9 t -75.12 123.3 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 O-C-N 121.047 -1.033 . . . . 0.0 110.691 -164.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.6 mmt180 -130.75 153.27 49.19 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.05 1.34 . . . . 0.0 110.259 176.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 32.1 p-80 -144.02 169.77 17.19 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.375 1.07 . . . . 0.0 112.78 -173.1 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.2 t -162.62 149.85 13.47 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.1 1.36 . . . . 0.0 111.521 -176.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.2 m120 -67.23 -19.22 65.5 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.236 -0.915 . . . . 0.0 111.925 170.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.5 m -88.31 9.84 21.82 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 125.136 1.375 . . . . 0.0 113.368 177.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.8 tptm -147.84 125.15 11.55 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.912 1.285 . . . . 0.0 111.196 179.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 53.7 m-80 -66.61 -8.07 24.73 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 115.782 1.771 . . . . 0.0 115.782 -169.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -157.53 165.53 18.53 Favored Pre-proline 0 CA--C 1.549 0.918 0 C-N-CA 126.8 2.04 . . . . 0.0 109.999 -173.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -77.99 159.55 30.62 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 123.152 2.568 . . . . 0.0 111.995 -175.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 51.5 p90 -123.69 143.61 50.16 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 126.048 1.739 . . . . 0.0 110.225 171.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -97.55 100.37 11.78 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.537 -0.727 . . . . 0.0 109.98 -173.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -63.55 137.01 57.96 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.887 1.675 . . . . 0.0 112.233 -173.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 57.5 t-20 -95.97 122.41 58.45 Favored Pre-proline 0 CA--C 1.547 0.836 0 C-N-CA 124.061 0.944 . . . . 0.0 108.793 167.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -78.34 -36.69 0.89 Allowed 'Trans proline' 0 CA--C 1.534 0.514 0 C-N-CA 122.498 2.132 . . . . 0.0 113.093 176.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -85.25 -12.63 52.05 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -169.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 30.3 m -135.19 141.14 45.8 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.608 1.963 . . . . 0.0 108.282 173.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -66.73 89.15 0.15 Allowed 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.476 1.035 . . . . 0.0 109.651 170.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -171.92 179.13 2.8 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.664 1.585 . . . . 0.0 110.114 -172.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.2 p -160.5 173.77 15.06 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.851 1.66 . . . . 0.0 109.825 172.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.6 tpp180 -125.88 138.31 53.79 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.368 1.067 . . . . 0.0 110.608 -172.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -104.71 -32.06 9.06 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.34 1.456 . . . . 0.0 112.99 -163.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -143.72 162.06 43.35 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 128.476 2.71 . . . . 0.0 107.866 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.67 114.76 1.99 Allowed 'Trans proline' 0 CA--C 1.549 1.273 0 C-N-CA 123.306 2.671 . . . . 0.0 111.218 166.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -79.09 -166.9 0.44 Allowed 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 124.776 3.651 . . . . 0.0 111.974 -177.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -81.61 -18.44 44.71 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 177.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -95.01 7.58 45.64 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.118 1.767 . . . . 0.0 113.355 -174.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.2 t -96.73 162.02 13.61 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 126.58 1.952 . . . . 0.0 112.836 -174.188 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -89.25 -34.47 16.61 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 121.287 0.565 . . . . 0.0 112.129 -157.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . 0.26 28.6 mtt 61.55 -37.03 0.11 Allowed 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 130.148 3.379 . . . . 0.0 115.675 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -60.82 -29.07 69.25 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.838 1.255 . . . . 0.0 112.065 168.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.4 m -102.86 26.16 8.43 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.681 1.592 . . . . 0.0 112.109 168.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 76.4 mt -129.4 -20.09 3.36 Favored 'General case' 0 CA--C 1.507 -0.674 0 O-C-N 119.507 -1.995 . . . . 0.0 115.554 170.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.74 -27.1 67.34 Favored 'General case' 0 CA--C 1.556 1.178 0 CA-C-N 123.092 2.678 . . . . 0.0 111.743 177.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 26.3 ptm -59.24 -14.62 11.6 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 128.053 2.541 . . . . 0.0 115.21 164.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -127.36 -57.15 1.3 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.688 1.595 . . . . 0.0 113.122 -165.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 67.7 mmm -66.04 -10.87 44.1 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 127.361 2.265 . . . . 0.0 114.981 -175.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.02 110.62 5.13 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.003 1.321 . . . . 0.0 109.527 169.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 55.4 m . . . . . 0 N--CA 1.475 0.815 0 C-N-CA 124.936 1.294 . . . . 0.0 113.808 -162.845 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.2 t . . . . . 0 N--CA 1.476 0.854 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 57.5 mtt -146.0 66.76 1.2 Allowed 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.521 1.128 . . . . 0.0 111.124 -161.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 22.8 m -123.96 158.46 30.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 125.532 1.533 . . . . 0.0 113.167 -171.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 22.0 m120 -94.37 133.83 37.53 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.312 1.045 . . . . 0.0 110.468 168.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 24.6 p -134.89 128.26 32.27 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.471 1.509 . . . . 0.0 108.635 174.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -73.25 47.65 1.37 Allowed Glycine 0 CA--C 1.525 0.69 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.871 158.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.8 mt -82.83 171.15 12.4 Favored Pre-proline 0 CA--C 1.545 0.765 0 O-C-N 121.586 -0.95 . . . . 0.0 109.711 171.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -66.39 153.0 79.68 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 N-CA-C 108.656 -1.325 . . . . 0.0 108.656 171.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.28 -25.65 3.96 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 116.067 1.877 . . . . 0.0 116.067 -165.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -77.36 57.03 3.72 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 125.028 1.299 . . . . 0.0 112.612 166.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 2.4 p90 -96.33 149.84 21.23 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.368 1.067 . . . . 0.0 113.343 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 174.42 99.16 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 130.089 3.355 . . . . 0.0 107.27 168.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 39.4 t -69.46 115.53 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 CA-C-N 119.112 0.869 . . . . 0.0 111.066 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -106.05 176.61 5.11 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.223 1.809 . . . . 0.0 109.636 165.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 16.9 p80 -161.84 147.21 13.28 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.954 -1.092 . . . . 0.0 112.299 -178.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.2 m -70.14 156.59 38.98 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -177.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -62.3 -46.14 90.1 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.349 1.06 . . . . 0.0 112.762 -176.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.1 m -130.17 -28.11 2.17 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.933 1.293 . . . . 0.0 112.936 -170.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.3 mttm -74.87 149.68 39.46 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 126.0 1.72 . . . . 0.0 111.476 172.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -96.07 -5.88 39.9 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 118.466 2.765 . . . . 0.0 118.466 -153.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -100.02 158.13 32.61 Favored Pre-proline 0 N--CA 1.481 1.114 0 CA-C-N 120.876 1.671 . . . . 0.0 112.374 177.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -77.41 174.99 11.86 Favored 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 124.018 3.145 . . . . 0.0 110.934 169.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 16.8 p90 -142.17 137.23 30.71 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.912 0.885 . . . . 0.0 110.247 159.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -98.76 102.62 14.41 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.057 -1.027 . . . . 0.0 110.378 -171.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -75.54 131.3 39.95 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.428 1.091 . . . . 0.0 111.287 -177.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 60.5 t-20 -87.66 121.18 71.1 Favored Pre-proline 0 CA--C 1.546 0.807 0 CA-C-O 118.652 -0.689 . . . . 0.0 109.648 167.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -76.63 -35.09 2.2 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 122.595 2.196 . . . . 0.0 113.204 174.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -90.51 -15.88 29.91 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 -169.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.0 m -132.47 138.88 47.75 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.538 1.935 . . . . 0.0 107.207 171.454 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 35.7 mtp-105 -70.41 87.74 0.64 Allowed 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 118.554 0.616 . . . . 0.0 110.421 175.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -165.79 170.54 13.83 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.96 2.104 . . . . 0.0 111.7 -172.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 79.6 p -152.97 155.86 37.77 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.01 1.324 . . . . 0.0 112.043 177.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -124.85 147.23 48.88 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 126.741 2.016 . . . . 0.0 109.315 -177.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -113.57 -34.61 5.49 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 113.221 0.822 . . . . 0.0 113.221 -160.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -144.03 167.11 16.17 Favored Pre-proline 0 CA--C 1.554 1.126 0 C-N-CA 129.416 3.087 . . . . 0.0 106.878 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -65.12 116.99 4.16 Favored 'Trans proline' 0 CA--C 1.553 1.448 0 C-N-CA 123.06 2.507 . . . . 0.0 113.029 -175.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -87.4 179.94 2.91 Favored 'Trans proline' 0 C--N 1.357 1.003 1 C-N-CA 125.468 4.112 . . . . 0.0 114.036 -175.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.76 -29.72 70.27 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.452 1.278 . . . . 0.0 114.452 175.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -76.82 0.04 22.2 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.89 1.276 . . . . 0.0 114.105 177.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.4 169.88 14.13 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.521 1.529 . . . . 0.0 112.458 -173.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -125.72 56.53 1.39 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.283 1.833 . . . . 0.0 110.907 -171.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 62.5 mtm -25.97 -42.44 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.424 0 C-N-CA 127.771 2.428 . . . . 0.0 116.538 171.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -53.57 -53.83 46.13 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 121.787 2.085 . . . . 0.0 112.032 172.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.8 m -71.95 -6.73 44.14 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 126.51 1.924 . . . . 0.0 112.238 173.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 71.7 mt -95.81 -20.9 18.47 Favored 'General case' 0 CA--C 1.507 -0.681 0 O-C-N 120.254 -1.529 . . . . 0.0 113.954 166.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -68.15 -38.17 81.85 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 121.812 2.096 . . . . 0.0 109.707 -172.173 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 23.7 ptm -60.16 -13.01 9.98 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 128.422 2.689 . . . . 0.0 115.342 165.37 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 39.8 t80 -110.42 -65.44 1.16 Allowed 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.016 1.726 . . . . 0.0 112.348 -177.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 55.5 mtp -63.17 -17.19 62.11 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 128.102 2.561 . . . . 0.0 114.752 -172.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -128.23 148.48 50.63 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.071 1.348 . . . . 0.0 111.081 173.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 90.6 m -96.92 -56.81 2.45 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.947 1.299 . . . . 0.0 110.924 -176.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -85.15 147.35 26.66 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 118.718 0.69 . . . . 0.0 110.28 160.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 32.9 m80 . . . . . 0 C--O 1.253 1.262 0 C-N-CA 124.137 0.975 . . . . 0.0 112.866 -173.857 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 23.3 t . . . . . 0 N--CA 1.477 0.877 0 N-CA-C 110.751 -0.092 . . . . 0.0 110.751 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.9 ppp? -68.22 166.31 16.57 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.016 1.726 . . . . 0.0 114.983 -173.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 17.7 m -142.82 146.61 21.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 124.513 1.125 . . . . 0.0 112.932 178.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 37.8 t-20 -95.0 154.58 17.11 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.121 1.368 . . . . 0.0 109.766 159.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 70.4 p -134.22 135.4 42.95 Favored 'General case' 0 CA--C 1.509 -0.626 0 C-N-CA 124.735 1.214 . . . . 0.0 109.129 170.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -81.01 45.24 3.15 Favored Glycine 0 CA--C 1.526 0.745 0 CA-C-N 114.528 -1.215 . . . . 0.0 111.966 155.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.9 mt -93.41 165.56 18.0 Favored Pre-proline 0 CA--C 1.553 1.093 0 CA-C-N 119.831 1.815 . . . . 0.0 110.256 173.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_endo -77.48 -153.86 0.05 OUTLIER 'Trans proline' 0 CA--C 1.548 1.188 0 C-N-CA 123.797 2.998 . . . . 0.0 111.457 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.12 -15.93 38.65 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.246 1.418 . . . . 0.0 114.733 173.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -108.29 83.2 0.32 Allowed Glycine 0 C--N 1.337 0.603 0 C-N-CA 126.524 2.012 . . . . 0.0 110.568 173.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -124.22 0.42 8.39 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 115.157 1.539 . . . . 0.0 115.157 -179.778 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -80.51 102.55 9.8 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.786 0.721 . . . . 0.0 110.438 -172.474 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 75.8 t -66.3 131.06 32.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 O-C-N 121.572 -0.705 . . . . 0.0 111.422 -172.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.7 mmt-85 -131.11 120.66 23.69 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.339 1.856 . . . . 0.0 109.312 172.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -92.03 14.03 17.07 Favored 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 -176.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.6 m -73.07 107.29 5.34 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.539 -1.35 . . . . 0.0 111.049 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 55.0 t-20 174.85 135.7 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 128.714 2.806 . . . . 0.0 107.133 -172.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 42.4 m -59.21 -24.92 63.54 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.09 1.356 . . . . 0.0 113.376 168.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.5 mmtt -103.01 141.06 36.44 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.14 1.376 . . . . 0.0 110.532 178.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -79.16 24.52 0.33 Allowed 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 -154.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -111.97 146.0 33.91 Favored Pre-proline 0 CA--C 1.544 0.726 0 C-N-CA 124.921 1.289 . . . . 0.0 110.509 171.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -76.87 166.71 26.48 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 123.587 2.858 . . . . 0.0 112.208 176.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 46.0 p90 -107.43 159.24 16.55 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.306 153.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -100.93 125.4 47.5 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 171.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.439 ' CE2' ' HA ' ' A' ' 27' ' ' PRO . 24.7 t80 -83.35 142.59 30.94 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 121.433 -0.792 . . . . 0.0 111.388 177.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -96.46 92.39 1.07 Allowed Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 126.041 1.736 . . . . 0.0 110.117 170.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.439 ' HA ' ' CE2' ' A' ' 25' ' ' PHE . 9.8 Cg_endo -54.7 -22.72 29.99 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.691 2.928 . . . . 0.0 115.827 -176.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -94.57 -4.85 47.13 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 115.402 1.63 . . . . 0.0 115.402 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.6 m -143.68 149.05 36.65 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 119.701 1.137 . . . . 0.0 111.11 -164.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 55.0 mtp180 -83.97 67.75 9.75 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 121.05 -1.031 . . . . 0.0 110.346 171.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -159.14 169.08 24.97 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 126.748 2.019 . . . . 0.0 109.777 -176.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 92.6 p -140.68 161.15 38.45 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.93 -1.106 . . . . 0.0 113.394 172.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -120.08 158.18 27.38 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.505 1.922 . . . . 0.0 110.221 178.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -144.5 -17.16 0.55 Allowed 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 114.368 1.248 . . . . 0.0 114.368 -160.101 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -154.7 161.4 29.47 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 128.159 2.584 . . . . 0.0 107.12 -173.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -70.64 117.52 5.18 Favored 'Trans proline' 0 CA--C 1.548 1.199 0 C-N-CA 123.05 2.5 . . . . 0.0 111.956 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -83.73 -161.07 0.13 Allowed 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 124.77 3.647 . . . . 0.0 112.476 -178.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -95.1 -21.82 18.29 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 120.51 -1.368 . . . . 0.0 114.02 -178.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -76.99 0.13 22.33 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.998 1.719 . . . . 0.0 112.862 169.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -82.63 172.75 12.61 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 126.968 2.107 . . . . 0.0 111.973 -178.904 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -129.94 65.72 1.49 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.103 1.761 . . . . 0.0 111.253 -173.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 41.1 mtm -37.83 -35.88 0.16 Allowed 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 116.582 2.067 . . . . 0.0 116.582 174.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -68.28 -12.71 61.47 Favored 'General case' 0 CA--C 1.56 1.346 0 CA-C-N 121.481 1.946 . . . . 0.0 114.081 176.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 31.9 m -107.42 -2.41 20.54 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 128.019 2.528 . . . . 0.0 111.837 166.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 79.4 mt -98.68 -18.43 18.05 Favored 'General case' 0 CA--C 1.507 -0.698 0 CA-C-O 115.871 -2.014 . . . . 0.0 114.48 171.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 7.4 mmpt? -68.85 -37.28 79.02 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 123.392 2.814 . . . . 0.0 110.601 -175.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 23.1 ptp -51.86 -22.43 3.75 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.469 1.908 . . . . 0.0 114.054 164.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -104.11 -70.03 0.78 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 126.497 1.919 . . . . 0.0 112.66 -178.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 12.9 mtt -66.05 -15.53 63.14 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 128.129 2.572 . . . . 0.0 115.265 -174.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -162.5 60.3 0.22 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.97 1.308 . . . . 0.0 111.351 -177.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 5.8 m -25.94 91.2 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 128.877 2.871 . . . . 0.0 115.187 -159.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -62.31 122.85 16.68 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.491 1.117 . . . . 0.0 111.907 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 5.9 t60 . . . . . 0 C--O 1.248 1.017 0 C-N-CA 123.986 0.914 . . . . 0.0 113.286 -164.976 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.6 m . . . . . 0 N--CA 1.476 0.849 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 59.7 mtt -93.79 150.03 20.73 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.997 0.919 . . . . 0.0 111.909 163.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -146.31 154.49 12.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 124.345 1.058 . . . . 0.0 111.791 -176.091 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -70.55 146.37 50.2 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.496 0.719 . . . . 0.0 111.713 169.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 63.6 p -136.83 142.55 42.87 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.857 1.663 . . . . 0.0 109.257 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -75.24 16.98 3.3 Favored Glycine 0 CA--C 1.535 1.29 0 CA-C-O 118.486 -1.175 . . . . 0.0 115.635 152.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 16.4 mt -71.88 156.12 91.34 Favored Pre-proline 0 CA--C 1.547 0.865 0 CA-C-N 120.391 2.095 . . . . 0.0 110.252 -177.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -78.67 -150.82 0.04 OUTLIER 'Trans proline' 0 CA--C 1.548 1.198 0 C-N-CA 122.872 2.382 . . . . 0.0 111.503 -172.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.73 -22.97 58.91 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 120.517 -1.364 . . . . 0.0 114.678 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -102.53 81.53 0.39 Allowed Glycine 0 C--N 1.34 0.761 0 C-N-CA 126.445 1.974 . . . . 0.0 110.542 174.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 10.2 p-90 -130.33 -6.96 4.26 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.73 1.381 . . . . 0.0 114.73 -175.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.2 tp10 -75.67 103.25 5.69 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 118.993 0.815 . . . . 0.0 109.191 -175.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.0 p -66.47 134.78 29.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.179 0.591 . . . . 0.0 111.589 -174.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -130.5 125.83 35.33 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.667 1.587 . . . . 0.0 110.179 176.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 28.1 p-80 -88.04 -11.52 46.98 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.248 1.419 . . . . 0.0 114.668 -173.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 44.6 m -51.19 108.09 0.23 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.918 1.287 . . . . 0.0 112.997 -174.186 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.1 p30 152.26 140.78 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 131.619 3.967 . . . . 0.0 109.835 -179.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 38.0 m -70.07 -15.9 63.06 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.709 1.604 . . . . 0.0 112.897 168.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.4 ttmt -79.1 -166.17 0.88 Allowed 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.71 1.204 . . . . 0.0 112.463 -179.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.1 m120 -94.93 -30.32 14.21 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 -154.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -114.77 156.16 45.3 Favored Pre-proline 0 N--CA 1.475 0.782 0 C-N-CA 124.662 1.185 . . . . 0.0 111.776 -177.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -79.57 -173.68 1.97 Allowed 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 123.828 3.018 . . . . 0.0 110.562 171.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 45.7 p90 -133.39 149.87 51.82 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.281 1.432 . . . . 0.0 110.05 161.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -93.34 132.13 37.85 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 121.313 -0.867 . . . . 0.0 110.312 174.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -100.42 147.92 25.31 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.514 1.125 . . . . 0.0 111.681 178.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.4 t-20 -102.47 110.02 61.96 Favored Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 123.914 0.885 . . . . 0.0 110.265 162.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -63.97 -29.94 66.81 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 123.137 2.558 . . . . 0.0 114.613 177.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.4 -30.77 57.6 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 -172.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 95.6 m -147.1 105.39 3.77 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 126.248 1.819 . . . . 0.0 107.616 177.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -47.18 104.56 0.05 Allowed 'General case' 0 C--O 1.237 0.419 0 C-N-CA 128.147 2.579 . . . . 0.0 111.927 -171.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -171.59 158.09 4.97 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.968 1.707 . . . . 0.0 109.799 -171.065 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 92.6 p -127.3 162.19 26.84 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 174.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 8.1 tpp85 -134.31 150.21 50.94 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 126.725 2.01 . . . . 0.0 109.249 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -142.54 -18.28 0.7 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.561 1.144 . . . . 0.0 112.863 -156.62 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -149.54 155.96 39.03 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 128.179 2.592 . . . . 0.0 107.504 -175.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -66.03 121.75 9.14 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.823 2.349 . . . . 0.0 110.87 178.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -80.07 167.91 19.4 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 123.545 2.83 . . . . 0.0 111.494 175.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.39 -28.17 68.42 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -176.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -71.48 -24.89 62.07 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.24 1.816 . . . . 0.0 113.859 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.41 164.38 23.14 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 127.034 2.134 . . . . 0.0 113.96 -163.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -107.88 53.42 0.69 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.216 1.407 . . . . 0.0 111.24 -162.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 77.4 mtm -27.2 -40.38 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 129.045 2.938 . . . . 0.0 115.103 166.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -50.61 -47.58 58.21 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 121.555 1.979 . . . . 0.0 113.542 173.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 21.5 m -78.52 -21.04 49.45 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 128.04 2.536 . . . . 0.0 112.162 176.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.3 tp -117.48 -21.4 8.64 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 123.976 0.91 . . . . 0.0 111.3 -150.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.9 -35.48 69.03 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 120.598 1.544 . . . . 0.0 111.015 157.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 8.5 mmt -60.43 -24.96 65.61 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 172.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -97.36 -45.48 6.45 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.858 1.663 . . . . 0.0 112.78 -178.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 35.1 mtt -76.33 -17.25 59.51 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.268 1.827 . . . . 0.0 112.697 -177.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -104.3 165.01 11.33 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.044 1.338 . . . . 0.0 110.398 157.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -121.5 -2.75 9.41 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.078 1.351 . . . . 0.0 113.343 178.407 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -57.75 149.71 21.51 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.505 1.122 . . . . 0.0 112.249 157.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 78.7 t60 . . . . . 0 C--O 1.252 1.23 0 C-N-CA 125.17 1.388 . . . . 0.0 113.527 -176.174 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 80.8 p . . . . . 0 N--CA 1.476 0.85 0 CA-C-O 118.872 -0.585 . . . . 0.0 111.495 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 99.2 mmm -77.36 132.05 38.37 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.98 1.264 . . . . 0.0 110.612 178.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 18.5 t -107.83 158.43 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 127.048 2.139 . . . . 0.0 108.664 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.8 m120 -53.26 131.02 36.63 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 122.093 -0.38 . . . . 0.0 111.29 168.29 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 44.7 p -129.39 146.59 51.23 Favored 'General case' 0 CA--C 1.508 -0.668 0 C-N-CA 125.508 1.523 . . . . 0.0 108.337 171.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -94.47 52.92 2.08 Favored Glycine 0 CA--C 1.524 0.616 0 CA-C-N 113.795 -1.548 . . . . 0.0 111.5 154.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 15.0 mt -88.63 169.06 14.24 Favored Pre-proline 0 CA--C 1.551 1.013 0 CA-C-N 118.699 1.25 . . . . 0.0 110.311 175.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -75.8 -158.34 0.08 OUTLIER 'Trans proline' 0 CA--C 1.548 1.209 0 C-N-CA 121.726 1.618 . . . . 0.0 110.801 177.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.4 12.8 0.54 Allowed 'General case' 0 CA--C 1.551 1.002 0 N-CA-C 115.657 1.725 . . . . 0.0 115.657 -172.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -142.14 102.32 0.3 Allowed Glycine 0 C--N 1.334 0.472 0 C-N-CA 126.046 1.784 . . . . 0.0 109.276 173.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 52.7 p-90 -141.64 -2.47 1.21 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.411 1.484 . . . . 0.0 114.264 -171.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.09 161.25 11.21 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.576 0.751 . . . . 0.0 110.927 159.487 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.5 m -118.51 149.28 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.37 1.068 . . . . 0.0 112.866 -173.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.9 mmt85 -141.44 118.89 11.53 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.473 1.909 . . . . 0.0 110.196 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 16.4 p-80 -74.52 166.16 23.99 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 113.631 0.974 . . . . 0.0 113.631 175.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 29.0 t -160.49 130.88 5.34 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 125.46 1.504 . . . . 0.0 110.176 176.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -58.9 -24.44 62.32 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 -176.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 69.5 m -71.94 -15.79 62.09 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.944 1.298 . . . . 0.0 114.063 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -108.21 168.03 9.59 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.566 1.546 . . . . 0.0 113.045 -171.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -92.97 -9.94 38.15 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 169.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -160.77 164.64 18.82 Favored Pre-proline 0 CA--C 1.55 0.947 0 C-N-CA 126.906 2.082 . . . . 0.0 109.598 -177.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.57 162.68 40.69 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 122.782 2.321 . . . . 0.0 113.125 -177.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 33.2 p90 -95.24 157.57 15.84 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.805 0.842 . . . . 0.0 110.953 160.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -83.0 143.42 30.65 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 121.683 -0.636 . . . . 0.0 110.388 171.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -116.83 145.2 43.7 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.301 1.04 . . . . 0.0 112.493 -174.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -101.13 98.15 8.31 Favored Pre-proline 0 CA--C 1.552 1.031 0 C-N-CA 124.702 1.201 . . . . 0.0 110.447 176.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -66.72 -29.67 42.55 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 122.692 2.261 . . . . 0.0 115.137 -167.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.73 -24.38 41.66 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.868 1.432 . . . . 0.0 114.868 -176.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.8 m -146.47 126.68 13.85 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 125.274 1.43 . . . . 0.0 109.51 178.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -50.36 101.12 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.196 1.798 . . . . 0.0 112.736 -176.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -168.08 154.48 7.54 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 127.019 2.128 . . . . 0.0 110.749 179.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 82.4 p -129.53 151.55 50.02 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.878 1.271 . . . . 0.0 112.735 176.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 18.0 tpp180 -126.34 146.35 50.07 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 127.471 2.308 . . . . 0.0 109.831 -176.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -130.62 -36.33 1.43 Allowed 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -158.228 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -146.28 150.53 41.52 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 126.554 1.942 . . . . 0.0 107.861 -178.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -48.27 112.61 0.62 Allowed 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 124.817 3.678 . . . . 0.0 114.391 -174.534 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -80.14 163.45 22.66 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 123.488 2.792 . . . . 0.0 112.203 -177.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.84 -22.71 66.87 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.058 1.132 . . . . 0.0 114.058 -178.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -90.75 -1.03 57.88 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.207 1.803 . . . . 0.0 113.998 -174.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.86 -173.6 1.93 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 126.009 1.723 . . . . 0.0 113.794 -170.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -119.09 60.27 0.82 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 126.149 1.78 . . . . 0.0 110.229 177.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 59.6 mtt -31.96 -46.33 0.12 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.901 1.68 . . . . 0.0 113.93 168.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -53.6 -36.58 62.11 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 120.351 1.432 . . . . 0.0 113.995 177.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 75.9 m -85.65 -28.19 24.91 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.28 1.432 . . . . 0.0 111.822 171.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 81.3 mt -72.31 -14.19 61.68 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 119.818 1.19 . . . . 0.0 112.536 174.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.24 -18.18 64.49 Favored 'General case' 0 CA--C 1.55 0.954 0 CA-C-N 120.624 1.556 . . . . 0.0 111.988 -175.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 93.3 mmm -79.84 -8.77 59.48 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 128.146 2.578 . . . . 0.0 113.688 168.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -121.27 -56.25 1.91 Allowed 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.786 2.034 . . . . 0.0 113.095 -166.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 88.3 mmm -67.16 -11.79 58.26 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.986 2.115 . . . . 0.0 113.267 178.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.3 151.0 40.0 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.636 1.974 . . . . 0.0 110.338 159.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 5.0 m -85.07 125.8 33.06 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.929 1.292 . . . . 0.0 110.229 -175.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -62.48 135.01 57.21 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.265 0.626 . . . . 0.0 111.903 176.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 21.0 t60 . . . . . 0 C--O 1.253 1.256 0 C-N-CA 124.375 1.07 . . . . 0.0 113.569 -167.028 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 57.1 m . . . . . 0 N--CA 1.478 0.937 0 CA-C-O 118.96 -0.543 . . . . 0.0 110.853 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 19.7 ptt? 166.04 145.49 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 128.636 2.775 . . . . 0.0 111.626 173.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 17.0 m -132.8 152.52 36.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 125.101 1.36 . . . . 0.0 111.475 177.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.7 m120 -111.24 128.66 56.0 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.113 0.965 . . . . 0.0 109.667 164.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 24.4 p -115.37 127.98 55.76 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.664 1.586 . . . . 0.0 108.217 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -76.33 55.0 3.23 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 110.797 -0.921 . . . . 0.0 110.797 158.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.8 mt -93.07 166.66 15.85 Favored Pre-proline 0 CA--C 1.55 0.964 0 CA-C-N 118.745 1.273 . . . . 0.0 110.905 176.264 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -77.24 -141.45 0.02 OUTLIER 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 123.526 2.817 . . . . 0.0 110.211 176.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.09 -21.43 64.97 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 120.451 -1.406 . . . . 0.0 113.675 177.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -98.52 81.33 0.6 Allowed Glycine 0 C--N 1.337 0.603 0 C-N-CA 126.974 2.226 . . . . 0.0 110.146 172.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 52.0 p-90 -119.46 -16.5 8.92 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 116.69 2.108 . . . . 0.0 116.69 -171.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -80.96 127.13 32.22 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 118.91 0.777 . . . . 0.0 110.759 -175.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.8 m -89.16 130.67 38.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 O-C-N 121.412 -0.805 . . . . 0.0 111.633 -166.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 80.8 mmt-85 -141.28 158.61 43.66 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.215 1.006 . . . . 0.0 112.254 -173.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 8.6 p80 -172.39 137.6 0.87 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.73 2.012 . . . . 0.0 112.118 177.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.9 m -70.18 159.3 34.21 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.672 -0.642 . . . . 0.0 111.968 175.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -68.47 -20.23 64.6 Favored 'General case' 0 CA--C 1.547 0.83 0 O-C-N 120.664 -1.272 . . . . 0.0 114.389 -176.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.4 m -78.89 -0.95 32.84 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.415 1.486 . . . . 0.0 113.756 173.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 59.9 mmtt -135.41 169.87 16.82 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.619 1.968 . . . . 0.0 112.751 -171.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -131.52 -29.76 1.73 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.435 1.494 . . . . 0.0 113.111 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -77.99 128.2 79.53 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 126.369 1.868 . . . . 0.0 110.071 178.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -80.99 159.26 20.86 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 123.188 2.592 . . . . 0.0 114.829 -170.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 34.1 p90 -116.63 153.26 32.59 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.816 1.647 . . . . 0.0 109.824 154.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 33.3 m-85 -110.84 112.2 23.89 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.167 0.987 . . . . 0.0 110.192 -172.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -79.84 137.25 36.9 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.071 1.748 . . . . 0.0 112.928 -171.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -93.35 109.87 43.07 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 124.479 1.112 . . . . 0.0 110.048 171.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.43 -37.21 10.28 Favored 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 121.771 1.647 . . . . 0.0 112.322 175.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.42 -21.81 62.78 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 116.028 1.862 . . . . 0.0 116.028 -170.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 31.6 m -153.67 146.46 24.33 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.256 1.823 . . . . 0.0 108.613 -173.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -70.86 87.08 0.71 Allowed 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.008 0.822 . . . . 0.0 111.844 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -166.23 178.98 5.93 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.839 2.056 . . . . 0.0 109.766 176.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 26.1 p -156.96 149.85 23.7 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.297 1.439 . . . . 0.0 112.552 170.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.7 tpp180 -101.32 135.67 42.43 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.626 2.37 . . . . 0.0 109.664 -176.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -102.03 -30.77 11.0 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 121.114 -0.991 . . . . 0.0 113.513 -167.172 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -148.58 156.7 41.92 Favored Pre-proline 0 CA--C 1.539 0.55 0 C-N-CA 126.938 2.095 . . . . 0.0 108.087 -161.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -67.27 120.72 7.8 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 122.195 1.93 . . . . 0.0 110.69 -173.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -78.19 170.13 19.15 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 122.873 2.382 . . . . 0.0 110.776 173.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -72.65 -27.9 62.4 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.554 -0.716 . . . . 0.0 111.768 164.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -65.23 -0.18 1.64 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 127.716 2.407 . . . . 0.0 114.648 179.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -88.53 172.84 9.03 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 126.658 1.983 . . . . 0.0 113.547 -170.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -107.09 48.43 0.84 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 127.288 2.235 . . . . 0.0 111.178 -171.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 69.1 mtm -29.38 -43.19 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 118.099 2.629 . . . . 0.0 118.099 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -49.29 -47.29 47.03 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 123.062 2.665 . . . . 0.0 111.912 174.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 36.6 m -77.66 -22.07 51.18 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 126.028 1.731 . . . . 0.0 111.713 178.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 66.8 mt -82.19 -21.46 36.46 Favored 'General case' 0 CA--C 1.506 -0.741 0 CA-C-O 117.625 -1.179 . . . . 0.0 113.245 171.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.71 -10.13 57.1 Favored 'General case' 0 CA--C 1.554 1.134 0 CA-C-N 121.197 1.817 . . . . 0.0 111.38 176.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.2 mmm -89.33 5.64 44.1 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 127.922 2.489 . . . . 0.0 113.066 167.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 49.6 t80 -135.42 -58.35 0.78 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 126.36 1.864 . . . . 0.0 113.031 -172.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 36.0 mtp -72.29 -4.68 31.09 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 127.829 2.452 . . . . 0.0 112.322 172.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -154.6 -165.99 2.21 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 129.168 2.987 . . . . 0.0 108.055 166.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 29.1 p -132.25 165.31 24.43 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.497 1.119 . . . . 0.0 111.23 170.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -127.58 131.76 49.93 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.363 1.865 . . . . 0.0 110.875 -178.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 . . . . . 0 C--O 1.255 1.353 0 C-N-CA 127.793 2.437 . . . . 0.0 108.812 -173.557 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 26.6 m . . . . . 0 N--CA 1.473 0.704 0 CA-C-O 120.585 0.231 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 98.1 mmm -63.1 142.11 58.51 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 125.013 1.325 . . . . 0.0 112.176 -177.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.0 m -129.04 127.27 65.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 123.866 0.866 . . . . 0.0 110.541 172.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.2 m120 -78.48 132.5 37.28 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.407 0.683 . . . . 0.0 109.503 166.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.423 ' HB ' ' H ' ' A' ' 7' ' ' LEU . 71.9 p -132.59 144.21 50.22 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 126.733 2.013 . . . . 0.0 108.588 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -81.22 8.69 57.32 Favored Glycine 0 CA--C 1.536 1.366 0 CA-C-N 115.093 -0.958 . . . . 0.0 113.622 156.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.423 ' H ' ' HB ' ' A' ' 5' ' ' THR . 30.4 mt -61.96 155.17 64.76 Favored Pre-proline 0 CA--C 1.542 0.669 0 CA-C-N 119.902 1.851 . . . . 0.0 110.696 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -70.36 179.18 4.21 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 121.098 1.199 . . . . 0.0 112.308 -169.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.88 -39.74 69.01 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.453 1.101 . . . . 0.0 113.049 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -82.15 68.16 3.56 Favored Glycine 0 CA--C 1.526 0.747 0 C-N-CA 125.405 1.479 . . . . 0.0 111.649 174.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -143.25 163.8 31.95 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 171.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 175.73 140.85 0.06 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 131.22 3.808 . . . . 0.0 106.231 164.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 9.1 p -81.54 141.74 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 CA-C-N 120.195 1.361 . . . . 0.0 112.172 -174.019 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -142.74 102.54 4.06 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.704 1.202 . . . . 0.0 111.934 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 76.5 m-70 -72.41 112.45 8.48 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.938 0.895 . . . . 0.0 111.892 175.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 29.2 t -59.63 151.23 25.28 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 -167.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -73.88 -36.95 64.86 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.053 1.341 . . . . 0.0 111.451 165.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.2 t -86.29 -25.13 25.64 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -175.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -133.67 153.45 51.67 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.299 1.039 . . . . 0.0 112.002 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -80.63 52.61 1.7 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 124.424 1.09 . . . . 0.0 111.471 176.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -154.16 135.29 8.69 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 125.245 1.418 . . . . 0.0 110.16 -158.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -82.04 131.37 6.88 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 123.33 2.687 . . . . 0.0 112.635 174.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 53.8 p90 -96.36 165.48 12.17 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 122.892 0.477 . . . . 0.0 110.11 151.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -105.19 129.84 53.48 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.321 -0.862 . . . . 0.0 110.65 170.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -87.86 139.41 30.55 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.579 1.151 . . . . 0.0 110.44 174.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -99.13 108.0 47.33 Favored Pre-proline 0 CA--C 1.551 1.015 0 O-C-N 121.855 -0.528 . . . . 0.0 109.858 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -73.48 -36.62 3.78 Favored 'Trans proline' 0 C--N 1.354 0.853 0 C-N-CA 122.512 2.141 . . . . 0.0 112.581 174.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.26 -26.24 64.67 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -174.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 76.9 m -150.21 132.0 15.04 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 127.904 2.482 . . . . 0.0 106.861 -176.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -65.0 97.89 0.26 Allowed 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.604 1.093 . . . . 0.0 110.633 -177.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -171.63 172.65 4.91 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 126.472 1.909 . . . . 0.0 110.542 -167.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 36.6 p -140.02 143.96 36.68 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 120.823 -1.173 . . . . 0.0 111.862 166.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 20.2 tpp180 -107.33 143.49 35.53 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 126.788 2.035 . . . . 0.0 110.218 -178.354 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -127.3 -6.54 5.91 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.41 1.484 . . . . 0.0 114.528 -166.025 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -165.98 168.92 7.25 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 127.763 2.425 . . . . 0.0 107.941 -173.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -68.01 122.38 9.47 Favored 'Trans proline' 0 CA--C 1.546 1.093 0 C-N-CA 122.07 1.846 . . . . 0.0 111.239 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -82.12 174.77 9.77 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 124.505 3.47 . . . . 0.0 111.465 176.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.37 -44.46 88.87 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 176.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -68.96 -11.48 60.74 Favored 'General case' 0 CA--C 1.553 1.066 0 N-CA-C 115.645 1.72 . . . . 0.0 115.645 -167.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.3 t -75.83 164.29 26.38 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 126.382 1.873 . . . . 0.0 114.872 -164.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -115.17 56.57 0.74 Allowed 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.749 2.02 . . . . 0.0 111.174 -163.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 27.0 mtt -30.86 -40.75 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.87 1.668 . . . . 0.0 114.805 169.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -39.65 -54.75 1.99 Allowed 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 126.412 1.885 . . . . 0.0 114.082 166.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 95.6 m -78.79 -31.06 45.85 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.961 2.104 . . . . 0.0 111.409 170.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -80.03 -19.99 46.38 Favored 'General case' 0 C--O 1.224 -0.251 0 O-C-N 121.171 -0.956 . . . . 0.0 112.58 -162.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.25 -27.41 67.93 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 120.707 1.594 . . . . 0.0 112.17 175.387 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 95.6 mmm -62.05 -8.03 4.79 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.714 1.205 . . . . 0.0 113.816 167.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -115.85 -59.55 1.98 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.615 1.966 . . . . 0.0 111.547 178.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -7.45 41.81 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.247 1.819 . . . . 0.0 113.99 -178.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -138.45 53.58 1.79 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.469 1.508 . . . . 0.0 110.238 167.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 7.4 m -55.38 126.98 27.36 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.245 1.418 . . . . 0.0 110.647 -174.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -70.12 147.71 49.6 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.6 0.76 . . . . 0.0 112.729 -175.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 54.0 t60 . . . . . 0 C--O 1.25 1.118 0 C-N-CA 125.305 1.442 . . . . 0.0 110.832 -173.07 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 56.9 p . . . . . 0 N--CA 1.476 0.853 0 CA-C-O 118.682 -0.675 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.5 pmm? -168.67 162.68 11.91 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 120.048 1.295 . . . . 0.0 113.178 -167.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 3.4 t -117.21 140.94 37.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 125.651 1.58 . . . . 0.0 108.557 168.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -70.32 128.72 37.19 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 122.09 -0.382 . . . . 0.0 111.188 175.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 24.5 p -133.03 132.49 41.9 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 127.206 2.202 . . . . 0.0 107.843 -176.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -68.86 34.12 0.29 Allowed Glycine 0 CA--C 1.532 1.142 0 CA-C-O 118.435 -1.203 . . . . 0.0 115.651 155.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.7 mt -83.77 165.04 41.84 Favored Pre-proline 0 CA--C 1.548 0.872 0 CA-C-N 119.633 1.716 . . . . 0.0 109.61 177.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -77.95 -147.15 0.03 OUTLIER 'Trans proline' 0 CA--C 1.545 1.036 0 C-N-CA 121.608 1.539 . . . . 0.0 109.128 174.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.28 -21.04 64.82 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.212 -1.555 . . . . 0.0 112.91 173.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -80.94 68.79 3.36 Favored Glycine 0 CA--C 1.527 0.805 0 C-N-CA 126.025 1.774 . . . . 0.0 111.545 170.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 12.1 p-90 -120.37 -12.43 8.99 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 116.588 2.07 . . . . 0.0 116.588 -173.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -70.3 114.91 8.9 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 120.077 1.308 . . . . 0.0 110.448 -179.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 6.0 t -72.16 134.17 30.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 CA-C-N 119.168 0.895 . . . . 0.0 109.826 178.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.2 mmt85 -131.9 128.98 39.71 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 125.087 1.355 . . . . 0.0 111.331 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 38.0 p-80 -62.8 137.57 58.3 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 121.771 -0.58 . . . . 0.0 110.476 159.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.8 t -97.69 150.93 20.64 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.037 -1.04 . . . . 0.0 112.391 -174.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -69.03 -41.41 77.72 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.388 -0.82 . . . . 0.0 110.156 162.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 85.1 p -106.91 -3.73 19.9 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 115.691 1.738 . . . . 0.0 115.691 -158.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.5 ttmm -138.43 146.34 42.03 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.484 1.038 . . . . 0.0 113.564 -169.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -88.1 46.67 1.41 Allowed 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.74 1.616 . . . . 0.0 111.946 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 16.6 tp -170.63 151.9 3.67 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 128.258 2.623 . . . . 0.0 107.322 -171.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -71.18 166.37 29.42 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 121.607 1.538 . . . . 0.0 110.645 169.039 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 17.2 p90 -127.86 160.93 30.27 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.725 1.21 . . . . 0.0 109.949 164.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -103.98 139.44 39.11 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.6 -0.688 . . . . 0.0 110.537 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -118.04 142.19 47.66 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.658 1.583 . . . . 0.0 111.581 -172.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 65.0 t-20 -98.15 109.41 51.84 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 124.576 1.15 . . . . 0.0 110.362 171.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -75.79 -26.22 9.92 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 123.087 2.525 . . . . 0.0 113.243 177.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.83 -29.4 40.17 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 118.948 0.795 . . . . 0.0 112.771 -175.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.9 m -143.27 88.99 2.06 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.144 1.378 . . . . 0.0 108.707 174.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -32.7 103.1 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 128.557 2.743 . . . . 0.0 114.005 -173.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -173.19 165.13 4.87 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.299 1.84 . . . . 0.0 109.821 -170.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 57.1 p -120.38 173.4 7.17 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.482 1.513 . . . . 0.0 113.352 175.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.05 141.28 17.48 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.837 2.055 . . . . 0.0 109.254 -178.268 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -134.5 -25.92 1.46 Allowed 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -151.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -142.91 152.75 59.64 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 127.976 2.51 . . . . 0.0 107.556 172.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -51.04 113.0 0.91 Allowed 'Trans proline' 0 CA--C 1.544 1.012 0 C-N-CA 124.19 3.26 . . . . 0.0 112.923 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -79.15 169.39 19.17 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 123.34 2.693 . . . . 0.0 111.924 -176.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.94 -38.02 81.2 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -78.44 0.13 27.04 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 127.463 2.305 . . . . 0.0 114.5 -175.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.78 174.7 10.19 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 126.008 1.723 . . . . 0.0 111.063 178.214 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -103.6 -35.6 8.23 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 120.949 -1.095 . . . . 0.0 112.402 -166.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . 0.263 33.7 mtt 60.99 -40.05 0.11 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 128.542 2.737 . . . . 0.0 115.741 -176.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -62.23 -51.99 65.53 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 122.343 2.338 . . . . 0.0 111.783 177.288 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.0 m -66.53 -11.16 51.34 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 125.91 1.684 . . . . 0.0 112.175 169.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 8.6 tp -105.06 -23.76 12.89 Favored 'General case' 0 N--CA 1.447 -0.602 0 O-C-N 120.942 -1.099 . . . . 0.0 111.225 -170.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.24 -37.7 88.26 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 120.957 1.708 . . . . 0.0 110.213 169.534 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 25.1 ptp -69.87 18.31 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 126.101 1.761 . . . . 0.0 114.573 166.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -138.28 -32.38 0.72 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.691 1.997 . . . . 0.0 112.297 171.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 93.4 mmm -95.12 -8.95 34.99 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 127.287 2.235 . . . . 0.0 115.095 -179.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -141.23 165.6 27.07 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 120.327 1.421 . . . . 0.0 113.179 -176.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 10.9 t -147.39 145.31 29.21 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 125.118 1.367 . . . . 0.0 113.288 -170.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 24.0 t80 -85.82 161.27 19.19 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.213 1.005 . . . . 0.0 112.729 172.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 27.8 p-80 . . . . . 0 C--O 1.252 1.213 0 C-N-CA 126.812 2.045 . . . . 0.0 113.246 -173.138 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.478 0.949 0 CA-C-O 119.788 -0.149 . . . . 0.0 110.888 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 24.1 ptt? -59.28 166.07 2.39 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 126.723 2.009 . . . . 0.0 115.13 -178.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.8 m -138.5 145.61 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 125.609 1.564 . . . . 0.0 111.459 175.312 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -83.39 140.65 32.27 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.201 0.6 . . . . 0.0 110.345 167.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.472 ' HB ' ' H ' ' A' ' 7' ' ' LEU . 63.1 p -139.98 141.76 36.36 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 122.727 1.251 . . . . 0.0 109.714 170.787 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -73.76 4.14 31.17 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-N 113.785 -1.552 . . . . 0.0 116.074 152.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.472 ' H ' ' HB ' ' A' ' 5' ' ' THR . 15.1 mt -71.02 153.9 94.43 Favored Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 120.708 2.254 . . . . 0.0 109.074 -173.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -77.3 -152.23 0.04 OUTLIER 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 122.253 1.969 . . . . 0.0 109.989 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.09 -30.98 71.38 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 120.871 -1.143 . . . . 0.0 113.198 -178.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -91.74 74.26 1.54 Allowed Glycine 0 C--N 1.339 0.737 0 C-N-CA 126.799 2.142 . . . . 0.0 112.271 174.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 55.1 p-90 -109.71 -19.56 13.13 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 117.237 2.31 . . . . 0.0 117.237 -174.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -87.04 116.62 25.21 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 119.821 1.192 . . . . 0.0 111.198 -167.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.8 p -67.41 131.36 32.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 119.449 1.022 . . . . 0.0 112.306 -177.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.3 mmt180 -139.36 162.01 36.06 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.109 1.763 . . . . 0.0 111.469 -173.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . 0.804 ' HD1' ' H ' ' A' ' 16' ' ' SER . 2.1 t-80 -142.78 165.01 28.56 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.118 1.367 . . . . 0.0 111.74 179.726 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.804 ' H ' ' HD1' ' A' ' 15' ' ' HIS . 68.4 m -136.08 173.9 11.21 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.27 1.428 . . . . 0.0 112.877 -169.349 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 10.4 p-10 -81.92 -11.51 58.86 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 115.581 1.697 . . . . 0.0 115.581 -171.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.3 t -127.27 -31.84 2.52 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -178.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.5 tttp -60.14 155.16 17.86 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.513 1.525 . . . . 0.0 112.208 170.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -106.63 -28.2 10.37 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.126 0.97 . . . . 0.0 113.502 175.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 8.5 mp -95.64 160.49 30.25 Favored Pre-proline 0 N--CA 1.476 0.843 0 C-N-CA 125.604 1.562 . . . . 0.0 111.972 175.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -79.11 174.26 12.34 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 123.324 2.683 . . . . 0.0 112.272 168.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 39.7 p90 -147.75 152.22 37.37 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.72 2.408 . . . . 0.0 109.876 172.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 -87.06 141.51 28.61 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.129 -0.982 . . . . 0.0 110.689 173.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -124.16 146.15 48.85 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.78 1.632 . . . . 0.0 111.52 -170.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 57.4 t-20 -97.94 113.73 64.14 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 124.066 0.947 . . . . 0.0 111.401 177.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -70.41 -30.37 19.36 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 123.159 2.573 . . . . 0.0 113.552 178.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.28 -51.25 10.42 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.231 0.923 . . . . 0.0 112.036 -176.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 23.2 m -117.55 125.63 51.15 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.584 1.554 . . . . 0.0 107.917 177.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 46.4 mtm105 -62.89 107.56 1.01 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.956 1.253 . . . . 0.0 109.873 177.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -174.06 162.77 3.86 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 129.304 3.042 . . . . 0.0 109.127 -173.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 30.9 p -128.51 175.66 8.36 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.781 1.233 . . . . 0.0 114.234 -179.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.55 145.24 25.0 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 127.298 2.239 . . . . 0.0 109.06 174.057 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 2.0 m-90 -111.7 -23.26 10.74 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 121.295 -0.878 . . . . 0.0 113.162 -155.188 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -157.77 167.41 14.55 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 131.545 3.938 . . . . 0.0 106.373 -175.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -62.12 120.09 7.51 Favored 'Trans proline' 0 CA--C 1.551 1.328 0 CA-C-N 121.954 1.734 . . . . 0.0 110.201 172.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -85.37 -167.99 0.46 Allowed 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 124.391 3.394 . . . . 0.0 112.486 -171.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -75.06 -47.0 31.03 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 121.282 -0.886 . . . . 0.0 113.35 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -63.65 -13.08 39.3 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.03 1.332 . . . . 0.0 114.315 -175.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -71.0 164.94 24.52 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 127.872 2.469 . . . . 0.0 112.646 -171.114 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -110.05 24.87 12.45 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.267 -0.895 . . . . 0.0 112.482 -154.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.436 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 51.6 mtt -5.35 -45.39 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.508 1 C-N-CA 132.103 4.161 . . . . 0.0 120.059 -176.122 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -55.65 -42.66 75.34 Favored 'General case' 0 CA--C 1.55 0.96 0 CA-C-N 122.657 2.48 . . . . 0.0 112.564 170.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.3 m -73.33 -7.9 53.58 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 127.876 2.47 . . . . 0.0 113.25 172.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.436 ' HB3' ' HA ' ' A' ' 42' ' ' MET . 11.4 tp -121.71 -24.16 5.36 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 120.994 -1.066 . . . . 0.0 111.734 -163.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -57.81 -42.95 85.33 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 120.163 1.347 . . . . 0.0 110.091 163.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 21.7 ptp -61.83 -9.48 6.8 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.518 1.527 . . . . 0.0 114.521 172.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.0 t80 -109.65 -44.03 3.94 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.456 1.503 . . . . 0.0 112.885 176.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 12.2 mmt -78.22 -36.42 47.17 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.369 1.868 . . . . 0.0 113.328 -175.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -95.4 161.8 13.93 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.458 1.103 . . . . 0.0 112.557 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 38.0 p -89.89 -14.12 34.94 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 115.482 1.66 . . . . 0.0 115.482 -174.353 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -88.26 156.06 19.4 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 120.054 1.297 . . . . 0.0 113.558 -178.537 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 15.2 p-80 . . . . . 0 C--O 1.253 1.281 0 C-N-CA 125.343 1.457 . . . . 0.0 113.11 -178.473 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 18.1 m . . . . . 0 N--CA 1.474 0.732 0 N-CA-C 111.706 0.261 . . . . 0.0 111.706 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 96.3 mmm -82.05 117.86 22.57 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 162.204 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.8 m -159.44 138.19 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 125.988 1.715 . . . . 0.0 110.07 -172.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 56.0 m-80 -72.17 135.82 46.27 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.658 0.742 . . . . 0.0 111.887 173.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 77.1 p -124.02 148.41 47.04 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 126.751 2.02 . . . . 0.0 107.349 174.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . 0.44 ' H ' ' CD1' ' A' ' 45' ' ' LEU . . . -76.62 2.47 58.54 Favored Glycine 0 CA--C 1.532 1.15 0 CA-C-O 118.681 -1.066 . . . . 0.0 114.545 157.257 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.7 mt -61.31 153.71 66.86 Favored Pre-proline 0 CA--C 1.541 0.611 0 CA-C-N 119.383 1.592 . . . . 0.0 110.012 -171.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -71.42 162.25 42.93 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 CA-C-N 120.009 1.039 . . . . 0.0 109.632 -176.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.77 -25.82 8.36 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 115.555 1.687 . . . . 0.0 115.555 -169.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -82.38 72.27 2.84 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 124.181 0.896 . . . . 0.0 111.119 166.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 2.1 p-90 -142.3 153.09 43.6 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.603 1.161 . . . . 0.0 114.113 169.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 174.72 124.96 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 130.589 3.556 . . . . 0.0 105.254 176.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 35.4 t -73.99 129.65 36.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 CA-C-N 121.329 1.877 . . . . 0.0 110.586 -174.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.0 mmt-85 -114.09 132.94 55.86 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 126.029 1.732 . . . . 0.0 111.349 171.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -102.85 25.45 9.27 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.564 1.546 . . . . 0.0 112.201 170.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.1 m -77.98 54.24 1.28 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.21 1.804 . . . . 0.0 114.151 -171.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -155.59 138.0 14.91 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 126.468 1.907 . . . . 0.0 108.452 -177.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 17.6 t -62.45 -32.88 73.82 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 125.715 1.606 . . . . 0.0 111.706 170.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -70.73 143.12 51.38 Favored 'General case' 0 CA--C 1.547 0.865 0 O-C-N 121.049 -1.032 . . . . 0.0 110.828 167.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -82.17 32.78 0.39 Allowed 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.366 1.466 . . . . 0.0 114.475 -165.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -107.6 157.88 34.71 Favored Pre-proline 0 N--CA 1.474 0.741 0 C-N-CA 125.821 1.648 . . . . 0.0 110.869 175.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -86.92 172.18 6.53 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 123.622 2.882 . . . . 0.0 110.329 164.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 49.0 p90 -142.21 165.54 27.15 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.027 1.331 . . . . 0.0 109.214 151.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -98.8 125.08 44.07 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 120.782 -1.199 . . . . 0.0 110.475 176.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -74.11 149.23 41.16 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 120.64 -1.288 . . . . 0.0 110.709 168.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -99.02 96.91 4.48 Favored Pre-proline 0 CA--C 1.545 0.765 0 C-N-CA 122.996 0.518 . . . . 0.0 110.365 173.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -66.49 -29.45 44.77 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.453 2.102 . . . . 0.0 112.519 171.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.54 -19.11 62.92 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 -174.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.5 m -174.27 130.31 0.37 Allowed 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 129.042 2.937 . . . . 0.0 106.476 177.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 55.5 mtt85 -61.33 108.55 0.95 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.946 0.898 . . . . 0.0 111.011 -170.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -170.98 -180.0 2.93 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 130.552 3.541 . . . . 0.0 106.752 -170.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 14.8 m -149.97 130.25 13.71 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 119.463 -2.023 . . . . 0.0 111.963 165.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 12.8 tpp180 -86.91 121.72 29.77 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 127.583 2.353 . . . . 0.0 110.557 -178.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -76.16 -32.99 59.35 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 127.105 2.162 . . . . 0.0 114.209 -168.339 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -166.21 168.9 7.09 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 127.304 2.241 . . . . 0.0 108.565 -172.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -55.66 124.75 17.06 Favored 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 122.69 2.26 . . . . 0.0 112.551 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -85.29 -168.86 0.54 Allowed 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 124.761 3.641 . . . . 0.0 111.644 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.0 -42.75 31.66 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.061 0.945 . . . . 0.0 113.461 177.203 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -78.87 5.64 11.0 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 -172.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.5 t -74.41 152.02 39.57 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.188 1.795 . . . . 0.0 112.241 177.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -105.14 48.3 0.84 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.384 1.074 . . . . 0.0 112.905 -155.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.419 ' O ' ' HE3' ' A' ' 46' ' ' LYS . 65.2 mtm -22.07 -47.2 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 118.792 2.886 . . . . 0.0 118.792 -169.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -51.65 -42.61 62.2 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 123.335 2.788 . . . . 0.0 113.328 175.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 55.9 m -75.07 -23.08 57.97 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.098 1.359 . . . . 0.0 112.023 173.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.44 ' CD1' ' H ' ' A' ' 6' ' ' GLY . 3.2 mm? -79.87 -19.84 47.33 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 116.781 -1.58 . . . . 0.0 113.139 171.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.419 ' HE3' ' O ' ' A' ' 42' ' ' MET . 8.0 mmpt? -69.01 -23.37 64.08 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 122.289 2.313 . . . . 0.0 111.751 -172.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.2 ptm -70.21 -17.89 63.16 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.485 1.514 . . . . 0.0 113.998 168.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 47.1 t80 -107.2 -61.75 1.51 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.967 2.507 . . . . 0.0 112.157 -171.633 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 27.9 mtp -66.74 -7.73 23.16 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.967 2.107 . . . . 0.0 114.489 -178.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -151.69 152.56 32.95 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.371 1.468 . . . . 0.0 109.997 163.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 6.4 t -139.12 -22.14 0.93 Allowed 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 118.022 -0.989 . . . . 0.0 112.929 170.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 34.5 t80 -55.51 144.02 27.49 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.384 1.474 . . . . 0.0 111.908 171.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.9 p80 . . . . . 0 C--O 1.251 1.174 0 CA-C-O 116.669 -1.634 . . . . 0.0 114.025 -167.604 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.2 m . . . . . 0 N--CA 1.473 0.722 0 CA-C-O 119.363 -0.351 . . . . 0.0 110.693 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 34.3 tpp -112.69 125.37 54.23 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.393 1.077 . . . . 0.0 111.294 174.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.5 m -71.95 140.1 18.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 175.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -95.49 142.79 27.43 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 125.029 1.332 . . . . 0.0 109.514 159.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.483 ' HB ' ' H ' ' A' ' 7' ' ' LEU . 76.2 p -133.93 144.14 48.65 Favored 'General case' 0 CA--C 1.514 -0.416 0 C-N-CA 126.085 1.754 . . . . 0.0 108.814 174.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . 0.496 ' H ' HD23 ' A' ' 45' ' ' LEU . . . -78.44 3.11 64.15 Favored Glycine 0 CA--C 1.534 1.249 0 CA-C-O 119.015 -0.88 . . . . 0.0 113.141 155.143 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.483 ' H ' ' HB ' ' A' ' 5' ' ' THR . 37.6 mt -61.91 153.78 71.13 Favored Pre-proline 0 CA--C 1.545 0.775 0 CA-C-N 119.881 1.841 . . . . 0.0 110.594 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -80.52 -149.5 0.04 OUTLIER 'Trans proline' 0 CA--C 1.544 1.0 0 C-N-CA 122.695 2.263 . . . . 0.0 110.419 -176.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.24 4.65 0.2 Allowed 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 115.825 1.787 . . . . 0.0 115.825 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -127.92 97.34 0.45 Allowed Glycine 0 C--N 1.338 0.648 0 C-N-CA 127.115 2.293 . . . . 0.0 109.501 171.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 61.8 p-90 -139.47 -23.84 0.87 Allowed 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 116.445 2.017 . . . . 0.0 116.445 -165.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -83.14 105.22 13.94 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 119.131 0.878 . . . . 0.0 109.366 -169.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 6.1 p -70.49 128.18 33.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 CA-C-N 119.219 0.918 . . . . 0.0 112.732 -169.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -128.46 165.09 21.34 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.767 2.027 . . . . 0.0 110.895 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 3.1 p80 -168.02 -179.52 4.17 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 126.121 1.769 . . . . 0.0 112.06 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.2 m -145.95 166.42 26.07 Favored 'General case' 0 N--CA 1.476 0.868 0 O-C-N 120.48 -1.387 . . . . 0.0 112.499 177.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -60.13 -44.22 95.07 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.844 1.257 . . . . 0.0 113.812 -174.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.5 m -87.16 -5.82 58.86 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.527 1.131 . . . . 0.0 112.751 174.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -133.8 67.75 1.51 Allowed 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.566 1.546 . . . . 0.0 110.642 -174.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -65.37 -24.81 67.34 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.407 1.483 . . . . 0.0 113.892 -174.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -74.14 119.41 76.19 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 123.819 0.847 . . . . 0.0 108.866 178.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -76.99 166.32 26.96 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 123.145 2.564 . . . . 0.0 113.98 -165.577 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 44.1 p90 -137.48 146.08 43.82 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 126.154 1.782 . . . . 0.0 110.959 171.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -93.65 118.46 31.41 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.157 -0.964 . . . . 0.0 110.578 178.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -81.33 138.67 35.65 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.719 1.208 . . . . 0.0 112.055 -175.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -92.69 117.83 67.73 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 124.424 1.089 . . . . 0.0 109.101 172.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -69.87 -46.1 1.3 Allowed 'Trans proline' 0 C--N 1.35 0.623 0 C-N-CA 121.907 1.738 . . . . 0.0 112.664 179.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -90.73 9.48 29.79 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 115.254 1.576 . . . . 0.0 115.254 -170.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 92.6 m -151.85 140.89 21.19 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.906 1.683 . . . . 0.0 109.715 -176.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 64.7 mtp85 -70.95 95.71 1.21 Allowed 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.593 0.757 . . . . 0.0 108.994 168.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -174.66 157.42 2.53 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.608 1.963 . . . . 0.0 110.452 -169.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.3 p -139.84 133.19 29.97 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 123.804 0.842 . . . . 0.0 110.394 159.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 4.3 tpp180 -81.87 117.31 22.04 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 122.231 1.015 . . . . 0.0 109.767 174.336 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -88.25 -22.25 24.05 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.573 1.549 . . . . 0.0 113.975 -170.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -160.55 156.28 22.13 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 127.608 2.363 . . . . 0.0 108.537 -164.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.32 119.46 6.46 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.058 2.505 . . . . 0.0 112.141 -170.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_endo -84.07 -168.04 0.51 Allowed 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 124.628 3.552 . . . . 0.0 111.92 -177.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -88.21 -31.43 19.08 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.062 1.345 . . . . 0.0 112.896 171.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -69.83 -3.13 14.32 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 125.302 1.441 . . . . 0.0 113.492 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.1 t -80.92 159.4 24.97 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.743 2.017 . . . . 0.0 112.112 176.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -123.68 59.7 1.11 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 127.151 2.18 . . . . 0.0 111.333 -162.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.2 mpp? -32.92 -38.15 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 116.922 2.193 . . . . 0.0 116.922 173.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.09 -40.5 67.29 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 121.269 1.85 . . . . 0.0 113.002 171.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 55.2 m -80.46 -26.31 38.39 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.918 1.687 . . . . 0.0 111.712 168.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.496 HD23 ' H ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -94.1 -24.57 17.52 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 -161.558 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.75 -13.79 62.46 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 121.744 2.066 . . . . 0.0 112.101 172.361 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 23.7 mmt -71.15 -12.17 61.34 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.171 0.988 . . . . 0.0 113.518 164.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -113.1 -50.82 2.86 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.213 1.805 . . . . 0.0 112.118 -179.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 82.8 mmm -77.09 -4.28 43.57 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.696 1.998 . . . . 0.0 114.174 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -148.28 172.66 14.01 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.325 1.85 . . . . 0.0 109.856 170.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 3.9 t -137.07 158.63 44.01 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.935 1.294 . . . . 0.0 110.198 177.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -97.26 131.1 44.3 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.568 1.147 . . . . 0.0 111.981 177.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 14.5 t-80 . . . . . 0 C--O 1.254 1.295 0 C-N-CA 125.737 1.615 . . . . 0.0 113.681 -179.605 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.5 m . . . . . 0 N--CA 1.478 0.949 0 N-CA-C 111.525 0.194 . . . . 0.0 111.525 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -102.29 174.01 6.11 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.628 1.571 . . . . 0.0 111.296 177.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 14.9 m -132.21 137.85 53.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 125.117 1.367 . . . . 0.0 111.759 173.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -98.55 122.08 41.3 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.435 1.094 . . . . 0.0 109.525 168.734 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 32.6 p -117.02 124.15 48.61 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.343 1.457 . . . . 0.0 108.701 -175.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -69.78 41.45 0.43 Allowed Glycine 0 CA--C 1.532 1.128 0 CA-C-O 118.768 -1.018 . . . . 0.0 115.381 158.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.1 mt -85.67 168.18 21.07 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 125.858 1.663 . . . . 0.0 110.432 179.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -75.26 -157.29 0.06 OUTLIER 'Trans proline' 0 CA--C 1.548 1.196 0 C-N-CA 122.576 2.184 . . . . 0.0 111.197 176.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.02 -33.98 74.12 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.541 -1.35 . . . . 0.0 112.645 173.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -80.24 62.25 4.29 Favored Glycine 0 CA--C 1.526 0.772 0 C-N-CA 125.522 1.534 . . . . 0.0 112.398 171.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 36.0 p-90 -108.14 -17.65 13.97 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 115.445 1.646 . . . . 0.0 115.445 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -72.45 103.22 3.41 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 119.282 0.946 . . . . 0.0 110.113 -167.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.3 p -67.86 120.85 15.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-N 118.589 0.632 . . . . 0.0 110.708 -174.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -107.12 139.12 42.03 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.852 1.261 . . . . 0.0 108.812 166.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 3.6 p80 -157.19 -178.95 7.74 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.53 1.132 . . . . 0.0 111.523 -169.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.6 m -135.49 174.18 10.89 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.318 1.447 . . . . 0.0 111.608 177.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -112.21 -27.62 8.27 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.729 1.211 . . . . 0.0 111.747 166.058 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.8 m -82.2 -6.16 59.01 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.534 1.134 . . . . 0.0 113.538 171.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -133.75 165.26 25.37 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 128.231 2.613 . . . . 0.0 108.794 163.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 49.3 t-20 -136.94 65.79 1.49 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.142 0.977 . . . . 0.0 111.947 -179.17 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -156.17 123.99 2.82 Favored Pre-proline 0 CA--C 1.549 0.906 0 C-N-CA 125.015 1.326 . . . . 0.0 109.43 173.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -88.6 168.21 5.98 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.73 2.953 . . . . 0.0 112.634 -173.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 44.4 p90 -139.19 132.71 30.32 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.887 0.875 . . . . 0.0 110.759 156.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -86.73 116.51 24.87 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.943 0.897 . . . . 0.0 109.242 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -101.19 142.62 32.35 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.567 1.147 . . . . 0.0 112.61 -165.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 58.5 t-20 -98.53 114.78 65.68 Favored Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 124.975 1.31 . . . . 0.0 109.3 166.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -81.34 -23.13 5.31 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 123.371 2.714 . . . . 0.0 114.298 178.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.85 -33.11 46.16 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.384 0.993 . . . . 0.0 112.115 -176.124 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 70.9 m -134.56 110.74 9.54 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 126.201 1.8 . . . . 0.0 106.36 170.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.3 mtt85 -57.24 106.9 0.37 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.615 0.766 . . . . 0.0 111.025 -172.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -166.6 153.65 9.24 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.208 1.803 . . . . 0.0 109.896 -168.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 97.4 p -124.11 163.64 21.08 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 114.439 1.274 . . . . 0.0 114.439 178.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.37 152.05 48.07 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 128.632 2.773 . . . . 0.0 108.483 176.382 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -125.3 -26.88 3.56 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -153.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 -154.15 170.49 8.36 Favored Pre-proline 0 CA--C 1.552 1.033 0 C-N-CA 130.181 3.392 . . . . 0.0 106.316 177.286 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -54.11 122.05 10.74 Favored 'Trans proline' 0 CA--C 1.546 1.118 0 C-N-CA 122.803 2.335 . . . . 0.0 112.129 172.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -90.29 -162.1 0.11 Allowed 'Trans proline' 0 CA--C 1.546 1.082 0 C-N-CA 124.215 3.276 . . . . 0.0 110.658 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -102.1 -27.06 13.13 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -178.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -80.87 10.1 5.49 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 125.637 1.575 . . . . 0.0 113.19 177.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -77.08 -177.94 4.75 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 129.687 3.195 . . . . 0.0 112.924 -177.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -90.42 -54.27 4.08 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-O 122.975 1.369 . . . . 0.0 109.548 -175.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 8.7 ttp 86.6 -43.0 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 129.711 3.204 . . . . 0.0 114.078 170.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -64.8 -48.37 74.7 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 121.494 1.952 . . . . 0.0 111.904 178.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 16.0 m -60.72 -21.58 63.09 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 125.656 1.582 . . . . 0.0 111.463 167.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 11.1 tp -93.69 -21.66 19.21 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 118.014 -0.993 . . . . 0.0 111.197 -170.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.434 ' HA ' ' HE2' ' A' ' 46' ' ' LYS . 7.9 mmpt? -60.97 -40.62 94.09 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 120.889 1.677 . . . . 0.0 111.229 171.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.7 ptt? -67.88 6.95 0.59 Allowed 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 172.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -124.11 -44.4 2.04 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.106 1.762 . . . . 0.0 112.572 172.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 92.4 mtp -66.25 -24.67 66.63 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.819 2.048 . . . . 0.0 112.496 177.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -128.61 158.44 38.48 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.588 1.555 . . . . 0.0 111.772 172.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 87.1 m -82.17 137.69 34.88 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.167 1.387 . . . . 0.0 108.625 168.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 92.5 t80 -118.36 121.9 41.5 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.036 1.334 . . . . 0.0 110.952 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.6 p80 . . . . . 0 C--O 1.249 1.04 0 C-N-CA 125.328 1.451 . . . . 0.0 113.365 -173.052 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 77.6 p . . . . . 0 N--CA 1.476 0.841 0 CA-C-O 119.798 -0.144 . . . . 0.0 111.322 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 22.5 ptt? -151.75 20.74 0.7 Allowed 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 116.491 2.034 . . . . 0.0 116.491 -162.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.0 m -82.42 151.88 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.315 0 CA-C-N 120.238 1.381 . . . . 0.0 110.87 168.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -84.1 122.59 29.02 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 122.07 -0.393 . . . . 0.0 110.351 172.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 73.7 p -126.5 146.68 50.02 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.268 1.427 . . . . 0.0 108.396 168.024 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -80.94 16.32 16.22 Favored Glycine 0 CA--C 1.532 1.148 0 N-CA-C 115.537 0.975 . . . . 0.0 115.537 150.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.4 mt -68.82 157.41 88.86 Favored Pre-proline 0 CA--C 1.548 0.894 0 CA-C-N 119.995 1.898 . . . . 0.0 110.292 -176.037 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -73.98 -170.48 0.71 Allowed 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 122.927 2.418 . . . . 0.0 109.494 177.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.43 -23.15 9.16 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -175.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -88.45 77.47 1.82 Allowed Glycine 0 CA--C 1.527 0.833 0 C-N-CA 126.173 1.844 . . . . 0.0 111.864 165.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 1.7 p90 -110.83 -8.69 14.51 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 -177.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -89.18 110.25 21.02 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 120.228 1.376 . . . . 0.0 111.338 -172.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.6 p -61.15 136.72 24.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 O-C-N 121.101 -1.0 . . . . 0.0 112.658 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -133.28 112.97 12.1 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.892 1.677 . . . . 0.0 109.848 174.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 31.1 p80 -103.77 155.2 18.78 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.415 1.086 . . . . 0.0 112.122 173.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 99.4 p -161.35 158.2 26.57 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 125.126 1.371 . . . . 0.0 110.707 -172.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.9 p30 -75.27 -18.91 59.96 Favored 'General case' 0 CA--C 1.548 0.878 0 O-C-N 120.416 -1.428 . . . . 0.0 113.538 177.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.7 m -75.86 -30.05 58.76 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.456 1.502 . . . . 0.0 112.811 -175.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -109.08 146.11 34.54 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.262 1.425 . . . . 0.0 111.239 -176.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -88.69 12.29 15.22 Favored 'General case' 0 CA--C 1.555 1.15 0 N-CA-C 114.313 1.227 . . . . 0.0 114.313 -178.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -166.33 159.26 12.16 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 127.335 2.254 . . . . 0.0 109.338 172.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -75.16 169.45 22.53 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.964 2.443 . . . . 0.0 111.576 -178.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 52.9 p90 -126.49 148.05 49.74 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.404 1.082 . . . . 0.0 111.125 168.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -103.73 107.25 18.03 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.582 0.753 . . . . 0.0 109.836 -175.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -95.3 149.75 21.0 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.929 1.692 . . . . 0.0 112.959 -165.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 61.0 t-20 -99.34 113.73 65.04 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 125.135 1.374 . . . . 0.0 110.018 171.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.2 -29.67 14.06 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.871 2.381 . . . . 0.0 113.533 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -80.91 -38.24 28.25 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -171.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 92.2 m -127.85 138.92 52.87 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.264 1.826 . . . . 0.0 107.898 169.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 84.8 mtm-85 -61.67 104.43 0.43 Allowed 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.127 0.876 . . . . 0.0 111.071 178.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -163.62 153.56 15.16 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.915 1.286 . . . . 0.0 111.983 178.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 31.4 t -133.69 152.75 51.96 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.369 1.467 . . . . 0.0 111.093 176.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.7 tpp180 -128.0 136.82 51.81 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.612 1.565 . . . . 0.0 110.486 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -126.11 0.88 7.19 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.587 1.555 . . . . 0.0 113.324 -157.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -169.17 156.28 6.69 Favored Pre-proline 0 CA--C 1.544 0.714 0 C-N-CA 128.772 2.829 . . . . 0.0 107.69 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -62.09 113.37 1.85 Allowed 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.282 2.655 . . . . 0.0 110.483 175.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -85.56 159.28 10.8 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.773 2.315 . . . . 0.0 112.253 -171.348 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.48 -22.02 41.2 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 178.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -81.36 -15.32 55.63 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 126.279 1.832 . . . . 0.0 113.797 -179.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.62 179.01 4.97 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.597 1.559 . . . . 0.0 112.989 -170.283 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -130.12 51.33 2.11 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 122.105 0.955 . . . . 0.0 111.363 -160.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.41 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 32.6 mtt -27.3 -42.28 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 128.195 2.598 . . . . 0.0 116.113 169.62 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -48.24 -42.44 30.39 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 121.316 1.871 . . . . 0.0 113.751 173.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.3 m -82.87 -26.25 31.76 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 127.216 2.207 . . . . 0.0 112.399 173.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.41 ' HB3' ' HA ' ' A' ' 42' ' ' MET . 43.9 tp -109.9 -16.51 13.84 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 124.423 1.089 . . . . 0.0 112.244 -151.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.33 -34.17 66.32 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.673 -1.267 . . . . 0.0 111.336 159.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.7 mmt -60.9 -22.31 64.21 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.614 0.766 . . . . 0.0 112.751 173.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -103.51 -36.05 8.1 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.306 1.842 . . . . 0.0 112.801 -177.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 29.2 mtp -95.34 -1.37 51.38 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.046 1.738 . . . . 0.0 114.824 -178.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -151.11 67.24 0.91 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.188 1.795 . . . . 0.0 111.686 170.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 2.1 t -78.57 -10.68 59.82 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 115.139 1.533 . . . . 0.0 115.139 -172.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -65.47 137.1 57.22 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-N 119.699 1.136 . . . . 0.0 113.027 175.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 . . . . . 0 C--O 1.249 1.069 0 C-N-CA 125.058 1.343 . . . . 0.0 113.811 -176.286 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 43.3 m . . . . . 0 N--CA 1.473 0.709 0 N-CA-C 110.533 -0.173 . . . . 0.0 110.533 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -68.9 139.31 55.13 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.747 0.819 . . . . 0.0 111.196 179.055 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 3.4 m -150.55 127.82 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 124.833 1.253 . . . . 0.0 110.606 -176.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 -69.61 123.46 21.39 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 121.777 -0.577 . . . . 0.0 110.386 175.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 73.9 p -127.99 149.69 50.24 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.666 1.586 . . . . 0.0 108.304 173.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -77.57 6.04 48.25 Favored Glycine 0 CA--C 1.529 0.938 0 CA-C-O 118.223 -1.321 . . . . 0.0 115.125 155.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 27.9 mt -62.13 150.2 84.58 Favored Pre-proline 0 CA--C 1.544 0.714 0 CA-C-N 120.141 1.971 . . . . 0.0 111.986 -168.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -70.47 159.95 51.15 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 122.17 1.913 . . . . 0.0 109.868 -176.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -52.31 -35.62 51.02 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 116.717 2.117 . . . . 0.0 116.717 -154.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -93.22 74.0 1.26 Allowed Glycine 0 CA--C 1.524 0.655 0 C-N-CA 125.894 1.711 . . . . 0.0 111.362 -177.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 11.4 p-90 -136.04 154.19 51.12 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.933 1.293 . . . . 0.0 113.556 178.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -169.76 128.07 0.93 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 129.575 3.15 . . . . 0.0 104.578 177.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.9 t -79.93 130.6 35.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 CA-C-N 120.044 1.293 . . . . 0.0 109.814 -171.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.1 mmt180 -138.07 156.95 47.27 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.808 1.243 . . . . 0.0 111.839 177.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 10.7 p-80 -168.59 152.29 5.63 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.243 1.017 . . . . 0.0 113.156 -169.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 82.6 p -171.37 163.68 6.96 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 125.772 1.629 . . . . 0.0 109.987 -170.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -65.25 -5.74 7.86 Favored 'General case' 0 CA--C 1.554 1.128 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 179.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.6 t -73.77 -19.96 60.62 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.131 1.772 . . . . 0.0 113.089 170.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.81 138.87 24.65 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 120.436 -1.415 . . . . 0.0 113.905 -178.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -76.11 -40.85 51.98 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.179 0.992 . . . . 0.0 112.854 -170.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 7.9 mp -100.92 155.21 36.58 Favored Pre-proline 0 CA--C 1.54 0.573 0 C-N-CA 125.157 1.383 . . . . 0.0 109.91 169.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -63.29 155.21 63.2 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 122.91 2.407 . . . . 0.0 111.113 175.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 34.0 p90 -116.04 140.87 48.83 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 125.832 1.653 . . . . 0.0 109.429 171.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -94.9 95.67 8.8 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.9 0.857 . . . . 0.0 108.745 -175.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -63.21 137.9 58.37 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.929 1.692 . . . . 0.0 110.171 177.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 56.3 t-20 -82.58 116.9 66.44 Favored Pre-proline 0 CA--C 1.553 1.079 0 O-C-N 121.531 -0.731 . . . . 0.0 110.044 173.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.9 -19.87 34.89 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 123.611 2.874 . . . . 0.0 114.358 -179.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -88.45 -97.71 0.09 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.708 0.803 . . . . 0.0 109.865 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.8 p -63.91 150.54 44.77 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.367 1.467 . . . . 0.0 110.696 171.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -79.74 95.25 5.92 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 121.602 -0.686 . . . . 0.0 109.243 -178.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -159.73 -177.65 6.51 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.223 1.409 . . . . 0.0 110.243 -179.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 80.3 p -158.09 146.15 18.64 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 120.422 -1.424 . . . . 0.0 112.595 177.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 15.8 tpp180 -101.26 131.69 47.15 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 127.071 2.148 . . . . 0.0 108.953 172.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 1.4 m-90 -86.05 -37.38 18.96 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 122.276 1.036 . . . . 0.0 113.476 -163.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -154.11 162.96 25.58 Favored Pre-proline 0 CA--C 1.54 0.577 0 C-N-CA 129.112 2.965 . . . . 0.0 106.709 -167.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -57.95 117.72 4.48 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 122.343 2.029 . . . . 0.0 110.547 176.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -78.79 168.63 20.71 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 124.077 3.185 . . . . 0.0 111.165 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.27 -30.28 69.35 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.648 -0.657 . . . . 0.0 112.656 170.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -65.17 -9.44 23.17 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 127.092 2.157 . . . . 0.0 115.781 -176.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.2 t -87.72 167.45 13.84 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 126.02 1.728 . . . . 0.0 112.748 -170.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -95.53 54.54 1.59 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 125.506 1.522 . . . . 0.0 110.687 -176.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 33.5 mtt -30.36 -39.0 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 127.416 2.286 . . . . 0.0 115.921 173.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -54.53 -39.19 67.41 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 121.505 1.957 . . . . 0.0 114.01 172.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 84.8 m -82.37 -16.02 50.66 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 127.616 2.366 . . . . 0.0 112.735 172.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -123.48 -20.17 5.65 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.218 -0.926 . . . . 0.0 112.833 -151.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.63 -26.34 66.95 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 120.16 -1.588 . . . . 0.0 111.524 156.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 4.4 mmt -67.09 -19.55 65.66 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.758 0.823 . . . . 0.0 112.906 170.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -104.39 -54.02 2.61 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.31 1.444 . . . . 0.0 112.139 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 68.5 mmm -65.48 -17.43 64.55 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.598 1.959 . . . . 0.0 113.448 -179.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -139.14 178.93 6.82 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.337 1.855 . . . . 0.0 110.197 172.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 20.2 p -108.21 98.88 8.36 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.369 1.067 . . . . 0.0 112.265 -172.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -81.29 171.57 14.66 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 127.528 2.331 . . . . 0.0 112.077 173.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 51.3 t-80 . . . . . 0 C--O 1.255 1.348 0 C-N-CA 124.719 1.207 . . . . 0.0 112.722 -173.457 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 75.2 m . . . . . 0 N--CA 1.474 0.755 0 CA-C-O 119.162 -0.447 . . . . 0.0 110.177 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 27.2 ttt -147.43 94.77 2.43 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.536 0.734 . . . . 0.0 111.403 176.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -161.7 148.7 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 125.737 1.615 . . . . 0.0 111.94 -166.235 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -82.94 93.78 7.6 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.283 1.033 . . . . 0.0 110.337 172.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.5 p -100.15 135.0 42.25 Favored 'General case' 0 CA--C 1.506 -0.731 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 176.105 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -76.29 26.39 1.55 Allowed Glycine 0 CA--C 1.532 1.127 0 CA-C-O 117.924 -1.487 . . . . 0.0 116.101 151.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 16.0 mt -71.58 160.36 82.81 Favored Pre-proline 0 CA--C 1.547 0.84 0 CA-C-N 121.135 2.468 . . . . 0.0 110.533 -178.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -72.94 168.98 23.28 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 120.992 1.128 . . . . 0.0 111.147 -175.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.35 -21.15 5.27 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 118.305 2.706 . . . . 0.0 118.305 -157.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -138.32 94.34 0.21 Allowed Glycine 0 N--CA 1.468 0.777 0 C-N-CA 124.87 1.224 . . . . 0.0 112.692 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 33.5 p-90 -135.06 159.59 41.02 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.095 1.358 . . . . 0.0 114.028 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -150.43 150.28 31.15 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 127.418 2.287 . . . . 0.0 107.829 166.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.3 p -87.85 146.75 5.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 CA-C-N 120.774 1.625 . . . . 0.0 110.852 172.342 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -127.98 113.17 15.49 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.73 1.612 . . . . 0.0 110.779 174.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 45.1 p-80 -78.7 149.61 32.73 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.659 0.784 . . . . 0.0 110.92 160.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.9 t -162.81 132.59 4.39 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 121.27 -0.894 . . . . 0.0 112.015 178.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 10.5 m-20 -68.28 -7.92 35.04 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.708 1.203 . . . . 0.0 113.337 176.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.8 t -75.59 -19.5 59.21 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.956 1.303 . . . . 0.0 112.833 167.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -116.78 161.02 19.92 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.67 1.588 . . . . 0.0 111.863 -170.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -89.69 -39.1 13.41 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.625 0.77 . . . . 0.0 112.247 173.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -104.69 176.43 1.75 Allowed Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 127.127 2.171 . . . . 0.0 110.102 176.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -69.58 157.91 59.06 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.456 2.104 . . . . 0.0 110.832 155.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 47.6 p90 -120.07 163.89 16.98 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.889 0.876 . . . . 0.0 109.963 157.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.9 m-85 -101.61 137.88 39.33 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 120.938 -1.102 . . . . 0.0 110.973 176.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -97.42 150.59 20.86 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.724 1.209 . . . . 0.0 109.977 169.669 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -115.2 99.13 51.95 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 124.486 1.114 . . . . 0.0 110.97 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -69.31 -22.75 33.7 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 122.419 2.079 . . . . 0.0 115.05 -173.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -75.81 -41.58 52.36 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 119.762 1.164 . . . . 0.0 113.517 -177.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 23.0 m -131.19 100.42 5.19 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 168.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -47.82 110.12 0.29 Allowed 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.533 1.533 . . . . 0.0 112.198 -171.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -174.23 177.14 2.34 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 127.834 2.453 . . . . 0.0 107.839 -169.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 69.5 p -117.69 171.53 7.97 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.898 -1.127 . . . . 0.0 112.846 170.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.5 139.69 40.69 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 127.13 2.172 . . . . 0.0 109.103 175.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -126.02 -46.57 1.67 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.155 -0.929 . . . . 0.0 112.444 -152.228 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -144.56 150.84 48.78 Favored Pre-proline 0 CA--C 1.542 0.657 0 C-N-CA 127.917 2.487 . . . . 0.0 107.478 -179.438 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -56.53 115.38 2.44 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 123.597 2.865 . . . . 0.0 112.956 -159.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -74.43 163.81 35.38 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 123.657 2.905 . . . . 0.0 112.147 -172.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.11 -21.85 65.84 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 -172.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -78.82 -21.38 47.79 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.127 1.371 . . . . 0.0 112.899 172.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -71.18 156.47 39.53 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.528 1.531 . . . . 0.0 112.926 -170.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -108.95 49.53 0.81 Allowed 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.544 1.538 . . . . 0.0 110.723 -164.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.402 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 72.3 mtm -25.29 -47.42 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 127.029 2.132 . . . . 0.0 115.296 173.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -50.19 -46.82 54.64 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 121.694 2.043 . . . . 0.0 114.5 174.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 99.2 m -68.39 -38.44 81.34 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.189 1.796 . . . . 0.0 111.665 169.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.402 ' HB3' ' HA ' ' A' ' 42' ' ' MET . 54.2 tp -94.27 -16.68 23.36 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 124.67 1.188 . . . . 0.0 110.964 -153.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.09 -28.78 66.82 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 120.512 -1.367 . . . . 0.0 112.093 161.23 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 20.3 mmt -65.46 -16.66 63.87 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 119.633 1.106 . . . . 0.0 112.509 172.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -105.61 -44.49 4.67 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.185 1.794 . . . . 0.0 112.701 177.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.6 mtp -78.61 -8.04 58.22 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.842 1.657 . . . . 0.0 113.607 -176.415 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -130.96 153.83 48.78 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.154 1.382 . . . . 0.0 112.044 175.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 9.7 t -81.59 -54.73 5.17 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.49 1.116 . . . . 0.0 111.766 179.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 62.3 t80 -76.0 127.83 33.77 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.494 1.118 . . . . 0.0 112.996 -172.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 35.6 m80 . . . . . 0 C--O 1.249 1.026 0 C-N-CA 125.794 1.638 . . . . 0.0 111.881 176.469 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 65.4 m . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 119.579 -0.248 . . . . 0.0 110.82 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 19.1 mmt -78.0 165.13 24.42 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.726 0.811 . . . . 0.0 110.248 164.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 15.9 m -142.4 135.44 27.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.84 1.256 . . . . 0.0 112.173 176.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -81.45 136.06 35.65 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.983 0.913 . . . . 0.0 110.561 164.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 62.9 p -134.84 133.15 39.43 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.659 1.584 . . . . 0.0 108.43 178.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -66.58 16.41 0.27 Allowed Glycine 0 CA--C 1.531 1.038 0 N-CA-C 115.523 0.969 . . . . 0.0 115.523 157.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 28.3 mt -67.23 156.66 87.59 Favored Pre-proline 0 CA--C 1.549 0.92 0 CA-C-N 119.909 1.855 . . . . 0.0 110.648 -176.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -80.35 -133.08 0.01 OUTLIER 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 123.17 2.58 . . . . 0.0 110.017 -179.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.99 -26.12 67.4 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -102.22 86.65 0.58 Allowed Glycine 0 C--N 1.339 0.711 0 C-N-CA 126.275 1.893 . . . . 0.0 109.534 176.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 69.5 p-90 -127.06 -28.01 2.93 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 117.226 2.306 . . . . 0.0 117.226 -167.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -83.96 112.04 19.81 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.313 0.961 . . . . 0.0 110.489 -168.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 24.1 t -61.84 132.2 27.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 O-C-N 121.615 -0.678 . . . . 0.0 111.048 -177.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 60.7 mmt-85 -132.65 132.69 42.7 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.787 1.635 . . . . 0.0 110.567 174.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -130.7 2.51 4.47 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 115.065 1.506 . . . . 0.0 115.065 -172.248 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.6 t -72.71 82.11 1.14 Allowed 'General case' 0 N--CA 1.473 0.682 0 O-C-N 120.855 -1.153 . . . . 0.0 108.054 156.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -178.19 116.57 0.08 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 127.335 2.254 . . . . 0.0 109.381 -165.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.2 m -76.5 -2.18 30.94 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 115.901 1.815 . . . . 0.0 115.901 -170.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.452 ' HG3' ' H ' ' A' ' 20' ' ' ASN . 2.0 tppp? -71.42 179.64 2.87 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 119.522 1.056 . . . . 0.0 111.983 178.257 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.452 ' H ' ' HG3' ' A' ' 19' ' ' LYS . 10.6 m120 -61.99 -43.11 99.54 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.7 1.6 . . . . 0.0 113.729 -175.042 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 10.3 mp -122.96 162.68 37.74 Favored Pre-proline 0 CA--C 1.547 0.827 0 C-N-CA 126.415 1.886 . . . . 0.0 110.866 -177.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.86 159.96 50.93 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 123.184 2.589 . . . . 0.0 111.098 168.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 34.1 p90 -108.21 146.08 33.31 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.504 1.121 . . . . 0.0 111.627 177.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -92.25 101.16 13.66 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 121.452 0.644 . . . . 0.0 109.377 177.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . 0.412 ' CE2' ' HA ' ' A' ' 27' ' ' PRO . 40.5 t80 -67.13 145.86 54.85 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.43 1.092 . . . . 0.0 111.8 -178.605 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -104.71 85.08 1.08 Allowed Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 125.944 1.697 . . . . 0.0 109.828 178.075 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.412 ' HA ' ' CE2' ' A' ' 25' ' ' PHE . 21.1 Cg_endo -62.39 -24.61 75.76 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.601 2.201 . . . . 0.0 115.694 -170.265 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.33 -13.64 60.13 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.129 1.159 . . . . 0.0 114.129 -179.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.7 m -169.54 124.44 0.82 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 127.082 2.153 . . . . 0.0 108.375 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 24.8 mmt85 -52.15 98.08 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.825 0 CA-C-O 122.702 1.239 . . . . 0.0 112.838 -174.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -163.67 178.05 8.24 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 127.572 2.349 . . . . 0.0 109.825 -174.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.3 p -149.48 174.01 12.95 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 120.531 -1.355 . . . . 0.0 113.877 173.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 20.3 tpp180 -138.5 158.7 43.76 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 128.218 2.607 . . . . 0.0 107.948 171.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -140.48 -58.73 0.53 Allowed 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.777 -0.577 . . . . 0.0 111.305 -158.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -107.55 153.89 41.09 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 126.003 1.721 . . . . 0.0 109.446 166.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -69.17 121.95 8.78 Favored 'Trans proline' 0 CA--C 1.544 1.018 0 C-N-CA 123.337 2.691 . . . . 0.0 112.059 -167.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -83.88 166.27 13.24 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 124.47 3.447 . . . . 0.0 112.358 -172.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.32 -20.81 64.77 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 115.236 1.569 . . . . 0.0 115.236 -174.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -80.96 -7.54 59.55 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 125.177 1.391 . . . . 0.0 113.773 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -74.59 170.12 16.4 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.151 1.78 . . . . 0.0 114.726 -168.311 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -105.18 50.69 0.78 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.811 1.645 . . . . 0.0 110.965 -171.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 10.2 mtm -30.02 -35.54 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 127.164 2.186 . . . . 0.0 116.238 172.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.1 -27.35 69.04 Favored 'General case' 0 CA--C 1.553 1.092 0 CA-C-N 122.734 2.516 . . . . 0.0 114.183 175.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 69.4 m -94.52 -5.16 46.67 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 128.119 2.568 . . . . 0.0 112.297 171.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 26.1 tp -131.07 -20.2 2.78 Favored 'General case' 0 C--O 1.219 -0.528 0 O-C-N 120.844 -1.16 . . . . 0.0 111.69 -155.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.01 -36.32 76.96 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 120.607 1.549 . . . . 0.0 111.308 157.092 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 15.2 ptt? -67.65 -9.68 45.47 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.347 1.059 . . . . 0.0 113.485 171.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -104.66 -46.32 4.37 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.037 1.335 . . . . 0.0 112.077 173.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 83.4 mmm -72.85 -8.61 56.37 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 127.493 2.317 . . . . 0.0 113.536 -175.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -161.42 146.98 13.89 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.734 2.014 . . . . 0.0 109.679 166.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 22.3 m -78.82 147.13 33.36 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.441 -0.787 . . . . 0.0 110.304 -178.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -70.09 146.13 51.14 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.929 0.891 . . . . 0.0 113.226 -176.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 68.2 m80 . . . . . 0 C--O 1.247 0.963 0 C-N-CA 127.559 2.344 . . . . 0.0 114.4 179.588 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.7 t . . . . . 0 N--CA 1.476 0.843 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 22.3 mmt -71.13 151.13 44.75 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.855 0.862 . . . . 0.0 110.782 167.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 15.7 t -121.58 147.47 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 125.321 1.448 . . . . 0.0 109.258 178.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 27.4 m120 -59.39 120.95 10.29 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 122.925 0.49 . . . . 0.0 110.731 173.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 75.5 p -113.11 149.48 33.47 Favored 'General case' 0 CA--C 1.509 -0.623 0 C-N-CA 125.308 1.443 . . . . 0.0 108.1 171.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . 0.499 ' H ' ' CD1' ' A' ' 45' ' ' LEU . . . -84.65 9.52 64.88 Favored Glycine 0 CA--C 1.534 1.266 0 CA-C-N 113.827 -1.533 . . . . 0.0 115.749 158.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.4 mt -65.59 150.56 95.93 Favored Pre-proline 0 CA--C 1.546 0.801 0 CA-C-N 118.946 1.373 . . . . 0.0 110.925 -168.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -77.45 177.58 8.67 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.896 1.731 . . . . 0.0 110.978 -175.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.93 -32.94 55.25 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 115.331 1.604 . . . . 0.0 115.331 -170.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -79.1 42.54 2.35 Favored Glycine 0 CA--C 1.533 1.175 0 CA-C-O 118.443 -1.198 . . . . 0.0 115.118 -177.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 1.3 p-90 -122.95 152.54 40.75 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 -176.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 179.51 119.91 0.05 Allowed 'General case' 0 CA--C 1.54 0.569 1 C-N-CA 131.753 4.021 . . . . 0.0 104.085 175.55 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 5.7 t -78.59 126.93 38.97 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 120.604 1.547 . . . . 0.0 110.979 -169.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -119.43 113.7 21.18 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.451 1.501 . . . . 0.0 110.319 172.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -88.03 163.68 16.16 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.244 1.017 . . . . 0.0 112.049 165.163 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.4 t -159.64 144.44 15.25 Favored 'General case' 0 N--CA 1.467 0.409 0 O-C-N 120.924 -1.11 . . . . 0.0 113.022 -168.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 60.5 m-20 -71.89 -7.74 50.26 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.694 0.798 . . . . 0.0 113.066 169.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.0 m -91.7 -14.64 29.67 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 120.787 -1.196 . . . . 0.0 113.511 175.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -123.71 146.79 48.0 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.637 1.108 . . . . 0.0 113.425 -162.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -81.6 -9.38 59.69 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 175.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 23.3 mt -140.98 167.9 15.96 Favored Pre-proline 0 CA--C 1.539 0.553 0 C-N-CA 126.936 2.095 . . . . 0.0 109.117 176.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -68.41 167.04 23.5 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 122.118 1.879 . . . . 0.0 110.207 163.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 39.8 p90 -126.84 157.85 38.19 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.889 1.275 . . . . 0.0 109.416 160.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -103.09 115.16 30.06 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.336 -0.852 . . . . 0.0 109.663 -177.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -76.03 134.29 40.14 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.569 1.148 . . . . 0.0 110.312 176.715 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 60.2 t-20 -87.54 114.23 57.89 Favored Pre-proline 0 CA--C 1.547 0.839 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 168.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -74.14 -34.64 4.75 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.072 1.848 . . . . 0.0 112.569 176.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -80.15 -19.23 47.69 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.023 1.12 . . . . 0.0 114.023 -171.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 26.3 m -147.63 143.83 27.97 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.847 1.659 . . . . 0.0 108.725 -174.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -70.52 44.07 0.07 Allowed 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 116.863 2.171 . . . . 0.0 116.863 -170.67 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.447 ' HG3' ' H ' ' A' ' 32' ' ' SER . 6.3 tp10 -129.07 -175.64 3.62 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.815 2.046 . . . . 0.0 111.312 -176.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.447 ' H ' ' HG3' ' A' ' 31' ' ' GLU . 78.1 p -145.68 164.96 30.15 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 126.068 1.747 . . . . 0.0 110.804 172.498 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.3 tpp180 -118.64 132.34 56.18 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.66 1.584 . . . . 0.0 109.307 177.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 1.8 m-90 -98.84 -47.54 5.25 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.472 0.709 . . . . 0.0 112.278 -156.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -128.56 173.31 5.73 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 127.259 2.224 . . . . 0.0 108.397 165.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -57.67 120.21 7.97 Favored 'Trans proline' 0 CA--C 1.55 1.313 0 C-N-CA 122.509 2.139 . . . . 0.0 111.872 172.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -81.18 167.21 17.95 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 125.211 3.941 . . . . 0.0 113.025 -173.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -69.93 -4.65 21.54 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 177.314 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -93.66 -6.08 47.18 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 127.469 2.307 . . . . 0.0 113.025 177.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.1 t -85.54 176.35 8.27 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.28 1.432 . . . . 0.0 113.171 -171.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -107.67 36.79 2.62 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.287 1.035 . . . . 0.0 111.8 -166.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 56.7 mtt -18.41 -43.33 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 130.29 3.436 . . . . 0.0 119.186 -173.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -52.28 -45.73 65.58 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-N 122.121 2.237 . . . . 0.0 112.222 170.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 23.6 m -74.65 -15.46 60.81 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 127.457 2.303 . . . . 0.0 112.894 173.221 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.499 ' CD1' ' H ' ' A' ' 6' ' ' GLY . 3.5 mm? -88.67 -17.17 30.56 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 120.127 1.33 . . . . 0.0 112.08 167.838 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.11 -17.74 62.56 Favored 'General case' 0 CA--C 1.553 1.062 0 CA-C-N 121.377 1.898 . . . . 0.0 111.931 -174.343 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 24.0 ptp -82.88 -7.52 59.65 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 127.864 2.466 . . . . 0.0 114.14 167.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 54.2 t80 -116.07 -55.07 2.44 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.65 1.98 . . . . 0.0 112.833 -173.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 93.5 mmm -68.85 5.77 1.04 Allowed 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 127.976 2.51 . . . . 0.0 113.439 173.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -158.66 151.06 21.69 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 128.346 2.659 . . . . 0.0 109.316 171.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 46.1 p -108.56 163.0 13.62 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.828 1.651 . . . . 0.0 114.315 -166.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -77.65 145.31 36.77 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.705 1.602 . . . . 0.0 112.163 173.342 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 . . . . . 0 C--O 1.252 1.188 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -168.68 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 65.3 m . . . . . 0 N--CA 1.479 0.984 0 CA-C-O 121.271 0.557 . . . . 0.0 111.607 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -140.25 159.4 42.26 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 126.096 1.758 . . . . 0.0 111.044 -177.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 25.9 m -111.51 144.18 19.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 123.347 0.659 . . . . 0.0 111.854 174.451 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -81.64 136.51 35.52 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.291 1.036 . . . . 0.0 109.735 165.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 67.4 p -146.32 150.91 36.64 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-O 122.204 1.002 . . . . 0.0 110.434 170.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . 0.491 ' H ' ' CD1' ' A' ' 45' ' ' LEU . . . -92.42 18.71 53.93 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-N 113.974 -1.466 . . . . 0.0 114.796 156.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 16.5 mt -70.38 148.93 95.73 Favored Pre-proline 0 CA--C 1.546 0.796 0 CA-C-N 119.61 1.705 . . . . 0.0 110.919 -170.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -74.61 158.0 44.0 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 121.978 1.785 . . . . 0.0 110.538 -175.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.75 -11.77 5.86 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 117.195 2.294 . . . . 0.0 117.195 -160.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -94.37 59.66 1.91 Allowed Glycine 0 CA--C 1.53 0.995 0 C-N-CA 125.148 1.356 . . . . 0.0 111.871 171.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 9.7 p-90 -133.24 165.07 25.65 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 115.534 1.679 . . . . 0.0 115.534 -177.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 176.09 172.97 0.36 Allowed 'General case' 0 CA--C 1.543 0.676 1 C-N-CA 132.564 4.345 . . . . 0.0 106.127 -177.026 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.5 t -123.99 142.99 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 125.371 1.468 . . . . 0.0 110.072 -178.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -138.68 149.09 44.76 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.935 1.694 . . . . 0.0 110.596 177.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -141.94 162.74 34.72 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -169.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.4 t -173.37 151.29 1.97 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.283 1.833 . . . . 0.0 111.714 -177.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -63.95 -15.98 60.45 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.541 1.136 . . . . 0.0 112.525 167.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.4 t -66.27 -13.99 61.28 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.752 1.621 . . . . 0.0 113.921 -177.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.3 ptmt -150.42 161.88 41.64 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.028 1.331 . . . . 0.0 112.87 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -71.9 -35.1 69.61 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 -170.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.3 mp -122.51 173.51 4.15 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 127.431 2.292 . . . . 0.0 111.151 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -75.86 171.27 18.49 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 123.269 2.646 . . . . 0.0 111.737 169.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 46.2 p90 -126.24 162.49 25.32 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.894 1.678 . . . . 0.0 110.731 166.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -105.23 150.13 25.37 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 121.388 -0.82 . . . . 0.0 112.359 -176.234 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 84.2 t80 -136.13 143.42 44.51 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.515 1.126 . . . . 0.0 112.969 -168.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 62.8 t-20 -95.18 118.0 66.59 Favored Pre-proline 0 CA--C 1.556 1.185 0 C-N-CA 123.198 0.599 . . . . 0.0 111.319 170.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -75.15 -19.61 17.37 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.205 2.604 . . . . 0.0 114.414 174.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -93.29 -15.6 25.64 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -172.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 88.5 m -154.02 142.63 20.82 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 128.113 2.565 . . . . 0.0 107.485 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 49.1 mmm-85 -68.17 100.63 1.04 Allowed 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.496 1.044 . . . . 0.0 110.666 177.399 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -165.73 149.59 8.08 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.099 1.759 . . . . 0.0 110.495 176.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 57.5 p -114.97 -179.47 3.64 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.302 1.041 . . . . 0.0 113.192 169.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 17.8 tpp180 -149.65 137.73 20.46 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.734 1.613 . . . . 0.0 109.801 178.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -129.81 -33.13 1.83 Allowed 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.069 0.948 . . . . 0.0 112.987 -154.253 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -145.43 160.09 46.25 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 129.198 2.999 . . . . 0.0 106.887 177.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -67.69 121.42 8.48 Favored 'Trans proline' 0 CA--C 1.546 1.113 0 C-N-CA 122.008 1.805 . . . . 0.0 112.43 -167.252 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -77.6 165.32 27.23 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 124.063 3.175 . . . . 0.0 111.799 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.63 -41.18 76.7 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 179.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -71.37 -0.99 11.46 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.27 1.428 . . . . 0.0 114.46 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -85.52 157.17 20.49 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.231 1.013 . . . . 0.0 111.404 177.582 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -88.46 -29.38 20.21 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-O 121.934 0.873 . . . . 0.0 113.085 -163.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 43.6 mtt 69.57 -43.71 0.53 Allowed 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 129.792 3.237 . . . . 0.0 113.72 176.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -55.99 -52.29 64.72 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 120.009 1.277 . . . . 0.0 110.9 170.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.0 m -75.13 1.24 13.75 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 172.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.491 ' CD1' ' H ' ' A' ' 6' ' ' GLY . 2.7 mm? -104.12 -22.15 13.46 Favored 'General case' 0 CA--C 1.508 -0.655 0 O-C-N 120.257 -1.527 . . . . 0.0 113.963 169.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.29 -22.92 64.7 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 120.895 1.68 . . . . 0.0 111.082 -176.562 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 22.6 ptp -76.76 -6.12 50.93 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.484 2.314 . . . . 0.0 114.731 168.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -122.69 -58.1 1.69 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.21 1.804 . . . . 0.0 113.342 -169.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 54.9 mtp -67.66 -47.74 68.66 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.891 1.277 . . . . 0.0 111.178 -175.058 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -88.74 143.64 26.78 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 148.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 2.0 t -76.78 175.43 9.43 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 121.318 0.58 . . . . 0.0 112.431 -176.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 84.7 t80 -114.79 145.15 42.44 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.916 2.087 . . . . 0.0 110.684 170.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 21.8 m170 . . . . . 0 C--O 1.25 1.13 0 CA-C-O 117.011 -1.471 . . . . 0.0 112.489 -179.339 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 64.5 p . . . . . 0 N--CA 1.474 0.745 0 N-CA-C 111.608 0.225 . . . . 0.0 111.608 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.6 6.29 0.87 Allowed 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 117.676 2.473 . . . . 0.0 117.676 -158.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.5 m -93.82 148.61 4.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 127.142 2.177 . . . . 0.0 112.652 -169.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -74.3 143.65 44.89 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.435 1.094 . . . . 0.0 111.765 166.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.8 p -147.27 143.49 28.15 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.524 1.53 . . . . 0.0 109.369 169.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . 0.431 ' H ' ' CD1' ' A' ' 45' ' ' LEU . . . -82.19 7.67 63.15 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 125.864 1.697 . . . . 0.0 116.231 160.135 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 15.5 mt -65.11 155.85 82.81 Favored Pre-proline 0 CA--C 1.553 1.088 0 CA-C-N 119.703 1.751 . . . . 0.0 111.228 -169.118 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -70.16 174.57 9.65 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.071 1.847 . . . . 0.0 111.67 -175.663 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.11 -9.48 0.4 Allowed 'General case' 0 CA--C 1.554 1.101 0 N-CA-C 117.992 2.59 . . . . 0.0 117.992 -166.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -105.07 63.95 0.31 Allowed Glycine 0 CA--C 1.531 1.092 0 C-N-CA 125.715 1.626 . . . . 0.0 112.143 170.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 66.5 p-90 -109.91 146.75 34.63 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 -171.009 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 169.2 174.14 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.749 1 C-N-CA 132.314 4.245 . . . . 0.0 106.71 173.544 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.6 p -141.36 143.06 28.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 CA-C-N 119.581 1.082 . . . . 0.0 112.289 175.014 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -137.72 162.91 32.63 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.958 1.703 . . . . 0.0 111.189 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -145.86 172.34 13.48 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.98 1.312 . . . . 0.0 112.245 178.199 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.2 p -157.4 172.74 18.05 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.871 -1.143 . . . . 0.0 113.152 -177.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -73.48 -14.38 61.22 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 121.304 -0.872 . . . . 0.0 112.497 170.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 26.6 m -79.55 -31.04 41.95 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 -171.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -143.6 146.47 33.31 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.308 1.843 . . . . 0.0 110.056 -173.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -79.26 -27.64 42.34 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.222 1.409 . . . . 0.0 112.864 179.14 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -75.62 149.42 83.59 Favored Pre-proline 0 CA--C 1.546 0.824 0 O-C-N 121.4 -0.813 . . . . 0.0 111.043 170.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -73.99 -179.55 4.75 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 123.891 3.061 . . . . 0.0 110.302 167.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 54.1 p90 -135.64 140.81 44.83 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.041 0.936 . . . . 0.0 110.85 159.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -84.58 119.66 25.46 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -90.54 127.96 36.41 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 124.097 0.959 . . . . 0.0 111.699 -169.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 59.7 t-20 -89.94 118.0 68.56 Favored Pre-proline 0 CA--C 1.549 0.931 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 170.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -79.32 -33.91 1.24 Allowed 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.609 2.206 . . . . 0.0 113.034 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -90.77 -18.2 25.35 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -168.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.7 m -138.31 137.56 37.52 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 126.989 2.116 . . . . 0.0 107.643 172.734 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.25 88.79 0.85 Allowed 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.778 0.831 . . . . 0.0 110.143 -175.938 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -161.04 170.82 19.75 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.391 1.477 . . . . 0.0 110.383 -172.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 18.4 p -151.01 137.14 18.34 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.296 1.039 . . . . 0.0 111.227 173.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 19.7 tpp180 -99.29 149.38 23.18 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.534 1.934 . . . . 0.0 109.641 -178.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -120.79 -30.0 4.54 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.666 1.186 . . . . 0.0 113.502 -165.657 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -149.49 153.27 36.79 Favored Pre-proline 0 CA--C 1.541 0.626 0 C-N-CA 126.477 1.911 . . . . 0.0 109.636 -172.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -64.47 117.08 4.16 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 123.932 3.088 . . . . 0.0 112.171 -169.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -78.78 170.76 17.63 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.856 3.037 . . . . 0.0 111.852 -179.446 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.57 -32.7 74.46 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -178.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -76.15 -10.79 59.69 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 -177.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -76.86 178.59 6.74 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 125.977 1.711 . . . . 0.0 114.491 -171.118 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -126.57 58.64 1.39 Allowed 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.408 1.483 . . . . 0.0 111.991 -168.172 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -29.62 -40.62 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.075 1.75 . . . . 0.0 114.802 163.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 65.3 tt0 -45.51 -46.56 13.95 Favored 'General case' 0 CA--C 1.551 0.996 0 CA-C-N 120.479 1.49 . . . . 0.0 114.436 169.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 98.1 m -86.17 -13.21 47.71 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 127.556 2.342 . . . . 0.0 113.337 175.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.431 ' CD1' ' H ' ' A' ' 6' ' ' GLY . 37.1 tp -123.94 -17.36 6.31 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 121.3 -0.875 . . . . 0.0 112.211 -151.536 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.34 -39.17 72.39 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.371 -1.456 . . . . 0.0 109.749 153.227 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.8 mmt -63.36 8.13 0.08 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.062 1.745 . . . . 0.0 113.856 171.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -133.75 -44.28 0.81 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.233 1.813 . . . . 0.0 112.46 176.408 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.1 mtt -85.94 -21.82 27.72 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.719 2.008 . . . . 0.0 114.266 -177.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -165.37 66.29 0.12 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.281 1.832 . . . . 0.0 110.173 -177.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.8 m -63.35 124.64 21.8 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.58 1.152 . . . . 0.0 113.768 -159.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -82.4 150.42 27.13 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.322 1.849 . . . . 0.0 111.876 168.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 32.6 m170 . . . . . 0 C--O 1.257 1.488 0 C-N-CA 126.76 2.024 . . . . 0.0 111.527 175.766 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 75.4 p . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 116.836 -1.554 . . . . 0.0 109.625 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 83.4 mtp -62.7 150.05 42.1 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 121.85 2.114 . . . . 0.0 112.581 173.206 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.1 t -125.15 154.13 33.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.025 0 C-N-CA 126.311 1.844 . . . . 0.0 109.96 179.442 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -70.44 148.55 48.2 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.544 -0.722 . . . . 0.0 111.08 165.615 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 77.9 p -141.55 150.56 42.26 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.016 1.726 . . . . 0.0 108.057 173.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . 0.476 ' H ' ' CD1' ' A' ' 45' ' ' LEU . . . -87.35 28.8 5.53 Favored Glycine 0 CA--C 1.525 0.671 0 CA-C-O 117.548 -1.695 . . . . 0.0 114.359 154.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.7 mt -76.0 159.65 80.19 Favored Pre-proline 0 CA--C 1.547 0.828 0 CA-C-N 120.333 2.067 . . . . 0.0 110.75 -175.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -68.86 174.97 7.94 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 122.644 2.23 . . . . 0.0 111.575 -179.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.61 33.37 0.05 Allowed 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 116.28 1.956 . . . . 0.0 116.28 -167.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -166.08 99.25 0.16 Allowed Glycine 0 CA--C 1.532 1.153 0 C-N-CA 125.968 1.747 . . . . 0.0 111.872 170.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 19.4 p-90 -155.58 147.46 23.28 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 115.208 1.558 . . . . 0.0 115.208 -175.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -159.9 150.52 18.96 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 128.843 2.857 . . . . 0.0 106.809 168.364 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 18.9 t -102.85 120.2 52.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 CA-C-N 120.561 1.528 . . . . 0.0 110.862 -170.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.4 mmp_? -111.86 115.75 29.51 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.572 0.749 . . . . 0.0 111.623 176.649 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 4.0 p80 -155.74 158.94 39.03 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.775 2.03 . . . . 0.0 110.945 175.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 41.7 p -137.53 170.31 16.29 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.586 0.708 . . . . 0.0 112.815 -173.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -58.87 -24.71 62.52 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.13 0.972 . . . . 0.0 113.452 167.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 67.9 m -91.47 -6.42 52.68 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.205 1.402 . . . . 0.0 113.7 176.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -163.16 111.59 1.27 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.499 1.519 . . . . 0.0 111.034 173.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -64.06 -33.28 75.39 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.714 0.806 . . . . 0.0 112.888 175.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.44 114.3 20.93 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 123.186 0.595 . . . . 0.0 111.239 -167.613 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -77.37 139.61 18.68 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 123.208 2.605 . . . . 0.0 111.425 -172.556 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 55.9 p90 -105.19 135.34 46.74 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 153.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -90.15 100.4 13.23 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 121.67 -0.644 . . . . 0.0 110.212 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -63.5 129.4 40.03 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.049 1.34 . . . . 0.0 110.979 -179.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 58.4 t-20 -88.29 121.52 70.31 Favored Pre-proline 0 CA--C 1.556 1.193 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 174.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -79.27 -19.96 10.11 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 124.509 3.472 . . . . 0.0 113.559 178.124 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -91.67 -40.74 11.12 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.834 0.854 . . . . 0.0 111.969 -175.031 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.8 m -120.33 142.23 49.32 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.614 1.966 . . . . 0.0 109.104 175.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 -65.09 97.67 0.26 Allowed 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.277 1.031 . . . . 0.0 110.265 168.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -175.21 158.5 2.4 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.892 2.077 . . . . 0.0 109.542 -172.188 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 88.1 p -134.16 118.28 17.49 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 120.789 -1.194 . . . . 0.0 112.568 168.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 11.2 tpp180 -70.02 128.5 36.54 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.898 1.679 . . . . 0.0 109.576 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -90.57 -45.76 8.72 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.922 1.289 . . . . 0.0 111.743 -167.061 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -152.67 163.22 24.22 Favored Pre-proline 0 CA--C 1.549 0.919 0 C-N-CA 128.128 2.571 . . . . 0.0 107.898 -165.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -60.63 123.37 12.88 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 122.942 2.428 . . . . 0.0 113.578 -168.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -87.12 162.45 8.63 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 124.612 3.541 . . . . 0.0 113.413 178.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.51 -6.92 2.67 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 125.441 1.496 . . . . 0.0 114.917 172.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -104.89 9.08 34.82 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.344 1.858 . . . . 0.0 113.613 179.302 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -90.13 -179.91 5.77 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.551 1.94 . . . . 0.0 111.314 179.115 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -103.54 -34.12 8.78 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 120.149 -1.594 . . . . 0.0 112.663 -169.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' MET . . . . . 0.4 ' HA ' ' HB3' ' A' ' 45' ' ' LEU 0.252 90.3 mtp 60.76 -38.45 0.1 Allowed 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 129.118 2.967 . . . . 0.0 115.577 -170.994 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -64.07 -53.33 51.5 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 122.382 2.355 . . . . 0.0 111.498 -178.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.2 m -65.3 -7.15 12.0 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 125.563 1.545 . . . . 0.0 112.937 170.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.476 ' CD1' ' H ' ' A' ' 6' ' ' GLY . 10.8 tp -112.6 -27.18 8.3 Favored 'General case' 0 C--O 1.217 -0.613 0 O-C-N 120.894 -1.128 . . . . 0.0 112.256 -166.461 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.68 -40.13 96.12 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 120.853 1.661 . . . . 0.0 110.378 170.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 14.6 ptm -63.72 -6.96 6.34 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 126.052 1.741 . . . . 0.0 114.941 169.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -108.7 -50.47 3.01 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.356 1.463 . . . . 0.0 111.985 174.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 85.1 mtp -62.62 -36.89 84.24 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 127.167 2.187 . . . . 0.0 112.029 -178.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.56 88.08 7.02 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 156.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 15.0 t -84.6 -9.78 57.97 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.497 1.519 . . . . 0.0 114.591 -165.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 10.3 t80 -87.54 126.27 34.82 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 118.881 0.764 . . . . 0.0 112.122 175.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 12.7 m80 . . . . . 0 C--O 1.252 1.185 0 C-N-CA 126.602 1.961 . . . . 0.0 112.145 -172.319 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.2 m . . . . . 0 N--CA 1.472 0.668 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 92.6 mtp -98.84 152.68 19.46 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.64 1.176 . . . . 0.0 112.931 -168.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 32.9 m -84.26 165.28 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 123.847 0.859 . . . . 0.0 111.541 173.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -139.49 154.11 47.65 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.678 0.791 . . . . 0.0 109.836 160.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 62.2 p -133.78 126.71 31.2 Favored 'General case' 0 CA--C 1.51 -0.567 0 C-N-CA 124.811 1.244 . . . . 0.0 109.046 -174.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -66.83 5.93 2.24 Favored Glycine 0 CA--C 1.532 1.124 0 C-N-CA 125.229 1.395 . . . . 0.0 114.445 163.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 31.8 mt -63.19 155.98 70.99 Favored Pre-proline 0 CA--C 1.551 0.983 0 CA-C-N 118.917 1.358 . . . . 0.0 110.391 175.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -79.35 -135.62 0.02 OUTLIER 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 123.452 2.768 . . . . 0.0 110.495 -178.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.97 -26.21 66.7 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 120.806 -1.184 . . . . 0.0 114.144 177.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -93.04 83.53 1.09 Allowed Glycine 0 C--N 1.338 0.651 0 C-N-CA 125.609 1.576 . . . . 0.0 109.493 176.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -136.38 -13.18 1.8 Allowed 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 117.583 2.438 . . . . 0.0 117.583 -166.8 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -92.09 117.85 30.25 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.834 1.197 . . . . 0.0 109.809 -170.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 20.9 t -75.12 123.3 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 O-C-N 121.047 -1.033 . . . . 0.0 110.691 -164.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.6 mmt180 -130.75 153.27 49.19 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.05 1.34 . . . . 0.0 110.259 176.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 32.1 p-80 -144.02 169.77 17.19 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.375 1.07 . . . . 0.0 112.78 -173.1 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.2 t -162.62 149.85 13.47 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.1 1.36 . . . . 0.0 111.521 -176.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.2 m120 -67.23 -19.22 65.5 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.236 -0.915 . . . . 0.0 111.925 170.549 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.5 m -88.31 9.84 21.82 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 125.136 1.375 . . . . 0.0 113.368 177.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.8 tptm -147.84 125.15 11.55 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.912 1.285 . . . . 0.0 111.196 179.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 53.7 m-80 -66.61 -8.07 24.73 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 115.782 1.771 . . . . 0.0 115.782 -169.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -157.53 165.53 18.53 Favored Pre-proline 0 CA--C 1.549 0.918 0 C-N-CA 126.8 2.04 . . . . 0.0 109.999 -173.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -77.99 159.55 30.62 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 123.152 2.568 . . . . 0.0 111.995 -175.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 51.5 p90 -123.69 143.61 50.16 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 126.048 1.739 . . . . 0.0 110.225 171.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -97.55 100.37 11.78 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.537 -0.727 . . . . 0.0 109.98 -173.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -63.55 137.01 57.96 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.887 1.675 . . . . 0.0 112.233 -173.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 57.5 t-20 -95.97 122.41 58.45 Favored Pre-proline 0 CA--C 1.547 0.836 0 C-N-CA 124.061 0.944 . . . . 0.0 108.793 167.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -78.34 -36.69 0.89 Allowed 'Trans proline' 0 CA--C 1.534 0.514 0 C-N-CA 122.498 2.132 . . . . 0.0 113.093 176.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -85.25 -12.63 52.05 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -169.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 30.3 m -135.19 141.14 45.8 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.608 1.963 . . . . 0.0 108.282 173.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -66.73 89.15 0.15 Allowed 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.476 1.035 . . . . 0.0 109.651 170.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -171.92 179.13 2.8 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.664 1.585 . . . . 0.0 110.114 -172.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.2 p -160.5 173.77 15.06 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.851 1.66 . . . . 0.0 109.825 172.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.6 tpp180 -125.88 138.31 53.79 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.368 1.067 . . . . 0.0 110.608 -172.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -104.71 -32.06 9.06 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.34 1.456 . . . . 0.0 112.99 -163.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -143.72 162.06 43.35 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 128.476 2.71 . . . . 0.0 107.866 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.67 114.76 1.99 Allowed 'Trans proline' 0 CA--C 1.549 1.273 0 C-N-CA 123.306 2.671 . . . . 0.0 111.218 166.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -79.09 -166.9 0.44 Allowed 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 124.776 3.651 . . . . 0.0 111.974 -177.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -81.61 -18.44 44.71 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 177.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -95.01 7.58 45.64 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.118 1.767 . . . . 0.0 113.355 -174.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.2 t -96.73 162.02 13.61 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 126.58 1.952 . . . . 0.0 112.836 -174.188 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -89.25 -34.47 16.61 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 121.287 0.565 . . . . 0.0 112.129 -157.79 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . 0.26 28.6 mtt 61.55 -37.03 0.11 Allowed 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 130.148 3.379 . . . . 0.0 115.675 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -60.82 -29.07 69.25 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.838 1.255 . . . . 0.0 112.065 168.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.4 m -102.86 26.16 8.43 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.681 1.592 . . . . 0.0 112.109 168.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 76.4 mt -129.4 -20.09 3.36 Favored 'General case' 0 CA--C 1.507 -0.674 0 O-C-N 119.507 -1.995 . . . . 0.0 115.554 170.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.74 -27.1 67.34 Favored 'General case' 0 CA--C 1.556 1.178 0 CA-C-N 123.092 2.678 . . . . 0.0 111.743 177.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 26.3 ptm -59.24 -14.62 11.6 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 128.053 2.541 . . . . 0.0 115.21 164.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -127.36 -57.15 1.3 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.688 1.595 . . . . 0.0 113.122 -165.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 67.7 mmm -66.04 -10.87 44.1 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 127.361 2.265 . . . . 0.0 114.981 -175.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.02 110.62 5.13 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.003 1.321 . . . . 0.0 109.527 169.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 55.4 m -69.97 -51.75 29.98 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.936 1.294 . . . . 0.0 113.808 -162.845 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -98.86 -13.82 19.9 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 -166.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 54.1 t-80 . . . . . 0 C--O 1.253 1.243 0 C-N-CA 126.447 1.899 . . . . 0.0 111.436 174.175 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 22.8 m . . . . . 0 N--CA 1.48 1.05 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 22.0 m120 -94.37 133.83 37.53 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.312 1.045 . . . . 0.0 110.468 168.203 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.445 HG22 ' CD2' ' A' ' 48' ' ' TYR . 24.6 p -134.89 128.26 32.27 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.471 1.509 . . . . 0.0 108.635 174.745 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -73.25 47.65 1.37 Allowed Glycine 0 CA--C 1.525 0.69 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.871 158.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.8 mt -82.83 171.15 12.4 Favored Pre-proline 0 CA--C 1.545 0.765 0 O-C-N 121.586 -0.95 . . . . 0.0 109.711 171.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -66.39 153.0 79.68 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 N-CA-C 108.656 -1.325 . . . . 0.0 108.656 171.13 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.28 -25.65 3.96 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 116.067 1.877 . . . . 0.0 116.067 -165.032 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -77.36 57.03 3.72 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 125.028 1.299 . . . . 0.0 112.612 166.714 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 2.4 p90 -96.33 149.84 21.23 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.368 1.067 . . . . 0.0 113.343 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 174.42 99.16 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 130.089 3.355 . . . . 0.0 107.27 168.457 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 39.4 t -69.46 115.53 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 CA-C-N 119.112 0.869 . . . . 0.0 111.066 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -106.05 176.61 5.11 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.223 1.809 . . . . 0.0 109.636 165.141 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 16.9 p80 -161.84 147.21 13.28 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.954 -1.092 . . . . 0.0 112.299 -178.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.2 m -70.14 156.59 38.98 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -177.764 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -62.3 -46.14 90.1 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.349 1.06 . . . . 0.0 112.762 -176.478 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.1 m -130.17 -28.11 2.17 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.933 1.293 . . . . 0.0 112.936 -170.768 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.3 mttm -74.87 149.68 39.46 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 126.0 1.72 . . . . 0.0 111.476 172.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -96.07 -5.88 39.9 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 118.466 2.765 . . . . 0.0 118.466 -153.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -100.02 158.13 32.61 Favored Pre-proline 0 N--CA 1.481 1.114 0 CA-C-N 120.876 1.671 . . . . 0.0 112.374 177.471 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -77.41 174.99 11.86 Favored 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 124.018 3.145 . . . . 0.0 110.934 169.274 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 16.8 p90 -142.17 137.23 30.71 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.912 0.885 . . . . 0.0 110.247 159.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -98.76 102.62 14.41 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.057 -1.027 . . . . 0.0 110.378 -171.053 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -75.54 131.3 39.95 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.428 1.091 . . . . 0.0 111.287 -177.133 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 60.5 t-20 -87.66 121.18 71.1 Favored Pre-proline 0 CA--C 1.546 0.807 0 CA-C-O 118.652 -0.689 . . . . 0.0 109.648 167.133 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -76.63 -35.09 2.2 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 122.595 2.196 . . . . 0.0 113.204 174.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -90.51 -15.88 29.91 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 -169.706 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.0 m -132.47 138.88 47.75 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.538 1.935 . . . . 0.0 107.207 171.454 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 35.7 mtp-105 -70.41 87.74 0.64 Allowed 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 118.554 0.616 . . . . 0.0 110.421 175.188 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -165.79 170.54 13.83 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.96 2.104 . . . . 0.0 111.7 -172.019 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 79.6 p -152.97 155.86 37.77 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.01 1.324 . . . . 0.0 112.043 177.423 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -124.85 147.23 48.88 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 126.741 2.016 . . . . 0.0 109.315 -177.717 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -113.57 -34.61 5.49 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 113.221 0.822 . . . . 0.0 113.221 -160.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -144.03 167.11 16.17 Favored Pre-proline 0 CA--C 1.554 1.126 0 C-N-CA 129.416 3.087 . . . . 0.0 106.878 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -65.12 116.99 4.16 Favored 'Trans proline' 0 CA--C 1.553 1.448 0 C-N-CA 123.06 2.507 . . . . 0.0 113.029 -175.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -87.4 179.94 2.91 Favored 'Trans proline' 0 C--N 1.357 1.003 1 C-N-CA 125.468 4.112 . . . . 0.0 114.036 -175.797 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.76 -29.72 70.27 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.452 1.278 . . . . 0.0 114.452 175.246 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -76.82 0.04 22.2 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.89 1.276 . . . . 0.0 114.105 177.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.4 169.88 14.13 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.521 1.529 . . . . 0.0 112.458 -173.282 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -125.72 56.53 1.39 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.283 1.833 . . . . 0.0 110.907 -171.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.437 ' HA ' ' HB2' ' A' ' 45' ' ' LEU . 62.5 mtm -25.97 -42.44 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.424 0 C-N-CA 127.771 2.428 . . . . 0.0 116.538 171.489 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -53.57 -53.83 46.13 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 121.787 2.085 . . . . 0.0 112.032 172.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.8 m -71.95 -6.73 44.14 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 126.51 1.924 . . . . 0.0 112.238 173.136 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.437 ' HB2' ' HA ' ' A' ' 42' ' ' MET . 71.7 mt -95.81 -20.9 18.47 Favored 'General case' 0 CA--C 1.507 -0.681 0 O-C-N 120.254 -1.529 . . . . 0.0 113.954 166.628 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -68.15 -38.17 81.85 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 121.812 2.096 . . . . 0.0 109.707 -172.173 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 23.7 ptm -60.16 -13.01 9.98 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 128.422 2.689 . . . . 0.0 115.342 165.37 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.445 ' CD2' HG22 ' A' ' 5' ' ' THR . 39.8 t80 -110.42 -65.44 1.16 Allowed 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.016 1.726 . . . . 0.0 112.348 -177.616 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 55.5 mtp -63.17 -17.19 62.11 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 128.102 2.561 . . . . 0.0 114.752 -172.1 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -128.23 148.48 50.63 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.071 1.348 . . . . 0.0 111.081 173.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 90.6 m . . . . . 0 N--CA 1.478 0.961 0 C-N-CA 124.947 1.299 . . . . 0.0 110.924 -176.836 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 17.7 m . . . . . 0 N--CA 1.479 0.977 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 37.8 t-20 -95.0 154.58 17.11 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.121 1.368 . . . . 0.0 109.766 159.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.412 HG22 ' CD2' ' A' ' 48' ' ' TYR . 70.4 p -134.22 135.4 42.95 Favored 'General case' 0 CA--C 1.509 -0.626 0 C-N-CA 124.735 1.214 . . . . 0.0 109.129 170.333 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -81.01 45.24 3.15 Favored Glycine 0 CA--C 1.526 0.745 0 CA-C-N 114.528 -1.215 . . . . 0.0 111.966 155.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.9 mt -93.41 165.56 18.0 Favored Pre-proline 0 CA--C 1.553 1.093 0 CA-C-N 119.831 1.815 . . . . 0.0 110.256 173.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_endo -77.48 -153.86 0.05 OUTLIER 'Trans proline' 0 CA--C 1.548 1.188 0 C-N-CA 123.797 2.998 . . . . 0.0 111.457 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.12 -15.93 38.65 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.246 1.418 . . . . 0.0 114.733 173.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -108.29 83.2 0.32 Allowed Glycine 0 C--N 1.337 0.603 0 C-N-CA 126.524 2.012 . . . . 0.0 110.568 173.595 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -124.22 0.42 8.39 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 115.157 1.539 . . . . 0.0 115.157 -179.778 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -80.51 102.55 9.8 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.786 0.721 . . . . 0.0 110.438 -172.474 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 75.8 t -66.3 131.06 32.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 O-C-N 121.572 -0.705 . . . . 0.0 111.422 -172.341 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.7 mmt-85 -131.11 120.66 23.69 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.339 1.856 . . . . 0.0 109.312 172.834 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -92.03 14.03 17.07 Favored 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 -176.238 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.6 m -73.07 107.29 5.34 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.539 -1.35 . . . . 0.0 111.049 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 55.0 t-20 174.85 135.7 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 128.714 2.806 . . . . 0.0 107.133 -172.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 42.4 m -59.21 -24.92 63.54 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.09 1.356 . . . . 0.0 113.376 168.691 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.5 mmtt -103.01 141.06 36.44 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.14 1.376 . . . . 0.0 110.532 178.537 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -79.16 24.52 0.33 Allowed 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 -154.791 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -111.97 146.0 33.91 Favored Pre-proline 0 CA--C 1.544 0.726 0 C-N-CA 124.921 1.289 . . . . 0.0 110.509 171.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -76.87 166.71 26.48 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 123.587 2.858 . . . . 0.0 112.208 176.223 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 46.0 p90 -107.43 159.24 16.55 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.306 153.259 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -100.93 125.4 47.5 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 171.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' PHE . . . . . 0.4 ' CE2' ' HA ' ' A' ' 27' ' ' PRO . 24.7 t80 -83.35 142.59 30.94 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 121.433 -0.792 . . . . 0.0 111.388 177.537 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -96.46 92.39 1.07 Allowed Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 126.041 1.736 . . . . 0.0 110.117 170.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.4 ' HA ' ' CE2' ' A' ' 25' ' ' PHE . 9.8 Cg_endo -54.7 -22.72 29.99 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.691 2.928 . . . . 0.0 115.827 -176.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -94.57 -4.85 47.13 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 115.402 1.63 . . . . 0.0 115.402 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.6 m -143.68 149.05 36.65 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 119.701 1.137 . . . . 0.0 111.11 -164.404 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 55.0 mtp180 -83.97 67.75 9.75 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 121.05 -1.031 . . . . 0.0 110.346 171.107 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -159.14 169.08 24.97 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 126.748 2.019 . . . . 0.0 109.777 -176.415 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 92.6 p -140.68 161.15 38.45 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.93 -1.106 . . . . 0.0 113.394 172.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -120.08 158.18 27.38 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.505 1.922 . . . . 0.0 110.221 178.635 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -144.5 -17.16 0.55 Allowed 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 114.368 1.248 . . . . 0.0 114.368 -160.101 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -154.7 161.4 29.47 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 128.159 2.584 . . . . 0.0 107.12 -173.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -70.64 117.52 5.18 Favored 'Trans proline' 0 CA--C 1.548 1.199 0 C-N-CA 123.05 2.5 . . . . 0.0 111.956 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -83.73 -161.07 0.13 Allowed 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 124.77 3.647 . . . . 0.0 112.476 -178.321 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -95.1 -21.82 18.29 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 120.51 -1.368 . . . . 0.0 114.02 -178.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -76.99 0.13 22.33 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.998 1.719 . . . . 0.0 112.862 169.526 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -82.63 172.75 12.61 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 126.968 2.107 . . . . 0.0 111.973 -178.904 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -129.94 65.72 1.49 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.103 1.761 . . . . 0.0 111.253 -173.771 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.433 ' HA ' ' HB2' ' A' ' 45' ' ' LEU . 41.1 mtm -37.83 -35.88 0.16 Allowed 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 116.582 2.067 . . . . 0.0 116.582 174.622 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -68.28 -12.71 61.47 Favored 'General case' 0 CA--C 1.56 1.346 0 CA-C-N 121.481 1.946 . . . . 0.0 114.081 176.221 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 31.9 m -107.42 -2.41 20.54 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 128.019 2.528 . . . . 0.0 111.837 166.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.433 ' HB2' ' HA ' ' A' ' 42' ' ' MET . 79.4 mt -98.68 -18.43 18.05 Favored 'General case' 0 CA--C 1.507 -0.698 0 CA-C-O 115.871 -2.014 . . . . 0.0 114.48 171.402 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.417 ' HE2' ' HA ' ' A' ' 46' ' ' LYS . 7.4 mmpt? -68.85 -37.28 79.02 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 123.392 2.814 . . . . 0.0 110.601 -175.705 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 23.1 ptp -51.86 -22.43 3.75 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.469 1.908 . . . . 0.0 114.054 164.763 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.412 ' CD2' HG22 ' A' ' 5' ' ' THR . 43.1 t80 -104.11 -70.03 0.78 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 126.497 1.919 . . . . 0.0 112.66 -178.109 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 12.9 mtt -66.05 -15.53 63.14 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 128.129 2.572 . . . . 0.0 115.265 -174.652 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -162.5 60.3 0.22 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.97 1.308 . . . . 0.0 111.351 -177.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 5.8 m . . . . . 0 N--CA 1.48 1.051 0 C-N-CA 128.877 2.871 . . . . 0.0 115.187 -159.537 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.479 0.994 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -70.55 146.37 50.2 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.496 0.719 . . . . 0.0 111.713 169.84 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 63.6 p -136.83 142.55 42.87 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.857 1.663 . . . . 0.0 109.257 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.602 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -75.24 16.98 3.3 Favored Glycine 0 CA--C 1.535 1.29 0 CA-C-O 118.486 -1.175 . . . . 0.0 115.635 152.837 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 16.4 mt -71.88 156.12 91.34 Favored Pre-proline 0 CA--C 1.547 0.865 0 CA-C-N 120.391 2.095 . . . . 0.0 110.252 -177.725 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -78.67 -150.82 0.04 OUTLIER 'Trans proline' 0 CA--C 1.548 1.198 0 C-N-CA 122.872 2.382 . . . . 0.0 111.503 -172.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.73 -22.97 58.91 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 120.517 -1.364 . . . . 0.0 114.678 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -102.53 81.53 0.39 Allowed Glycine 0 C--N 1.34 0.761 0 C-N-CA 126.445 1.974 . . . . 0.0 110.542 174.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 10.2 p-90 -130.33 -6.96 4.26 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.73 1.381 . . . . 0.0 114.73 -175.675 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.2 tp10 -75.67 103.25 5.69 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 118.993 0.815 . . . . 0.0 109.191 -175.144 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.0 p -66.47 134.78 29.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.179 0.591 . . . . 0.0 111.589 -174.241 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -130.5 125.83 35.33 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.667 1.587 . . . . 0.0 110.179 176.66 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 28.1 p-80 -88.04 -11.52 46.98 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.248 1.419 . . . . 0.0 114.668 -173.437 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 44.6 m -51.19 108.09 0.23 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.918 1.287 . . . . 0.0 112.997 -174.186 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.1 p30 152.26 140.78 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 131.619 3.967 . . . . 0.0 109.835 -179.234 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 38.0 m -70.07 -15.9 63.06 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.709 1.604 . . . . 0.0 112.897 168.073 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.4 ttmt -79.1 -166.17 0.88 Allowed 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.71 1.204 . . . . 0.0 112.463 -179.34 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.1 m120 -94.93 -30.32 14.21 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 -154.729 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -114.77 156.16 45.3 Favored Pre-proline 0 N--CA 1.475 0.782 0 C-N-CA 124.662 1.185 . . . . 0.0 111.776 -177.071 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -79.57 -173.68 1.97 Allowed 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 123.828 3.018 . . . . 0.0 110.562 171.297 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 45.7 p90 -133.39 149.87 51.82 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.281 1.432 . . . . 0.0 110.05 161.1 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -93.34 132.13 37.85 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 121.313 -0.867 . . . . 0.0 110.312 174.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -100.42 147.92 25.31 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.514 1.125 . . . . 0.0 111.681 178.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.4 t-20 -102.47 110.02 61.96 Favored Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 123.914 0.885 . . . . 0.0 110.265 162.302 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -63.97 -29.94 66.81 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 123.137 2.558 . . . . 0.0 114.613 177.092 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.4 -30.77 57.6 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 -172.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 95.6 m -147.1 105.39 3.77 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 126.248 1.819 . . . . 0.0 107.616 177.024 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -47.18 104.56 0.05 Allowed 'General case' 0 C--O 1.237 0.419 0 C-N-CA 128.147 2.579 . . . . 0.0 111.927 -171.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -171.59 158.09 4.97 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.968 1.707 . . . . 0.0 109.799 -171.065 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 92.6 p -127.3 162.19 26.84 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 174.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 8.1 tpp85 -134.31 150.21 50.94 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 126.725 2.01 . . . . 0.0 109.249 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -142.54 -18.28 0.7 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.561 1.144 . . . . 0.0 112.863 -156.62 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -149.54 155.96 39.03 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 128.179 2.592 . . . . 0.0 107.504 -175.482 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -66.03 121.75 9.14 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.823 2.349 . . . . 0.0 110.87 178.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -80.07 167.91 19.4 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 123.545 2.83 . . . . 0.0 111.494 175.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.39 -28.17 68.42 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -176.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -71.48 -24.89 62.07 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.24 1.816 . . . . 0.0 113.859 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.41 164.38 23.14 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 127.034 2.134 . . . . 0.0 113.96 -163.913 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -107.88 53.42 0.69 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.216 1.407 . . . . 0.0 111.24 -162.555 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.428 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 77.4 mtm -27.2 -40.38 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 129.045 2.938 . . . . 0.0 115.103 166.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -50.61 -47.58 58.21 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 121.555 1.979 . . . . 0.0 113.542 173.219 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 21.5 m -78.52 -21.04 49.45 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 128.04 2.536 . . . . 0.0 112.162 176.047 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.602 HD13 ' N ' ' A' ' 6' ' ' GLY . 38.3 tp -117.48 -21.4 8.64 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 123.976 0.91 . . . . 0.0 111.3 -150.321 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.9 -35.48 69.03 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 120.598 1.544 . . . . 0.0 111.015 157.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 8.5 mmt -60.43 -24.96 65.61 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 172.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -97.36 -45.48 6.45 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.858 1.663 . . . . 0.0 112.78 -178.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 35.1 mtt -76.33 -17.25 59.51 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.268 1.827 . . . . 0.0 112.697 -177.03 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -104.3 165.01 11.33 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.044 1.338 . . . . 0.0 110.398 157.095 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.48 1.072 0 C-N-CA 125.078 1.351 . . . . 0.0 113.343 178.407 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 18.5 t . . . . . 0 N--CA 1.472 0.65 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.8 m120 -53.26 131.02 36.63 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 122.093 -0.38 . . . . 0.0 111.29 168.29 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 44.7 p -129.39 146.59 51.23 Favored 'General case' 0 CA--C 1.508 -0.668 0 C-N-CA 125.508 1.523 . . . . 0.0 108.337 171.439 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.412 ' H ' HD23 ' A' ' 45' ' ' LEU . . . -94.47 52.92 2.08 Favored Glycine 0 CA--C 1.524 0.616 0 CA-C-N 113.795 -1.548 . . . . 0.0 111.5 154.562 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.447 ' HG ' HD21 ' A' ' 45' ' ' LEU . 15.0 mt -88.63 169.06 14.24 Favored Pre-proline 0 CA--C 1.551 1.013 0 CA-C-N 118.699 1.25 . . . . 0.0 110.311 175.46 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -75.8 -158.34 0.08 OUTLIER 'Trans proline' 0 CA--C 1.548 1.209 0 C-N-CA 121.726 1.618 . . . . 0.0 110.801 177.416 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.4 12.8 0.54 Allowed 'General case' 0 CA--C 1.551 1.002 0 N-CA-C 115.657 1.725 . . . . 0.0 115.657 -172.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -142.14 102.32 0.3 Allowed Glycine 0 C--N 1.334 0.472 0 C-N-CA 126.046 1.784 . . . . 0.0 109.276 173.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 52.7 p-90 -141.64 -2.47 1.21 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.411 1.484 . . . . 0.0 114.264 -171.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.09 161.25 11.21 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.576 0.751 . . . . 0.0 110.927 159.487 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.5 m -118.51 149.28 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.37 1.068 . . . . 0.0 112.866 -173.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.406 ' HB2' ' CE1' ' A' ' 23' ' ' TYR . 22.9 mmt85 -141.44 118.89 11.53 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.473 1.909 . . . . 0.0 110.196 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 16.4 p-80 -74.52 166.16 23.99 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 113.631 0.974 . . . . 0.0 113.631 175.529 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 29.0 t -160.49 130.88 5.34 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 125.46 1.504 . . . . 0.0 110.176 176.448 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -58.9 -24.44 62.32 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 -176.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 69.5 m -71.94 -15.79 62.09 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.944 1.298 . . . . 0.0 114.063 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -108.21 168.03 9.59 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.566 1.546 . . . . 0.0 113.045 -171.23 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -92.97 -9.94 38.15 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 169.196 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -160.77 164.64 18.82 Favored Pre-proline 0 CA--C 1.55 0.947 0 C-N-CA 126.906 2.082 . . . . 0.0 109.598 -177.773 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.57 162.68 40.69 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 122.782 2.321 . . . . 0.0 113.125 -177.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.406 ' CE1' ' HB2' ' A' ' 14' ' ' ARG . 33.2 p90 -95.24 157.57 15.84 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.805 0.842 . . . . 0.0 110.953 160.925 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -83.0 143.42 30.65 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 121.683 -0.636 . . . . 0.0 110.388 171.645 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -116.83 145.2 43.7 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.301 1.04 . . . . 0.0 112.493 -174.728 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -101.13 98.15 8.31 Favored Pre-proline 0 CA--C 1.552 1.031 0 C-N-CA 124.702 1.201 . . . . 0.0 110.447 176.699 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -66.72 -29.67 42.55 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 122.692 2.261 . . . . 0.0 115.137 -167.839 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.73 -24.38 41.66 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.868 1.432 . . . . 0.0 114.868 -176.292 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.8 m -146.47 126.68 13.85 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 125.274 1.43 . . . . 0.0 109.51 178.766 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -50.36 101.12 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.196 1.798 . . . . 0.0 112.736 -176.712 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -168.08 154.48 7.54 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 127.019 2.128 . . . . 0.0 110.749 179.515 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 82.4 p -129.53 151.55 50.02 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.878 1.271 . . . . 0.0 112.735 176.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 18.0 tpp180 -126.34 146.35 50.07 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 127.471 2.308 . . . . 0.0 109.831 -176.022 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -130.62 -36.33 1.43 Allowed 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -158.228 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -146.28 150.53 41.52 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 126.554 1.942 . . . . 0.0 107.861 -178.037 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -48.27 112.61 0.62 Allowed 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 124.817 3.678 . . . . 0.0 114.391 -174.534 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -80.14 163.45 22.66 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 123.488 2.792 . . . . 0.0 112.203 -177.199 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.84 -22.71 66.87 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.058 1.132 . . . . 0.0 114.058 -178.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -90.75 -1.03 57.88 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.207 1.803 . . . . 0.0 113.998 -174.447 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.86 -173.6 1.93 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 126.009 1.723 . . . . 0.0 113.794 -170.659 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -119.09 60.27 0.82 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 126.149 1.78 . . . . 0.0 110.229 177.763 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 59.6 mtt -31.96 -46.33 0.12 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.901 1.68 . . . . 0.0 113.93 168.083 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -53.6 -36.58 62.11 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 120.351 1.432 . . . . 0.0 113.995 177.398 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 75.9 m -85.65 -28.19 24.91 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.28 1.432 . . . . 0.0 111.822 171.212 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.447 HD21 ' HG ' ' A' ' 7' ' ' LEU . 81.3 mt -72.31 -14.19 61.68 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 119.818 1.19 . . . . 0.0 112.536 174.846 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.24 -18.18 64.49 Favored 'General case' 0 CA--C 1.55 0.954 0 CA-C-N 120.624 1.556 . . . . 0.0 111.988 -175.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 93.3 mmm -79.84 -8.77 59.48 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 128.146 2.578 . . . . 0.0 113.688 168.205 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.406 ' HD2' HD22 ' A' ' 45' ' ' LEU . 67.9 t80 -121.27 -56.25 1.91 Allowed 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.786 2.034 . . . . 0.0 113.095 -166.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 88.3 mmm -67.16 -11.79 58.26 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.986 2.115 . . . . 0.0 113.267 178.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.3 151.0 40.0 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.636 1.974 . . . . 0.0 110.338 159.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 5.0 m . . . . . 0 N--CA 1.47 0.543 0 C-N-CA 124.929 1.292 . . . . 0.0 110.229 -175.156 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 17.0 m . . . . . 0 N--CA 1.474 0.774 0 CA-C-O 121.035 0.445 . . . . 0.0 111.475 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.7 m120 -111.24 128.66 56.0 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.113 0.965 . . . . 0.0 109.667 164.313 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 24.4 p -115.37 127.98 55.76 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.664 1.586 . . . . 0.0 108.217 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -76.33 55.0 3.23 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 110.797 -0.921 . . . . 0.0 110.797 158.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.8 mt -93.07 166.66 15.85 Favored Pre-proline 0 CA--C 1.55 0.964 0 CA-C-N 118.745 1.273 . . . . 0.0 110.905 176.264 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -77.24 -141.45 0.02 OUTLIER 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 123.526 2.817 . . . . 0.0 110.211 176.69 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.09 -21.43 64.97 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 120.451 -1.406 . . . . 0.0 113.675 177.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -98.52 81.33 0.6 Allowed Glycine 0 C--N 1.337 0.603 0 C-N-CA 126.974 2.226 . . . . 0.0 110.146 172.528 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 52.0 p-90 -119.46 -16.5 8.92 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 116.69 2.108 . . . . 0.0 116.69 -171.091 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -80.96 127.13 32.22 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 118.91 0.777 . . . . 0.0 110.759 -175.502 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.8 m -89.16 130.67 38.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 O-C-N 121.412 -0.805 . . . . 0.0 111.633 -166.674 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 80.8 mmt-85 -141.28 158.61 43.66 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.215 1.006 . . . . 0.0 112.254 -173.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 8.6 p80 -172.39 137.6 0.87 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.73 2.012 . . . . 0.0 112.118 177.107 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.9 m -70.18 159.3 34.21 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.672 -0.642 . . . . 0.0 111.968 175.396 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -68.47 -20.23 64.6 Favored 'General case' 0 CA--C 1.547 0.83 0 O-C-N 120.664 -1.272 . . . . 0.0 114.389 -176.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.4 m -78.89 -0.95 32.84 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.415 1.486 . . . . 0.0 113.756 173.21 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 59.9 mmtt -135.41 169.87 16.82 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.619 1.968 . . . . 0.0 112.751 -171.62 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -131.52 -29.76 1.73 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.435 1.494 . . . . 0.0 113.111 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -77.99 128.2 79.53 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 126.369 1.868 . . . . 0.0 110.071 178.401 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -80.99 159.26 20.86 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 123.188 2.592 . . . . 0.0 114.829 -170.555 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 34.1 p90 -116.63 153.26 32.59 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.816 1.647 . . . . 0.0 109.824 154.475 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 33.3 m-85 -110.84 112.2 23.89 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.167 0.987 . . . . 0.0 110.192 -172.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -79.84 137.25 36.9 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.071 1.748 . . . . 0.0 112.928 -171.086 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -93.35 109.87 43.07 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 124.479 1.112 . . . . 0.0 110.048 171.767 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.43 -37.21 10.28 Favored 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 121.771 1.647 . . . . 0.0 112.322 175.019 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.42 -21.81 62.78 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 116.028 1.862 . . . . 0.0 116.028 -170.431 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 31.6 m -153.67 146.46 24.33 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.256 1.823 . . . . 0.0 108.613 -173.254 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -70.86 87.08 0.71 Allowed 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.008 0.822 . . . . 0.0 111.844 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -166.23 178.98 5.93 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.839 2.056 . . . . 0.0 109.766 176.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 26.1 p -156.96 149.85 23.7 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.297 1.439 . . . . 0.0 112.552 170.76 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.7 tpp180 -101.32 135.67 42.43 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.626 2.37 . . . . 0.0 109.664 -176.675 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -102.03 -30.77 11.0 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 121.114 -0.991 . . . . 0.0 113.513 -167.172 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -148.58 156.7 41.92 Favored Pre-proline 0 CA--C 1.539 0.55 0 C-N-CA 126.938 2.095 . . . . 0.0 108.087 -161.777 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -67.27 120.72 7.8 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 122.195 1.93 . . . . 0.0 110.69 -173.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -78.19 170.13 19.15 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 122.873 2.382 . . . . 0.0 110.776 173.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -72.65 -27.9 62.4 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.554 -0.716 . . . . 0.0 111.768 164.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -65.23 -0.18 1.64 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 127.716 2.407 . . . . 0.0 114.648 179.14 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -88.53 172.84 9.03 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 126.658 1.983 . . . . 0.0 113.547 -170.246 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -107.09 48.43 0.84 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 127.288 2.235 . . . . 0.0 111.178 -171.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.414 ' HA ' ' HB2' ' A' ' 45' ' ' LEU . 69.1 mtm -29.38 -43.19 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 118.099 2.629 . . . . 0.0 118.099 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -49.29 -47.29 47.03 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 123.062 2.665 . . . . 0.0 111.912 174.174 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 36.6 m -77.66 -22.07 51.18 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 126.028 1.731 . . . . 0.0 111.713 178.26 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.414 ' HB2' ' HA ' ' A' ' 42' ' ' MET . 66.8 mt -82.19 -21.46 36.46 Favored 'General case' 0 CA--C 1.506 -0.741 0 CA-C-O 117.625 -1.179 . . . . 0.0 113.245 171.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.71 -10.13 57.1 Favored 'General case' 0 CA--C 1.554 1.134 0 CA-C-N 121.197 1.817 . . . . 0.0 111.38 176.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.2 mmm -89.33 5.64 44.1 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 127.922 2.489 . . . . 0.0 113.066 167.398 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 49.6 t80 -135.42 -58.35 0.78 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 126.36 1.864 . . . . 0.0 113.031 -172.844 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 36.0 mtp -72.29 -4.68 31.09 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 127.829 2.452 . . . . 0.0 112.322 172.325 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -154.6 -165.99 2.21 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 129.168 2.987 . . . . 0.0 108.055 166.275 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 29.1 p . . . . . 0 N--CA 1.474 0.73 0 C-N-CA 124.497 1.119 . . . . 0.0 111.23 170.874 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.0 m . . . . . 0 N--CA 1.469 0.514 0 CA-C-O 121.499 0.666 . . . . 0.0 110.541 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.2 m120 -78.48 132.5 37.28 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.407 0.683 . . . . 0.0 109.503 166.693 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.517 ' HB ' ' H ' ' A' ' 7' ' ' LEU . 71.9 p -132.59 144.21 50.22 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 126.733 2.013 . . . . 0.0 108.588 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -81.22 8.69 57.32 Favored Glycine 0 CA--C 1.536 1.366 0 CA-C-N 115.093 -0.958 . . . . 0.0 113.622 156.593 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.517 ' H ' ' HB ' ' A' ' 5' ' ' THR . 30.4 mt -61.96 155.17 64.76 Favored Pre-proline 0 CA--C 1.542 0.669 0 CA-C-N 119.902 1.851 . . . . 0.0 110.696 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -70.36 179.18 4.21 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 121.098 1.199 . . . . 0.0 112.308 -169.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.88 -39.74 69.01 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.453 1.101 . . . . 0.0 113.049 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -82.15 68.16 3.56 Favored Glycine 0 CA--C 1.526 0.747 0 C-N-CA 125.405 1.479 . . . . 0.0 111.649 174.466 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -143.25 163.8 31.95 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 171.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 175.73 140.85 0.06 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 131.22 3.808 . . . . 0.0 106.231 164.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 9.1 p -81.54 141.74 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 CA-C-N 120.195 1.361 . . . . 0.0 112.172 -174.019 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -142.74 102.54 4.06 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.704 1.202 . . . . 0.0 111.934 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 76.5 m-70 -72.41 112.45 8.48 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.938 0.895 . . . . 0.0 111.892 175.55 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 29.2 t -59.63 151.23 25.28 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 -167.326 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -73.88 -36.95 64.86 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.053 1.341 . . . . 0.0 111.451 165.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.2 t -86.29 -25.13 25.64 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -175.545 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -133.67 153.45 51.67 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.299 1.039 . . . . 0.0 112.002 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -80.63 52.61 1.7 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 124.424 1.09 . . . . 0.0 111.471 176.474 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -154.16 135.29 8.69 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 125.245 1.418 . . . . 0.0 110.16 -158.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -82.04 131.37 6.88 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 123.33 2.687 . . . . 0.0 112.635 174.291 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 53.8 p90 -96.36 165.48 12.17 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 122.892 0.477 . . . . 0.0 110.11 151.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -105.19 129.84 53.48 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.321 -0.862 . . . . 0.0 110.65 170.439 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -87.86 139.41 30.55 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.579 1.151 . . . . 0.0 110.44 174.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -99.13 108.0 47.33 Favored Pre-proline 0 CA--C 1.551 1.015 0 O-C-N 121.855 -0.528 . . . . 0.0 109.858 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -73.48 -36.62 3.78 Favored 'Trans proline' 0 C--N 1.354 0.853 0 C-N-CA 122.512 2.141 . . . . 0.0 112.581 174.356 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.26 -26.24 64.67 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -174.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 76.9 m -150.21 132.0 15.04 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 127.904 2.482 . . . . 0.0 106.861 -176.111 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -65.0 97.89 0.26 Allowed 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.604 1.093 . . . . 0.0 110.633 -177.101 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -171.63 172.65 4.91 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 126.472 1.909 . . . . 0.0 110.542 -167.105 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 36.6 p -140.02 143.96 36.68 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 120.823 -1.173 . . . . 0.0 111.862 166.073 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 20.2 tpp180 -107.33 143.49 35.53 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 126.788 2.035 . . . . 0.0 110.218 -178.354 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -127.3 -6.54 5.91 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.41 1.484 . . . . 0.0 114.528 -166.025 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -165.98 168.92 7.25 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 127.763 2.425 . . . . 0.0 107.941 -173.221 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -68.01 122.38 9.47 Favored 'Trans proline' 0 CA--C 1.546 1.093 0 C-N-CA 122.07 1.846 . . . . 0.0 111.239 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -82.12 174.77 9.77 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 124.505 3.47 . . . . 0.0 111.465 176.205 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.37 -44.46 88.87 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 176.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -68.96 -11.48 60.74 Favored 'General case' 0 CA--C 1.553 1.066 0 N-CA-C 115.645 1.72 . . . . 0.0 115.645 -167.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.3 t -75.83 164.29 26.38 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 126.382 1.873 . . . . 0.0 114.872 -164.594 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -115.17 56.57 0.74 Allowed 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.749 2.02 . . . . 0.0 111.174 -163.277 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.405 ' HA ' ' HB2' ' A' ' 45' ' ' LEU . 27.0 mtt -30.86 -40.75 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.87 1.668 . . . . 0.0 114.805 169.32 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -39.65 -54.75 1.99 Allowed 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 126.412 1.885 . . . . 0.0 114.082 166.778 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 95.6 m -78.79 -31.06 45.85 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.961 2.104 . . . . 0.0 111.409 170.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.405 ' HB2' ' HA ' ' A' ' 42' ' ' MET . 0.3 OUTLIER -80.03 -19.99 46.38 Favored 'General case' 0 C--O 1.224 -0.251 0 O-C-N 121.171 -0.956 . . . . 0.0 112.58 -162.972 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.25 -27.41 67.93 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 120.707 1.594 . . . . 0.0 112.17 175.387 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 95.6 mmm -62.05 -8.03 4.79 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.714 1.205 . . . . 0.0 113.816 167.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -115.85 -59.55 1.98 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.615 1.966 . . . . 0.0 111.547 178.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -7.45 41.81 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.247 1.819 . . . . 0.0 113.99 -178.713 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -138.45 53.58 1.79 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.469 1.508 . . . . 0.0 110.238 167.429 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 7.4 m . . . . . 0 N--CA 1.476 0.874 0 C-N-CA 125.245 1.418 . . . . 0.0 110.647 -174.426 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 3.4 t . . . . . 0 N--CA 1.474 0.758 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -70.32 128.72 37.19 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 122.09 -0.382 . . . . 0.0 111.188 175.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 24.5 p -133.03 132.49 41.9 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 127.206 2.202 . . . . 0.0 107.843 -176.207 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.537 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -68.86 34.12 0.29 Allowed Glycine 0 CA--C 1.532 1.142 0 CA-C-O 118.435 -1.203 . . . . 0.0 115.651 155.363 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.7 mt -83.77 165.04 41.84 Favored Pre-proline 0 CA--C 1.548 0.872 0 CA-C-N 119.633 1.716 . . . . 0.0 109.61 177.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -77.95 -147.15 0.03 OUTLIER 'Trans proline' 0 CA--C 1.545 1.036 0 C-N-CA 121.608 1.539 . . . . 0.0 109.128 174.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.28 -21.04 64.82 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.212 -1.555 . . . . 0.0 112.91 173.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -80.94 68.79 3.36 Favored Glycine 0 CA--C 1.527 0.805 0 C-N-CA 126.025 1.774 . . . . 0.0 111.545 170.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 12.1 p-90 -120.37 -12.43 8.99 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 116.588 2.07 . . . . 0.0 116.588 -173.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -70.3 114.91 8.9 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 120.077 1.308 . . . . 0.0 110.448 -179.122 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 6.0 t -72.16 134.17 30.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 CA-C-N 119.168 0.895 . . . . 0.0 109.826 178.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.2 mmt85 -131.9 128.98 39.71 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 125.087 1.355 . . . . 0.0 111.331 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 38.0 p-80 -62.8 137.57 58.3 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 121.771 -0.58 . . . . 0.0 110.476 159.259 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.8 t -97.69 150.93 20.64 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.037 -1.04 . . . . 0.0 112.391 -174.128 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -69.03 -41.41 77.72 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.388 -0.82 . . . . 0.0 110.156 162.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 85.1 p -106.91 -3.73 19.9 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 115.691 1.738 . . . . 0.0 115.691 -158.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.5 ttmm -138.43 146.34 42.03 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.484 1.038 . . . . 0.0 113.564 -169.773 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -88.1 46.67 1.41 Allowed 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.74 1.616 . . . . 0.0 111.946 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 16.6 tp -170.63 151.9 3.67 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 128.258 2.623 . . . . 0.0 107.322 -171.453 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -71.18 166.37 29.42 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 121.607 1.538 . . . . 0.0 110.645 169.039 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 17.2 p90 -127.86 160.93 30.27 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.725 1.21 . . . . 0.0 109.949 164.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -103.98 139.44 39.11 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.6 -0.688 . . . . 0.0 110.537 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -118.04 142.19 47.66 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.658 1.583 . . . . 0.0 111.581 -172.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 65.0 t-20 -98.15 109.41 51.84 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 124.576 1.15 . . . . 0.0 110.362 171.874 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -75.79 -26.22 9.92 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 123.087 2.525 . . . . 0.0 113.243 177.45 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.83 -29.4 40.17 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 118.948 0.795 . . . . 0.0 112.771 -175.762 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.9 m -143.27 88.99 2.06 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.144 1.378 . . . . 0.0 108.707 174.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -32.7 103.1 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 128.557 2.743 . . . . 0.0 114.005 -173.542 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -173.19 165.13 4.87 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.299 1.84 . . . . 0.0 109.821 -170.559 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 57.1 p -120.38 173.4 7.17 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.482 1.513 . . . . 0.0 113.352 175.659 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.05 141.28 17.48 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.837 2.055 . . . . 0.0 109.254 -178.268 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -134.5 -25.92 1.46 Allowed 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -151.772 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -142.91 152.75 59.64 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 127.976 2.51 . . . . 0.0 107.556 172.157 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -51.04 113.0 0.91 Allowed 'Trans proline' 0 CA--C 1.544 1.012 0 C-N-CA 124.19 3.26 . . . . 0.0 112.923 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -79.15 169.39 19.17 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 123.34 2.693 . . . . 0.0 111.924 -176.37 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.94 -38.02 81.2 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -78.44 0.13 27.04 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 127.463 2.305 . . . . 0.0 114.5 -175.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.78 174.7 10.19 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 126.008 1.723 . . . . 0.0 111.063 178.214 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -103.6 -35.6 8.23 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 120.949 -1.095 . . . . 0.0 112.402 -166.74 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.521 ' HA ' ' HB3' ' A' ' 45' ' ' LEU 0.263 33.7 mtt 60.99 -40.05 0.11 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 128.542 2.737 . . . . 0.0 115.741 -176.9 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -62.23 -51.99 65.53 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 122.343 2.338 . . . . 0.0 111.783 177.288 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.0 m -66.53 -11.16 51.34 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 125.91 1.684 . . . . 0.0 112.175 169.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.537 HD13 ' N ' ' A' ' 6' ' ' GLY . 8.6 tp -105.06 -23.76 12.89 Favored 'General case' 0 N--CA 1.447 -0.602 0 O-C-N 120.942 -1.099 . . . . 0.0 111.225 -170.771 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.24 -37.7 88.26 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 120.957 1.708 . . . . 0.0 110.213 169.534 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 25.1 ptp -69.87 18.31 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 126.101 1.761 . . . . 0.0 114.573 166.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -138.28 -32.38 0.72 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.691 1.997 . . . . 0.0 112.297 171.544 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 93.4 mmm -95.12 -8.95 34.99 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 127.287 2.235 . . . . 0.0 115.095 -179.331 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -141.23 165.6 27.07 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 120.327 1.421 . . . . 0.0 113.179 -176.824 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 10.9 t . . . . . 0 N--CA 1.479 0.989 0 C-N-CA 125.118 1.367 . . . . 0.0 113.288 -170.116 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.8 m . . . . . 0 N--CA 1.479 1.01 0 CA-C-O 120.616 0.246 . . . . 0.0 111.459 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -83.39 140.65 32.27 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.201 0.6 . . . . 0.0 110.345 167.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.576 ' HB ' ' H ' ' A' ' 7' ' ' LEU . 63.1 p -139.98 141.76 36.36 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 122.727 1.251 . . . . 0.0 109.714 170.787 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.662 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -73.76 4.14 31.17 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-N 113.785 -1.552 . . . . 0.0 116.074 152.083 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.576 ' H ' ' HB ' ' A' ' 5' ' ' THR . 15.1 mt -71.02 153.9 94.43 Favored Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 120.708 2.254 . . . . 0.0 109.074 -173.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -77.3 -152.23 0.04 OUTLIER 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 122.253 1.969 . . . . 0.0 109.989 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.09 -30.98 71.38 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 120.871 -1.143 . . . . 0.0 113.198 -178.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -91.74 74.26 1.54 Allowed Glycine 0 C--N 1.339 0.737 0 C-N-CA 126.799 2.142 . . . . 0.0 112.271 174.19 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 55.1 p-90 -109.71 -19.56 13.13 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 117.237 2.31 . . . . 0.0 117.237 -174.637 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -87.04 116.62 25.21 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 119.821 1.192 . . . . 0.0 111.198 -167.381 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.8 p -67.41 131.36 32.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 119.449 1.022 . . . . 0.0 112.306 -177.244 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.3 mmt180 -139.36 162.01 36.06 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.109 1.763 . . . . 0.0 111.469 -173.26 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -142.78 165.01 28.56 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.118 1.367 . . . . 0.0 111.74 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.4 m -136.08 173.9 11.21 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.27 1.428 . . . . 0.0 112.877 -169.349 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 10.4 p-10 -81.92 -11.51 58.86 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 115.581 1.697 . . . . 0.0 115.581 -171.191 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.3 t -127.27 -31.84 2.52 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -178.804 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.5 tttp -60.14 155.16 17.86 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.513 1.525 . . . . 0.0 112.208 170.729 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -106.63 -28.2 10.37 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.126 0.97 . . . . 0.0 113.502 175.177 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 8.5 mp -95.64 160.49 30.25 Favored Pre-proline 0 N--CA 1.476 0.843 0 C-N-CA 125.604 1.562 . . . . 0.0 111.972 175.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -79.11 174.26 12.34 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 123.324 2.683 . . . . 0.0 112.272 168.218 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 39.7 p90 -147.75 152.22 37.37 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.72 2.408 . . . . 0.0 109.876 172.442 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 -87.06 141.51 28.61 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.129 -0.982 . . . . 0.0 110.689 173.649 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -124.16 146.15 48.85 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.78 1.632 . . . . 0.0 111.52 -170.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 57.4 t-20 -97.94 113.73 64.14 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 124.066 0.947 . . . . 0.0 111.401 177.186 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -70.41 -30.37 19.36 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 123.159 2.573 . . . . 0.0 113.552 178.067 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.28 -51.25 10.42 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.231 0.923 . . . . 0.0 112.036 -176.302 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 23.2 m -117.55 125.63 51.15 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.584 1.554 . . . . 0.0 107.917 177.585 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 46.4 mtm105 -62.89 107.56 1.01 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.956 1.253 . . . . 0.0 109.873 177.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -174.06 162.77 3.86 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 129.304 3.042 . . . . 0.0 109.127 -173.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 30.9 p -128.51 175.66 8.36 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.781 1.233 . . . . 0.0 114.234 -179.106 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.55 145.24 25.0 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 127.298 2.239 . . . . 0.0 109.06 174.057 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 2.0 m-90 -111.7 -23.26 10.74 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 121.295 -0.878 . . . . 0.0 113.162 -155.188 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -157.77 167.41 14.55 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 131.545 3.938 . . . . 0.0 106.373 -175.278 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -62.12 120.09 7.51 Favored 'Trans proline' 0 CA--C 1.551 1.328 0 CA-C-N 121.954 1.734 . . . . 0.0 110.201 172.081 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -85.37 -167.99 0.46 Allowed 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 124.391 3.394 . . . . 0.0 112.486 -171.301 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -75.06 -47.0 31.03 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 121.282 -0.886 . . . . 0.0 113.35 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -63.65 -13.08 39.3 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.03 1.332 . . . . 0.0 114.315 -175.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -71.0 164.94 24.52 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 127.872 2.469 . . . . 0.0 112.646 -171.114 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -110.05 24.87 12.45 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.267 -0.895 . . . . 0.0 112.482 -154.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.606 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 51.6 mtt -5.35 -45.39 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.508 1 C-N-CA 132.103 4.161 . . . . 0.0 120.059 -176.122 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -55.65 -42.66 75.34 Favored 'General case' 0 CA--C 1.55 0.96 0 CA-C-N 122.657 2.48 . . . . 0.0 112.564 170.677 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.3 m -73.33 -7.9 53.58 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 127.876 2.47 . . . . 0.0 113.25 172.714 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.662 HD13 ' N ' ' A' ' 6' ' ' GLY . 11.4 tp -121.71 -24.16 5.36 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 120.994 -1.066 . . . . 0.0 111.734 -163.471 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -57.81 -42.95 85.33 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 120.163 1.347 . . . . 0.0 110.091 163.801 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 21.7 ptp -61.83 -9.48 6.8 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.518 1.527 . . . . 0.0 114.521 172.267 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.0 t80 -109.65 -44.03 3.94 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.456 1.503 . . . . 0.0 112.885 176.35 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 12.2 mmt -78.22 -36.42 47.17 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.369 1.868 . . . . 0.0 113.328 -175.253 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -95.4 161.8 13.93 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.458 1.103 . . . . 0.0 112.557 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 38.0 p . . . . . 0 N--CA 1.479 1.016 0 N-CA-C 115.482 1.66 . . . . 0.0 115.482 -174.353 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.8 m . . . . . 0 N--CA 1.478 0.958 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 56.0 m-80 -72.17 135.82 46.27 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.658 0.742 . . . . 0.0 111.887 173.275 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 77.1 p -124.02 148.41 47.04 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 126.751 2.02 . . . . 0.0 107.349 174.737 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.637 ' H ' HD13 ' A' ' 45' ' ' LEU . . . -76.62 2.47 58.54 Favored Glycine 0 CA--C 1.532 1.15 0 CA-C-O 118.681 -1.066 . . . . 0.0 114.545 157.257 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.434 ' HG ' HD11 ' A' ' 45' ' ' LEU . 14.7 mt -61.31 153.71 66.86 Favored Pre-proline 0 CA--C 1.541 0.611 0 CA-C-N 119.383 1.592 . . . . 0.0 110.012 -171.722 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -71.42 162.25 42.93 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 CA-C-N 120.009 1.039 . . . . 0.0 109.632 -176.25 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.77 -25.82 8.36 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 115.555 1.687 . . . . 0.0 115.555 -169.435 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -82.38 72.27 2.84 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 124.181 0.896 . . . . 0.0 111.119 166.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 2.1 p-90 -142.3 153.09 43.6 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.603 1.161 . . . . 0.0 114.113 169.188 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 174.72 124.96 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 130.589 3.556 . . . . 0.0 105.254 176.091 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 35.4 t -73.99 129.65 36.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 CA-C-N 121.329 1.877 . . . . 0.0 110.586 -174.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.0 mmt-85 -114.09 132.94 55.86 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 126.029 1.732 . . . . 0.0 111.349 171.262 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -102.85 25.45 9.27 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.564 1.546 . . . . 0.0 112.201 170.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.1 m -77.98 54.24 1.28 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.21 1.804 . . . . 0.0 114.151 -171.521 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -155.59 138.0 14.91 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 126.468 1.907 . . . . 0.0 108.452 -177.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 17.6 t -62.45 -32.88 73.82 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 125.715 1.606 . . . . 0.0 111.706 170.749 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -70.73 143.12 51.38 Favored 'General case' 0 CA--C 1.547 0.865 0 O-C-N 121.049 -1.032 . . . . 0.0 110.828 167.468 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -82.17 32.78 0.39 Allowed 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.366 1.466 . . . . 0.0 114.475 -165.161 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -107.6 157.88 34.71 Favored Pre-proline 0 N--CA 1.474 0.741 0 C-N-CA 125.821 1.648 . . . . 0.0 110.869 175.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -86.92 172.18 6.53 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 123.622 2.882 . . . . 0.0 110.329 164.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 49.0 p90 -142.21 165.54 27.15 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.027 1.331 . . . . 0.0 109.214 151.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -98.8 125.08 44.07 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 120.782 -1.199 . . . . 0.0 110.475 176.303 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -74.11 149.23 41.16 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 120.64 -1.288 . . . . 0.0 110.709 168.02 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -99.02 96.91 4.48 Favored Pre-proline 0 CA--C 1.545 0.765 0 C-N-CA 122.996 0.518 . . . . 0.0 110.365 173.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -66.49 -29.45 44.77 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.453 2.102 . . . . 0.0 112.519 171.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.54 -19.11 62.92 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 -174.877 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.5 m -174.27 130.31 0.37 Allowed 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 129.042 2.937 . . . . 0.0 106.476 177.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 55.5 mtt85 -61.33 108.55 0.95 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.946 0.898 . . . . 0.0 111.011 -170.042 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -170.98 -180.0 2.93 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 130.552 3.541 . . . . 0.0 106.752 -170.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 14.8 m -149.97 130.25 13.71 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 119.463 -2.023 . . . . 0.0 111.963 165.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 12.8 tpp180 -86.91 121.72 29.77 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 127.583 2.353 . . . . 0.0 110.557 -178.074 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -76.16 -32.99 59.35 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 127.105 2.162 . . . . 0.0 114.209 -168.339 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -166.21 168.9 7.09 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 127.304 2.241 . . . . 0.0 108.565 -172.46 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -55.66 124.75 17.06 Favored 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 122.69 2.26 . . . . 0.0 112.551 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -85.29 -168.86 0.54 Allowed 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 124.761 3.641 . . . . 0.0 111.644 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.0 -42.75 31.66 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.061 0.945 . . . . 0.0 113.461 177.203 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -78.87 5.64 11.0 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 -172.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.5 t -74.41 152.02 39.57 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.188 1.795 . . . . 0.0 112.241 177.224 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -105.14 48.3 0.84 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.384 1.074 . . . . 0.0 112.905 -155.438 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.427 ' O ' ' HE3' ' A' ' 46' ' ' LYS . 65.2 mtm -22.07 -47.2 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 118.792 2.886 . . . . 0.0 118.792 -169.243 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -51.65 -42.61 62.2 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 123.335 2.788 . . . . 0.0 113.328 175.051 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 55.9 m -75.07 -23.08 57.97 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.098 1.359 . . . . 0.0 112.023 173.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.637 HD13 ' H ' ' A' ' 6' ' ' GLY . 3.2 mm? -79.87 -19.84 47.33 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 116.781 -1.58 . . . . 0.0 113.139 171.128 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.427 ' HE3' ' O ' ' A' ' 42' ' ' MET . 8.0 mmpt? -69.01 -23.37 64.08 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 122.289 2.313 . . . . 0.0 111.751 -172.836 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.2 ptm -70.21 -17.89 63.16 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.485 1.514 . . . . 0.0 113.998 168.835 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.508 ' CD2' HD12 ' A' ' 45' ' ' LEU . 47.1 t80 -107.2 -61.75 1.51 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.967 2.507 . . . . 0.0 112.157 -171.633 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 27.9 mtp -66.74 -7.73 23.16 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.967 2.107 . . . . 0.0 114.489 -178.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -151.69 152.56 32.95 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.371 1.468 . . . . 0.0 109.997 163.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 6.4 t . . . . . 0 N--CA 1.474 0.741 0 CA-C-O 118.022 -0.989 . . . . 0.0 112.929 170.438 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.5 m . . . . . 0 N--CA 1.475 0.795 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -95.49 142.79 27.43 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 125.029 1.332 . . . . 0.0 109.514 159.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.577 ' HB ' ' H ' ' A' ' 7' ' ' LEU . 76.2 p -133.93 144.14 48.65 Favored 'General case' 0 CA--C 1.514 -0.416 0 C-N-CA 126.085 1.754 . . . . 0.0 108.814 174.84 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.41 ' H ' HD23 ' A' ' 45' ' ' LEU . . . -78.44 3.11 64.15 Favored Glycine 0 CA--C 1.534 1.249 0 CA-C-O 119.015 -0.88 . . . . 0.0 113.141 155.143 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.577 ' H ' ' HB ' ' A' ' 5' ' ' THR . 37.6 mt -61.91 153.78 71.13 Favored Pre-proline 0 CA--C 1.545 0.775 0 CA-C-N 119.881 1.841 . . . . 0.0 110.594 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -80.52 -149.5 0.04 OUTLIER 'Trans proline' 0 CA--C 1.544 1.0 0 C-N-CA 122.695 2.263 . . . . 0.0 110.419 -176.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.24 4.65 0.2 Allowed 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 115.825 1.787 . . . . 0.0 115.825 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -127.92 97.34 0.45 Allowed Glycine 0 C--N 1.338 0.648 0 C-N-CA 127.115 2.293 . . . . 0.0 109.501 171.465 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 61.8 p-90 -139.47 -23.84 0.87 Allowed 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 116.445 2.017 . . . . 0.0 116.445 -165.824 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -83.14 105.22 13.94 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 119.131 0.878 . . . . 0.0 109.366 -169.046 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 6.1 p -70.49 128.18 33.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 CA-C-N 119.219 0.918 . . . . 0.0 112.732 -169.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -128.46 165.09 21.34 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.767 2.027 . . . . 0.0 110.895 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 3.1 p80 -168.02 -179.52 4.17 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 126.121 1.769 . . . . 0.0 112.06 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.2 m -145.95 166.42 26.07 Favored 'General case' 0 N--CA 1.476 0.868 0 O-C-N 120.48 -1.387 . . . . 0.0 112.499 177.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -60.13 -44.22 95.07 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.844 1.257 . . . . 0.0 113.812 -174.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.5 m -87.16 -5.82 58.86 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.527 1.131 . . . . 0.0 112.751 174.737 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -133.8 67.75 1.51 Allowed 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.566 1.546 . . . . 0.0 110.642 -174.567 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -65.37 -24.81 67.34 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.407 1.483 . . . . 0.0 113.892 -174.063 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -74.14 119.41 76.19 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 123.819 0.847 . . . . 0.0 108.866 178.485 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -76.99 166.32 26.96 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 123.145 2.564 . . . . 0.0 113.98 -165.577 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 44.1 p90 -137.48 146.08 43.82 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 126.154 1.782 . . . . 0.0 110.959 171.135 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -93.65 118.46 31.41 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.157 -0.964 . . . . 0.0 110.578 178.552 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -81.33 138.67 35.65 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.719 1.208 . . . . 0.0 112.055 -175.519 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -92.69 117.83 67.73 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 124.424 1.089 . . . . 0.0 109.101 172.286 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -69.87 -46.1 1.3 Allowed 'Trans proline' 0 C--N 1.35 0.623 0 C-N-CA 121.907 1.738 . . . . 0.0 112.664 179.175 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -90.73 9.48 29.79 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 115.254 1.576 . . . . 0.0 115.254 -170.271 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 92.6 m -151.85 140.89 21.19 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.906 1.683 . . . . 0.0 109.715 -176.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 64.7 mtp85 -70.95 95.71 1.21 Allowed 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.593 0.757 . . . . 0.0 108.994 168.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -174.66 157.42 2.53 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.608 1.963 . . . . 0.0 110.452 -169.525 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.3 p -139.84 133.19 29.97 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 123.804 0.842 . . . . 0.0 110.394 159.286 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 4.3 tpp180 -81.87 117.31 22.04 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 122.231 1.015 . . . . 0.0 109.767 174.336 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -88.25 -22.25 24.05 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.573 1.549 . . . . 0.0 113.975 -170.561 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -160.55 156.28 22.13 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 127.608 2.363 . . . . 0.0 108.537 -164.371 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.32 119.46 6.46 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.058 2.505 . . . . 0.0 112.141 -170.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_endo -84.07 -168.04 0.51 Allowed 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 124.628 3.552 . . . . 0.0 111.92 -177.34 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -88.21 -31.43 19.08 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.062 1.345 . . . . 0.0 112.896 171.367 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -69.83 -3.13 14.32 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 125.302 1.441 . . . . 0.0 113.492 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.1 t -80.92 159.4 24.97 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.743 2.017 . . . . 0.0 112.112 176.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -123.68 59.7 1.11 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 127.151 2.18 . . . . 0.0 111.333 -162.249 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.2 mpp? -32.92 -38.15 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 116.922 2.193 . . . . 0.0 116.922 173.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.09 -40.5 67.29 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 121.269 1.85 . . . . 0.0 113.002 171.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 55.2 m -80.46 -26.31 38.39 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.918 1.687 . . . . 0.0 111.712 168.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.41 HD23 ' H ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -94.1 -24.57 17.52 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 -161.558 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.75 -13.79 62.46 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 121.744 2.066 . . . . 0.0 112.101 172.361 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 23.7 mmt -71.15 -12.17 61.34 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.171 0.988 . . . . 0.0 113.518 164.018 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -113.1 -50.82 2.86 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.213 1.805 . . . . 0.0 112.118 -179.574 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 82.8 mmm -77.09 -4.28 43.57 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.696 1.998 . . . . 0.0 114.174 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -148.28 172.66 14.01 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.325 1.85 . . . . 0.0 109.856 170.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 3.9 t . . . . . 0 N--CA 1.478 0.949 0 C-N-CA 124.935 1.294 . . . . 0.0 110.198 177.478 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 14.9 m . . . . . 0 N--CA 1.475 0.787 0 CA-C-O 120.734 0.302 . . . . 0.0 111.759 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -98.55 122.08 41.3 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.435 1.094 . . . . 0.0 109.525 168.734 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 32.6 p -117.02 124.15 48.61 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.343 1.457 . . . . 0.0 108.701 -175.415 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.464 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -69.78 41.45 0.43 Allowed Glycine 0 CA--C 1.532 1.128 0 CA-C-O 118.768 -1.018 . . . . 0.0 115.381 158.596 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.1 mt -85.67 168.18 21.07 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 125.858 1.663 . . . . 0.0 110.432 179.408 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -75.26 -157.29 0.06 OUTLIER 'Trans proline' 0 CA--C 1.548 1.196 0 C-N-CA 122.576 2.184 . . . . 0.0 111.197 176.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.02 -33.98 74.12 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.541 -1.35 . . . . 0.0 112.645 173.334 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -80.24 62.25 4.29 Favored Glycine 0 CA--C 1.526 0.772 0 C-N-CA 125.522 1.534 . . . . 0.0 112.398 171.75 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 36.0 p-90 -108.14 -17.65 13.97 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 115.445 1.646 . . . . 0.0 115.445 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -72.45 103.22 3.41 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 119.282 0.946 . . . . 0.0 110.113 -167.846 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.3 p -67.86 120.85 15.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-N 118.589 0.632 . . . . 0.0 110.708 -174.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -107.12 139.12 42.03 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.852 1.261 . . . . 0.0 108.812 166.229 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 3.6 p80 -157.19 -178.95 7.74 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.53 1.132 . . . . 0.0 111.523 -169.633 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.6 m -135.49 174.18 10.89 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.318 1.447 . . . . 0.0 111.608 177.744 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -112.21 -27.62 8.27 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.729 1.211 . . . . 0.0 111.747 166.058 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.8 m -82.2 -6.16 59.01 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.534 1.134 . . . . 0.0 113.538 171.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -133.75 165.26 25.37 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 128.231 2.613 . . . . 0.0 108.794 163.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 49.3 t-20 -136.94 65.79 1.49 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.142 0.977 . . . . 0.0 111.947 -179.17 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -156.17 123.99 2.82 Favored Pre-proline 0 CA--C 1.549 0.906 0 C-N-CA 125.015 1.326 . . . . 0.0 109.43 173.773 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -88.6 168.21 5.98 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.73 2.953 . . . . 0.0 112.634 -173.695 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 44.4 p90 -139.19 132.71 30.32 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.887 0.875 . . . . 0.0 110.759 156.639 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -86.73 116.51 24.87 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.943 0.897 . . . . 0.0 109.242 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -101.19 142.62 32.35 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.567 1.147 . . . . 0.0 112.61 -165.921 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 58.5 t-20 -98.53 114.78 65.68 Favored Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 124.975 1.31 . . . . 0.0 109.3 166.644 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -81.34 -23.13 5.31 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 123.371 2.714 . . . . 0.0 114.298 178.077 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.85 -33.11 46.16 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.384 0.993 . . . . 0.0 112.115 -176.124 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 70.9 m -134.56 110.74 9.54 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 126.201 1.8 . . . . 0.0 106.36 170.005 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.3 mtt85 -57.24 106.9 0.37 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.615 0.766 . . . . 0.0 111.025 -172.804 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -166.6 153.65 9.24 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.208 1.803 . . . . 0.0 109.896 -168.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 97.4 p -124.11 163.64 21.08 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 114.439 1.274 . . . . 0.0 114.439 178.038 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.37 152.05 48.07 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 128.632 2.773 . . . . 0.0 108.483 176.382 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -125.3 -26.88 3.56 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -153.256 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 -154.15 170.49 8.36 Favored Pre-proline 0 CA--C 1.552 1.033 0 C-N-CA 130.181 3.392 . . . . 0.0 106.316 177.286 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -54.11 122.05 10.74 Favored 'Trans proline' 0 CA--C 1.546 1.118 0 C-N-CA 122.803 2.335 . . . . 0.0 112.129 172.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -90.29 -162.1 0.11 Allowed 'Trans proline' 0 CA--C 1.546 1.082 0 C-N-CA 124.215 3.276 . . . . 0.0 110.658 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -102.1 -27.06 13.13 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -178.158 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -80.87 10.1 5.49 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 125.637 1.575 . . . . 0.0 113.19 177.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -77.08 -177.94 4.75 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 129.687 3.195 . . . . 0.0 112.924 -177.605 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -90.42 -54.27 4.08 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-O 122.975 1.369 . . . . 0.0 109.548 -175.756 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.464 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 8.7 ttp 86.6 -43.0 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 129.711 3.204 . . . . 0.0 114.078 170.504 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -64.8 -48.37 74.7 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 121.494 1.952 . . . . 0.0 111.904 178.139 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 16.0 m -60.72 -21.58 63.09 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 125.656 1.582 . . . . 0.0 111.463 167.411 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.464 ' HB3' ' HA ' ' A' ' 42' ' ' MET . 11.1 tp -93.69 -21.66 19.21 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 118.014 -0.993 . . . . 0.0 111.197 -170.576 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.488 ' HE2' ' HA ' ' A' ' 46' ' ' LYS . 7.9 mmpt? -60.97 -40.62 94.09 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 120.889 1.677 . . . . 0.0 111.229 171.939 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.7 ptt? -67.88 6.95 0.59 Allowed 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 172.242 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -124.11 -44.4 2.04 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.106 1.762 . . . . 0.0 112.572 172.019 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 92.4 mtp -66.25 -24.67 66.63 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.819 2.048 . . . . 0.0 112.496 177.145 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -128.61 158.44 38.48 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.588 1.555 . . . . 0.0 111.772 172.75 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 87.1 m . . . . . 0 N--CA 1.474 0.755 0 C-N-CA 125.167 1.387 . . . . 0.0 108.625 168.608 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.0 m . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 120.371 0.129 . . . . 0.0 110.87 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -84.1 122.59 29.02 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 122.07 -0.393 . . . . 0.0 110.351 172.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.476 ' HB ' ' H ' ' A' ' 7' ' ' LEU . 73.7 p -126.5 146.68 50.02 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.268 1.427 . . . . 0.0 108.396 168.024 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.522 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -80.94 16.32 16.22 Favored Glycine 0 CA--C 1.532 1.148 0 N-CA-C 115.537 0.975 . . . . 0.0 115.537 150.433 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.476 ' H ' ' HB ' ' A' ' 5' ' ' THR . 13.4 mt -68.82 157.41 88.86 Favored Pre-proline 0 CA--C 1.548 0.894 0 CA-C-N 119.995 1.898 . . . . 0.0 110.292 -176.037 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -73.98 -170.48 0.71 Allowed 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 122.927 2.418 . . . . 0.0 109.494 177.182 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.43 -23.15 9.16 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -175.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -88.45 77.47 1.82 Allowed Glycine 0 CA--C 1.527 0.833 0 C-N-CA 126.173 1.844 . . . . 0.0 111.864 165.189 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 1.7 p90 -110.83 -8.69 14.51 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 -177.573 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -89.18 110.25 21.02 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 120.228 1.376 . . . . 0.0 111.338 -172.772 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.6 p -61.15 136.72 24.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 O-C-N 121.101 -1.0 . . . . 0.0 112.658 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -133.28 112.97 12.1 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.892 1.677 . . . . 0.0 109.848 174.747 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 31.1 p80 -103.77 155.2 18.78 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.415 1.086 . . . . 0.0 112.122 173.192 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 99.4 p -161.35 158.2 26.57 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 125.126 1.371 . . . . 0.0 110.707 -172.691 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.9 p30 -75.27 -18.91 59.96 Favored 'General case' 0 CA--C 1.548 0.878 0 O-C-N 120.416 -1.428 . . . . 0.0 113.538 177.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.7 m -75.86 -30.05 58.76 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.456 1.502 . . . . 0.0 112.811 -175.559 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -109.08 146.11 34.54 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.262 1.425 . . . . 0.0 111.239 -176.583 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -88.69 12.29 15.22 Favored 'General case' 0 CA--C 1.555 1.15 0 N-CA-C 114.313 1.227 . . . . 0.0 114.313 -178.877 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -166.33 159.26 12.16 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 127.335 2.254 . . . . 0.0 109.338 172.791 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -75.16 169.45 22.53 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.964 2.443 . . . . 0.0 111.576 -178.351 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 52.9 p90 -126.49 148.05 49.74 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.404 1.082 . . . . 0.0 111.125 168.857 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -103.73 107.25 18.03 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.582 0.753 . . . . 0.0 109.836 -175.341 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -95.3 149.75 21.0 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.929 1.692 . . . . 0.0 112.959 -165.839 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 61.0 t-20 -99.34 113.73 65.04 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 125.135 1.374 . . . . 0.0 110.018 171.8 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.2 -29.67 14.06 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.871 2.381 . . . . 0.0 113.533 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -80.91 -38.24 28.25 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -171.202 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 92.2 m -127.85 138.92 52.87 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.264 1.826 . . . . 0.0 107.898 169.329 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 84.8 mtm-85 -61.67 104.43 0.43 Allowed 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.127 0.876 . . . . 0.0 111.071 178.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -163.62 153.56 15.16 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.915 1.286 . . . . 0.0 111.983 178.537 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 31.4 t -133.69 152.75 51.96 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.369 1.467 . . . . 0.0 111.093 176.65 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.7 tpp180 -128.0 136.82 51.81 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.612 1.565 . . . . 0.0 110.486 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -126.11 0.88 7.19 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.587 1.555 . . . . 0.0 113.324 -157.854 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -169.17 156.28 6.69 Favored Pre-proline 0 CA--C 1.544 0.714 0 C-N-CA 128.772 2.829 . . . . 0.0 107.69 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -62.09 113.37 1.85 Allowed 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.282 2.655 . . . . 0.0 110.483 175.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -85.56 159.28 10.8 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.773 2.315 . . . . 0.0 112.253 -171.348 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.48 -22.02 41.2 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 178.222 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -81.36 -15.32 55.63 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 126.279 1.832 . . . . 0.0 113.797 -179.413 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.62 179.01 4.97 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.597 1.559 . . . . 0.0 112.989 -170.283 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -130.12 51.33 2.11 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 122.105 0.955 . . . . 0.0 111.363 -160.282 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.503 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 32.6 mtt -27.3 -42.28 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 128.195 2.598 . . . . 0.0 116.113 169.62 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -48.24 -42.44 30.39 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 121.316 1.871 . . . . 0.0 113.751 173.195 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.3 m -82.87 -26.25 31.76 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 127.216 2.207 . . . . 0.0 112.399 173.402 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.522 HD13 ' N ' ' A' ' 6' ' ' GLY . 43.9 tp -109.9 -16.51 13.84 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 124.423 1.089 . . . . 0.0 112.244 -151.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.33 -34.17 66.32 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.673 -1.267 . . . . 0.0 111.336 159.324 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.7 mmt -60.9 -22.31 64.21 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.614 0.766 . . . . 0.0 112.751 173.791 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -103.51 -36.05 8.1 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.306 1.842 . . . . 0.0 112.801 -177.485 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 29.2 mtp -95.34 -1.37 51.38 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.046 1.738 . . . . 0.0 114.824 -178.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -151.11 67.24 0.91 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.188 1.795 . . . . 0.0 111.686 170.511 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 2.1 t . . . . . 0 N--CA 1.477 0.905 0 N-CA-C 115.139 1.533 . . . . 0.0 115.139 -172.095 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 3.4 m . . . . . 0 N--CA 1.476 0.844 0 N-CA-C 110.606 -0.146 . . . . 0.0 110.606 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 -69.61 123.46 21.39 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 121.777 -0.577 . . . . 0.0 110.386 175.751 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 73.9 p -127.99 149.69 50.24 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.666 1.586 . . . . 0.0 108.304 173.035 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -77.57 6.04 48.25 Favored Glycine 0 CA--C 1.529 0.938 0 CA-C-O 118.223 -1.321 . . . . 0.0 115.125 155.839 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 27.9 mt -62.13 150.2 84.58 Favored Pre-proline 0 CA--C 1.544 0.714 0 CA-C-N 120.141 1.971 . . . . 0.0 111.986 -168.578 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -70.47 159.95 51.15 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 122.17 1.913 . . . . 0.0 109.868 -176.677 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -52.31 -35.62 51.02 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 116.717 2.117 . . . . 0.0 116.717 -154.147 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -93.22 74.0 1.26 Allowed Glycine 0 CA--C 1.524 0.655 0 C-N-CA 125.894 1.711 . . . . 0.0 111.362 -177.334 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 11.4 p-90 -136.04 154.19 51.12 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.933 1.293 . . . . 0.0 113.556 178.475 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -169.76 128.07 0.93 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 129.575 3.15 . . . . 0.0 104.578 177.003 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.9 t -79.93 130.6 35.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 CA-C-N 120.044 1.293 . . . . 0.0 109.814 -171.373 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.1 mmt180 -138.07 156.95 47.27 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.808 1.243 . . . . 0.0 111.839 177.314 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 10.7 p-80 -168.59 152.29 5.63 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.243 1.017 . . . . 0.0 113.156 -169.773 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 82.6 p -171.37 163.68 6.96 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 125.772 1.629 . . . . 0.0 109.987 -170.164 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -65.25 -5.74 7.86 Favored 'General case' 0 CA--C 1.554 1.128 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 179.485 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.6 t -73.77 -19.96 60.62 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.131 1.772 . . . . 0.0 113.089 170.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.81 138.87 24.65 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 120.436 -1.415 . . . . 0.0 113.905 -178.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -76.11 -40.85 51.98 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.179 0.992 . . . . 0.0 112.854 -170.644 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 7.9 mp -100.92 155.21 36.58 Favored Pre-proline 0 CA--C 1.54 0.573 0 C-N-CA 125.157 1.383 . . . . 0.0 109.91 169.036 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -63.29 155.21 63.2 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 122.91 2.407 . . . . 0.0 111.113 175.147 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 34.0 p90 -116.04 140.87 48.83 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 125.832 1.653 . . . . 0.0 109.429 171.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -94.9 95.67 8.8 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.9 0.857 . . . . 0.0 108.745 -175.441 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -63.21 137.9 58.37 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.929 1.692 . . . . 0.0 110.171 177.834 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 56.3 t-20 -82.58 116.9 66.44 Favored Pre-proline 0 CA--C 1.553 1.079 0 O-C-N 121.531 -0.731 . . . . 0.0 110.044 173.278 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.9 -19.87 34.89 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 123.611 2.874 . . . . 0.0 114.358 -179.544 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -88.45 -97.71 0.09 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.708 0.803 . . . . 0.0 109.865 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.8 p -63.91 150.54 44.77 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.367 1.467 . . . . 0.0 110.696 171.059 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -79.74 95.25 5.92 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 121.602 -0.686 . . . . 0.0 109.243 -178.562 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -159.73 -177.65 6.51 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.223 1.409 . . . . 0.0 110.243 -179.311 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 80.3 p -158.09 146.15 18.64 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 120.422 -1.424 . . . . 0.0 112.595 177.004 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 15.8 tpp180 -101.26 131.69 47.15 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 127.071 2.148 . . . . 0.0 108.953 172.774 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 1.4 m-90 -86.05 -37.38 18.96 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 122.276 1.036 . . . . 0.0 113.476 -163.152 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -154.11 162.96 25.58 Favored Pre-proline 0 CA--C 1.54 0.577 0 C-N-CA 129.112 2.965 . . . . 0.0 106.709 -167.789 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -57.95 117.72 4.48 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 122.343 2.029 . . . . 0.0 110.547 176.93 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.463 ' O ' HG22 ' A' ' 40' ' ' THR . 91.9 Cg_endo -78.79 168.63 20.71 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 124.077 3.185 . . . . 0.0 111.165 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.27 -30.28 69.35 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.648 -0.657 . . . . 0.0 112.656 170.066 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -65.17 -9.44 23.17 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 127.092 2.157 . . . . 0.0 115.781 -176.41 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.463 HG22 ' O ' ' A' ' 37' ' ' PRO . 6.2 t -87.72 167.45 13.84 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 126.02 1.728 . . . . 0.0 112.748 -170.752 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -95.53 54.54 1.59 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 125.506 1.522 . . . . 0.0 110.687 -176.457 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.472 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 33.5 mtt -30.36 -39.0 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 127.416 2.286 . . . . 0.0 115.921 173.275 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -54.53 -39.19 67.41 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 121.505 1.957 . . . . 0.0 114.01 172.664 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 84.8 m -82.37 -16.02 50.66 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 127.616 2.366 . . . . 0.0 112.735 172.596 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.472 ' HB3' ' HA ' ' A' ' 42' ' ' MET . 3.0 tm? -123.48 -20.17 5.65 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.218 -0.926 . . . . 0.0 112.833 -151.726 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.63 -26.34 66.95 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 120.16 -1.588 . . . . 0.0 111.524 156.517 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 4.4 mmt -67.09 -19.55 65.66 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.758 0.823 . . . . 0.0 112.906 170.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -104.39 -54.02 2.61 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.31 1.444 . . . . 0.0 112.139 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 68.5 mmm -65.48 -17.43 64.55 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.598 1.959 . . . . 0.0 113.448 -179.747 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -139.14 178.93 6.82 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.337 1.855 . . . . 0.0 110.197 172.91 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 20.2 p . . . . . 0 N--CA 1.476 0.871 0 C-N-CA 124.369 1.067 . . . . 0.0 112.265 -172.604 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.477 0.923 0 CA-C-O 120.948 0.404 . . . . 0.0 111.94 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -82.94 93.78 7.6 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.283 1.033 . . . . 0.0 110.337 172.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.5 p -100.15 135.0 42.25 Favored 'General case' 0 CA--C 1.506 -0.731 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 176.105 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.52 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -76.29 26.39 1.55 Allowed Glycine 0 CA--C 1.532 1.127 0 CA-C-O 117.924 -1.487 . . . . 0.0 116.101 151.207 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 16.0 mt -71.58 160.36 82.81 Favored Pre-proline 0 CA--C 1.547 0.84 0 CA-C-N 121.135 2.468 . . . . 0.0 110.533 -178.651 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -72.94 168.98 23.28 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 120.992 1.128 . . . . 0.0 111.147 -175.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.35 -21.15 5.27 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 118.305 2.706 . . . . 0.0 118.305 -157.333 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -138.32 94.34 0.21 Allowed Glycine 0 N--CA 1.468 0.777 0 C-N-CA 124.87 1.224 . . . . 0.0 112.692 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 33.5 p-90 -135.06 159.59 41.02 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.095 1.358 . . . . 0.0 114.028 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -150.43 150.28 31.15 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 127.418 2.287 . . . . 0.0 107.829 166.679 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.3 p -87.85 146.75 5.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 CA-C-N 120.774 1.625 . . . . 0.0 110.852 172.342 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -127.98 113.17 15.49 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.73 1.612 . . . . 0.0 110.779 174.061 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 45.1 p-80 -78.7 149.61 32.73 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.659 0.784 . . . . 0.0 110.92 160.779 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.9 t -162.81 132.59 4.39 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 121.27 -0.894 . . . . 0.0 112.015 178.09 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 10.5 m-20 -68.28 -7.92 35.04 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.708 1.203 . . . . 0.0 113.337 176.37 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.8 t -75.59 -19.5 59.21 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.956 1.303 . . . . 0.0 112.833 167.55 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -116.78 161.02 19.92 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.67 1.588 . . . . 0.0 111.863 -170.802 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -89.69 -39.1 13.41 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.625 0.77 . . . . 0.0 112.247 173.678 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -104.69 176.43 1.75 Allowed Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 127.127 2.171 . . . . 0.0 110.102 176.72 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -69.58 157.91 59.06 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.456 2.104 . . . . 0.0 110.832 155.858 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 47.6 p90 -120.07 163.89 16.98 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.889 0.876 . . . . 0.0 109.963 157.016 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.9 m-85 -101.61 137.88 39.33 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 120.938 -1.102 . . . . 0.0 110.973 176.442 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -97.42 150.59 20.86 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.724 1.209 . . . . 0.0 109.977 169.669 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -115.2 99.13 51.95 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 124.486 1.114 . . . . 0.0 110.97 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -69.31 -22.75 33.7 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 122.419 2.079 . . . . 0.0 115.05 -173.801 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -75.81 -41.58 52.36 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 119.762 1.164 . . . . 0.0 113.517 -177.296 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 23.0 m -131.19 100.42 5.19 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 168.176 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -47.82 110.12 0.29 Allowed 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.533 1.533 . . . . 0.0 112.198 -171.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -174.23 177.14 2.34 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 127.834 2.453 . . . . 0.0 107.839 -169.08 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 69.5 p -117.69 171.53 7.97 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.898 -1.127 . . . . 0.0 112.846 170.401 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.5 139.69 40.69 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 127.13 2.172 . . . . 0.0 109.103 175.85 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -126.02 -46.57 1.67 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.155 -0.929 . . . . 0.0 112.444 -152.228 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -144.56 150.84 48.78 Favored Pre-proline 0 CA--C 1.542 0.657 0 C-N-CA 127.917 2.487 . . . . 0.0 107.478 -179.438 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -56.53 115.38 2.44 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 123.597 2.865 . . . . 0.0 112.956 -159.373 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -74.43 163.81 35.38 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 123.657 2.905 . . . . 0.0 112.147 -172.443 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.11 -21.85 65.84 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 -172.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -78.82 -21.38 47.79 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.127 1.371 . . . . 0.0 112.899 172.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -71.18 156.47 39.53 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.528 1.531 . . . . 0.0 112.926 -170.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -108.95 49.53 0.81 Allowed 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.544 1.538 . . . . 0.0 110.723 -164.356 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.479 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 72.3 mtm -25.29 -47.42 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 127.029 2.132 . . . . 0.0 115.296 173.325 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -50.19 -46.82 54.64 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 121.694 2.043 . . . . 0.0 114.5 174.424 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 99.2 m -68.39 -38.44 81.34 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.189 1.796 . . . . 0.0 111.665 169.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.52 HD13 ' N ' ' A' ' 6' ' ' GLY . 54.2 tp -94.27 -16.68 23.36 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 124.67 1.188 . . . . 0.0 110.964 -153.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.09 -28.78 66.82 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 120.512 -1.367 . . . . 0.0 112.093 161.23 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 20.3 mmt -65.46 -16.66 63.87 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 119.633 1.106 . . . . 0.0 112.509 172.11 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -105.61 -44.49 4.67 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.185 1.794 . . . . 0.0 112.701 177.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.6 mtp -78.61 -8.04 58.22 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.842 1.657 . . . . 0.0 113.607 -176.415 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -130.96 153.83 48.78 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.154 1.382 . . . . 0.0 112.044 175.488 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 9.7 t . . . . . 0 N--CA 1.476 0.842 0 C-N-CA 124.49 1.116 . . . . 0.0 111.766 179.175 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 15.9 m . . . . . 0 N--CA 1.476 0.84 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -81.45 136.06 35.65 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.983 0.913 . . . . 0.0 110.561 164.759 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 62.9 p -134.84 133.15 39.43 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.659 1.584 . . . . 0.0 108.43 178.871 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.568 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -66.58 16.41 0.27 Allowed Glycine 0 CA--C 1.531 1.038 0 N-CA-C 115.523 0.969 . . . . 0.0 115.523 157.291 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 28.3 mt -67.23 156.66 87.59 Favored Pre-proline 0 CA--C 1.549 0.92 0 CA-C-N 119.909 1.855 . . . . 0.0 110.648 -176.858 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -80.35 -133.08 0.01 OUTLIER 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 123.17 2.58 . . . . 0.0 110.017 -179.225 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.99 -26.12 67.4 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -102.22 86.65 0.58 Allowed Glycine 0 C--N 1.339 0.711 0 C-N-CA 126.275 1.893 . . . . 0.0 109.534 176.283 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 69.5 p-90 -127.06 -28.01 2.93 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 117.226 2.306 . . . . 0.0 117.226 -167.586 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -83.96 112.04 19.81 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.313 0.961 . . . . 0.0 110.489 -168.337 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 24.1 t -61.84 132.2 27.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 O-C-N 121.615 -0.678 . . . . 0.0 111.048 -177.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 60.7 mmt-85 -132.65 132.69 42.7 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.787 1.635 . . . . 0.0 110.567 174.311 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -130.7 2.51 4.47 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 115.065 1.506 . . . . 0.0 115.065 -172.248 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.6 t -72.71 82.11 1.14 Allowed 'General case' 0 N--CA 1.473 0.682 0 O-C-N 120.855 -1.153 . . . . 0.0 108.054 156.576 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -178.19 116.57 0.08 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 127.335 2.254 . . . . 0.0 109.381 -165.401 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.2 m -76.5 -2.18 30.94 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 115.901 1.815 . . . . 0.0 115.901 -170.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.489 ' HG3' ' H ' ' A' ' 20' ' ' ASN . 2.0 tppp? -71.42 179.64 2.87 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 119.522 1.056 . . . . 0.0 111.983 178.257 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.489 ' H ' ' HG3' ' A' ' 19' ' ' LYS . 10.6 m120 -61.99 -43.11 99.54 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.7 1.6 . . . . 0.0 113.729 -175.042 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 10.3 mp -122.96 162.68 37.74 Favored Pre-proline 0 CA--C 1.547 0.827 0 C-N-CA 126.415 1.886 . . . . 0.0 110.866 -177.867 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.86 159.96 50.93 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 123.184 2.589 . . . . 0.0 111.098 168.322 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 34.1 p90 -108.21 146.08 33.31 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.504 1.121 . . . . 0.0 111.627 177.34 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -92.25 101.16 13.66 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 121.452 0.644 . . . . 0.0 109.377 177.127 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -67.13 145.86 54.85 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.43 1.092 . . . . 0.0 111.8 -178.605 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -104.71 85.08 1.08 Allowed Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 125.944 1.697 . . . . 0.0 109.828 178.075 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -62.39 -24.61 75.76 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.601 2.201 . . . . 0.0 115.694 -170.265 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.33 -13.64 60.13 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.129 1.159 . . . . 0.0 114.129 -179.12 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.7 m -169.54 124.44 0.82 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 127.082 2.153 . . . . 0.0 108.375 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 24.8 mmt85 -52.15 98.08 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.825 0 CA-C-O 122.702 1.239 . . . . 0.0 112.838 -174.577 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -163.67 178.05 8.24 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 127.572 2.349 . . . . 0.0 109.825 -174.58 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.3 p -149.48 174.01 12.95 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 120.531 -1.355 . . . . 0.0 113.877 173.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 20.3 tpp180 -138.5 158.7 43.76 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 128.218 2.607 . . . . 0.0 107.948 171.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -140.48 -58.73 0.53 Allowed 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.777 -0.577 . . . . 0.0 111.305 -158.541 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -107.55 153.89 41.09 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 126.003 1.721 . . . . 0.0 109.446 166.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -69.17 121.95 8.78 Favored 'Trans proline' 0 CA--C 1.544 1.018 0 C-N-CA 123.337 2.691 . . . . 0.0 112.059 -167.329 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -83.88 166.27 13.24 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 124.47 3.447 . . . . 0.0 112.358 -172.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.32 -20.81 64.77 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 115.236 1.569 . . . . 0.0 115.236 -174.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -80.96 -7.54 59.55 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 125.177 1.391 . . . . 0.0 113.773 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -74.59 170.12 16.4 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.151 1.78 . . . . 0.0 114.726 -168.311 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -105.18 50.69 0.78 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.811 1.645 . . . . 0.0 110.965 -171.043 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.442 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 10.2 mtm -30.02 -35.54 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 127.164 2.186 . . . . 0.0 116.238 172.804 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.1 -27.35 69.04 Favored 'General case' 0 CA--C 1.553 1.092 0 CA-C-N 122.734 2.516 . . . . 0.0 114.183 175.352 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 69.4 m -94.52 -5.16 46.67 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 128.119 2.568 . . . . 0.0 112.297 171.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.568 HD13 ' N ' ' A' ' 6' ' ' GLY . 26.1 tp -131.07 -20.2 2.78 Favored 'General case' 0 C--O 1.219 -0.528 0 O-C-N 120.844 -1.16 . . . . 0.0 111.69 -155.445 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.01 -36.32 76.96 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 120.607 1.549 . . . . 0.0 111.308 157.092 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 15.2 ptt? -67.65 -9.68 45.47 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.347 1.059 . . . . 0.0 113.485 171.811 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -104.66 -46.32 4.37 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.037 1.335 . . . . 0.0 112.077 173.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 83.4 mmm -72.85 -8.61 56.37 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 127.493 2.317 . . . . 0.0 113.536 -175.586 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -161.42 146.98 13.89 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.734 2.014 . . . . 0.0 109.679 166.412 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 22.3 m . . . . . 0 N--CA 1.474 0.77 0 O-C-N 121.441 -0.787 . . . . 0.0 110.304 -178.0 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 15.7 t . . . . . 0 N--CA 1.472 0.653 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 27.4 m120 -59.39 120.95 10.29 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 122.925 0.49 . . . . 0.0 110.731 173.669 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 75.5 p -113.11 149.48 33.47 Favored 'General case' 0 CA--C 1.509 -0.623 0 C-N-CA 125.308 1.443 . . . . 0.0 108.1 171.706 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.686 ' H ' HD13 ' A' ' 45' ' ' LEU . . . -84.65 9.52 64.88 Favored Glycine 0 CA--C 1.534 1.266 0 CA-C-N 113.827 -1.533 . . . . 0.0 115.749 158.714 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.4 mt -65.59 150.56 95.93 Favored Pre-proline 0 CA--C 1.546 0.801 0 CA-C-N 118.946 1.373 . . . . 0.0 110.925 -168.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -77.45 177.58 8.67 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.896 1.731 . . . . 0.0 110.978 -175.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.93 -32.94 55.25 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 115.331 1.604 . . . . 0.0 115.331 -170.875 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -79.1 42.54 2.35 Favored Glycine 0 CA--C 1.533 1.175 0 CA-C-O 118.443 -1.198 . . . . 0.0 115.118 -177.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 1.3 p-90 -122.95 152.54 40.75 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 -176.544 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 179.51 119.91 0.05 Allowed 'General case' 0 CA--C 1.54 0.569 1 C-N-CA 131.753 4.021 . . . . 0.0 104.085 175.55 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 5.7 t -78.59 126.93 38.97 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 120.604 1.547 . . . . 0.0 110.979 -169.455 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -119.43 113.7 21.18 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.451 1.501 . . . . 0.0 110.319 172.478 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -88.03 163.68 16.16 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.244 1.017 . . . . 0.0 112.049 165.163 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.4 t -159.64 144.44 15.25 Favored 'General case' 0 N--CA 1.467 0.409 0 O-C-N 120.924 -1.11 . . . . 0.0 113.022 -168.444 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 60.5 m-20 -71.89 -7.74 50.26 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.694 0.798 . . . . 0.0 113.066 169.855 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.0 m -91.7 -14.64 29.67 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 120.787 -1.196 . . . . 0.0 113.511 175.581 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -123.71 146.79 48.0 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.637 1.108 . . . . 0.0 113.425 -162.75 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -81.6 -9.38 59.69 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 175.435 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 23.3 mt -140.98 167.9 15.96 Favored Pre-proline 0 CA--C 1.539 0.553 0 C-N-CA 126.936 2.095 . . . . 0.0 109.117 176.02 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -68.41 167.04 23.5 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 122.118 1.879 . . . . 0.0 110.207 163.811 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 39.8 p90 -126.84 157.85 38.19 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.889 1.275 . . . . 0.0 109.416 160.334 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -103.09 115.16 30.06 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.336 -0.852 . . . . 0.0 109.663 -177.226 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -76.03 134.29 40.14 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.569 1.148 . . . . 0.0 110.312 176.715 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 60.2 t-20 -87.54 114.23 57.89 Favored Pre-proline 0 CA--C 1.547 0.839 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 168.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -74.14 -34.64 4.75 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.072 1.848 . . . . 0.0 112.569 176.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -80.15 -19.23 47.69 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.023 1.12 . . . . 0.0 114.023 -171.568 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 26.3 m -147.63 143.83 27.97 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.847 1.659 . . . . 0.0 108.725 -174.455 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -70.52 44.07 0.07 Allowed 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 116.863 2.171 . . . . 0.0 116.863 -170.67 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.411 ' HG3' ' H ' ' A' ' 32' ' ' SER . 6.3 tp10 -129.07 -175.64 3.62 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.815 2.046 . . . . 0.0 111.312 -176.421 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.411 ' H ' ' HG3' ' A' ' 31' ' ' GLU . 78.1 p -145.68 164.96 30.15 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 126.068 1.747 . . . . 0.0 110.804 172.498 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.3 tpp180 -118.64 132.34 56.18 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.66 1.584 . . . . 0.0 109.307 177.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 1.8 m-90 -98.84 -47.54 5.25 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.472 0.709 . . . . 0.0 112.278 -156.009 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -128.56 173.31 5.73 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 127.259 2.224 . . . . 0.0 108.397 165.665 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -57.67 120.21 7.97 Favored 'Trans proline' 0 CA--C 1.55 1.313 0 C-N-CA 122.509 2.139 . . . . 0.0 111.872 172.428 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.421 ' O ' HG22 ' A' ' 40' ' ' THR . 71.5 Cg_endo -81.18 167.21 17.95 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 125.211 3.941 . . . . 0.0 113.025 -173.261 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -69.93 -4.65 21.54 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 177.314 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -93.66 -6.08 47.18 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 127.469 2.307 . . . . 0.0 113.025 177.678 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.421 HG22 ' O ' ' A' ' 37' ' ' PRO . 2.1 t -85.54 176.35 8.27 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.28 1.432 . . . . 0.0 113.171 -171.708 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -107.67 36.79 2.62 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.287 1.035 . . . . 0.0 111.8 -166.304 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 56.7 mtt -18.41 -43.33 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 130.29 3.436 . . . . 0.0 119.186 -173.297 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -52.28 -45.73 65.58 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-N 122.121 2.237 . . . . 0.0 112.222 170.936 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 23.6 m -74.65 -15.46 60.81 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 127.457 2.303 . . . . 0.0 112.894 173.221 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.686 HD13 ' H ' ' A' ' 6' ' ' GLY . 3.5 mm? -88.67 -17.17 30.56 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 120.127 1.33 . . . . 0.0 112.08 167.838 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.11 -17.74 62.56 Favored 'General case' 0 CA--C 1.553 1.062 0 CA-C-N 121.377 1.898 . . . . 0.0 111.931 -174.343 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 24.0 ptp -82.88 -7.52 59.65 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 127.864 2.466 . . . . 0.0 114.14 167.383 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.46 ' CD2' HD12 ' A' ' 45' ' ' LEU . 54.2 t80 -116.07 -55.07 2.44 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.65 1.98 . . . . 0.0 112.833 -173.19 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 93.5 mmm -68.85 5.77 1.04 Allowed 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 127.976 2.51 . . . . 0.0 113.439 173.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -158.66 151.06 21.69 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 128.346 2.659 . . . . 0.0 109.316 171.062 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 46.1 p . . . . . 0 N--CA 1.48 1.035 0 C-N-CA 125.828 1.651 . . . . 0.0 114.315 -166.489 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 25.9 m . . . . . 0 N--CA 1.48 1.031 0 CA-C-O 121.267 0.556 . . . . 0.0 111.854 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -81.64 136.51 35.52 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.291 1.036 . . . . 0.0 109.735 165.355 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 67.4 p -146.32 150.91 36.64 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-O 122.204 1.002 . . . . 0.0 110.434 170.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.67 ' H ' HD13 ' A' ' 45' ' ' LEU . . . -92.42 18.71 53.93 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-N 113.974 -1.466 . . . . 0.0 114.796 156.801 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.453 ' HG ' HD11 ' A' ' 45' ' ' LEU . 16.5 mt -70.38 148.93 95.73 Favored Pre-proline 0 CA--C 1.546 0.796 0 CA-C-N 119.61 1.705 . . . . 0.0 110.919 -170.401 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -74.61 158.0 44.0 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 121.978 1.785 . . . . 0.0 110.538 -175.648 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.75 -11.77 5.86 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 117.195 2.294 . . . . 0.0 117.195 -160.209 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -94.37 59.66 1.91 Allowed Glycine 0 CA--C 1.53 0.995 0 C-N-CA 125.148 1.356 . . . . 0.0 111.871 171.387 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 9.7 p-90 -133.24 165.07 25.65 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 115.534 1.679 . . . . 0.0 115.534 -177.389 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 176.09 172.97 0.36 Allowed 'General case' 0 CA--C 1.543 0.676 1 C-N-CA 132.564 4.345 . . . . 0.0 106.127 -177.026 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.5 t -123.99 142.99 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 125.371 1.468 . . . . 0.0 110.072 -178.212 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -138.68 149.09 44.76 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.935 1.694 . . . . 0.0 110.596 177.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -141.94 162.74 34.72 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -169.436 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.4 t -173.37 151.29 1.97 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.283 1.833 . . . . 0.0 111.714 -177.141 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -63.95 -15.98 60.45 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.541 1.136 . . . . 0.0 112.525 167.665 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.4 t -66.27 -13.99 61.28 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.752 1.621 . . . . 0.0 113.921 -177.773 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.3 ptmt -150.42 161.88 41.64 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.028 1.331 . . . . 0.0 112.87 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -71.9 -35.1 69.61 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 -170.948 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.3 mp -122.51 173.51 4.15 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 127.431 2.292 . . . . 0.0 111.151 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -75.86 171.27 18.49 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 123.269 2.646 . . . . 0.0 111.737 169.029 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 46.2 p90 -126.24 162.49 25.32 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.894 1.678 . . . . 0.0 110.731 166.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -105.23 150.13 25.37 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 121.388 -0.82 . . . . 0.0 112.359 -176.234 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 84.2 t80 -136.13 143.42 44.51 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.515 1.126 . . . . 0.0 112.969 -168.786 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 62.8 t-20 -95.18 118.0 66.59 Favored Pre-proline 0 CA--C 1.556 1.185 0 C-N-CA 123.198 0.599 . . . . 0.0 111.319 170.222 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -75.15 -19.61 17.37 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.205 2.604 . . . . 0.0 114.414 174.748 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -93.29 -15.6 25.64 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -172.386 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 88.5 m -154.02 142.63 20.82 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 128.113 2.565 . . . . 0.0 107.485 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 49.1 mmm-85 -68.17 100.63 1.04 Allowed 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.496 1.044 . . . . 0.0 110.666 177.399 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -165.73 149.59 8.08 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.099 1.759 . . . . 0.0 110.495 176.881 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 57.5 p -114.97 -179.47 3.64 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.302 1.041 . . . . 0.0 113.192 169.648 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 17.8 tpp180 -149.65 137.73 20.46 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.734 1.613 . . . . 0.0 109.801 178.749 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -129.81 -33.13 1.83 Allowed 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.069 0.948 . . . . 0.0 112.987 -154.253 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -145.43 160.09 46.25 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 129.198 2.999 . . . . 0.0 106.887 177.883 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -67.69 121.42 8.48 Favored 'Trans proline' 0 CA--C 1.546 1.113 0 C-N-CA 122.008 1.805 . . . . 0.0 112.43 -167.252 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -77.6 165.32 27.23 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 124.063 3.175 . . . . 0.0 111.799 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.63 -41.18 76.7 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 179.245 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -71.37 -0.99 11.46 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.27 1.428 . . . . 0.0 114.46 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -85.52 157.17 20.49 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.231 1.013 . . . . 0.0 111.404 177.582 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -88.46 -29.38 20.21 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-O 121.934 0.873 . . . . 0.0 113.085 -163.372 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.488 ' H ' HD23 ' A' ' 45' ' ' LEU . 43.6 mtt 69.57 -43.71 0.53 Allowed 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 129.792 3.237 . . . . 0.0 113.72 176.748 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -55.99 -52.29 64.72 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 120.009 1.277 . . . . 0.0 110.9 170.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.0 m -75.13 1.24 13.75 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 172.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.67 HD13 ' H ' ' A' ' 6' ' ' GLY . 2.7 mm? -104.12 -22.15 13.46 Favored 'General case' 0 CA--C 1.508 -0.655 0 O-C-N 120.257 -1.527 . . . . 0.0 113.963 169.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.29 -22.92 64.7 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 120.895 1.68 . . . . 0.0 111.082 -176.562 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 22.6 ptp -76.76 -6.12 50.93 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.484 2.314 . . . . 0.0 114.731 168.906 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' TYR . . . . . 0.468 ' HD2' HD12 ' A' ' 45' ' ' LEU . 56.6 t80 -122.69 -58.1 1.69 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.21 1.804 . . . . 0.0 113.342 -169.339 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 54.9 mtp -67.66 -47.74 68.66 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.891 1.277 . . . . 0.0 111.178 -175.058 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -88.74 143.64 26.78 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 148.002 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 2.0 t . . . . . 0 N--CA 1.474 0.771 0 CA-C-O 121.318 0.58 . . . . 0.0 112.431 -176.129 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.5 m . . . . . 0 N--CA 1.473 0.697 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -74.3 143.65 44.89 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.435 1.094 . . . . 0.0 111.765 166.129 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.8 p -147.27 143.49 28.15 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.524 1.53 . . . . 0.0 109.369 169.879 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.578 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -82.19 7.67 63.15 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 125.864 1.697 . . . . 0.0 116.231 160.135 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 15.5 mt -65.11 155.85 82.81 Favored Pre-proline 0 CA--C 1.553 1.088 0 CA-C-N 119.703 1.751 . . . . 0.0 111.228 -169.118 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -70.16 174.57 9.65 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.071 1.847 . . . . 0.0 111.67 -175.663 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.11 -9.48 0.4 Allowed 'General case' 0 CA--C 1.554 1.101 0 N-CA-C 117.992 2.59 . . . . 0.0 117.992 -166.517 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -105.07 63.95 0.31 Allowed Glycine 0 CA--C 1.531 1.092 0 C-N-CA 125.715 1.626 . . . . 0.0 112.143 170.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 66.5 p-90 -109.91 146.75 34.63 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 -171.009 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 169.2 174.14 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.749 1 C-N-CA 132.314 4.245 . . . . 0.0 106.71 173.544 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.6 p -141.36 143.06 28.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 CA-C-N 119.581 1.082 . . . . 0.0 112.289 175.014 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -137.72 162.91 32.63 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.958 1.703 . . . . 0.0 111.189 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -145.86 172.34 13.48 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.98 1.312 . . . . 0.0 112.245 178.199 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.2 p -157.4 172.74 18.05 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.871 -1.143 . . . . 0.0 113.152 -177.187 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -73.48 -14.38 61.22 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 121.304 -0.872 . . . . 0.0 112.497 170.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 26.6 m -79.55 -31.04 41.95 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 -171.608 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -143.6 146.47 33.31 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.308 1.843 . . . . 0.0 110.056 -173.405 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -79.26 -27.64 42.34 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.222 1.409 . . . . 0.0 112.864 179.14 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -75.62 149.42 83.59 Favored Pre-proline 0 CA--C 1.546 0.824 0 O-C-N 121.4 -0.813 . . . . 0.0 111.043 170.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -73.99 -179.55 4.75 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 123.891 3.061 . . . . 0.0 110.302 167.33 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 54.1 p90 -135.64 140.81 44.83 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.041 0.936 . . . . 0.0 110.85 159.799 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -84.58 119.66 25.46 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -90.54 127.96 36.41 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 124.097 0.959 . . . . 0.0 111.699 -169.306 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 59.7 t-20 -89.94 118.0 68.56 Favored Pre-proline 0 CA--C 1.549 0.931 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 170.532 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -79.32 -33.91 1.24 Allowed 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.609 2.206 . . . . 0.0 113.034 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -90.77 -18.2 25.35 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -168.092 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.7 m -138.31 137.56 37.52 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 126.989 2.116 . . . . 0.0 107.643 172.734 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.25 88.79 0.85 Allowed 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.778 0.831 . . . . 0.0 110.143 -175.938 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -161.04 170.82 19.75 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.391 1.477 . . . . 0.0 110.383 -172.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 18.4 p -151.01 137.14 18.34 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.296 1.039 . . . . 0.0 111.227 173.728 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 19.7 tpp180 -99.29 149.38 23.18 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.534 1.934 . . . . 0.0 109.641 -178.331 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -120.79 -30.0 4.54 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.666 1.186 . . . . 0.0 113.502 -165.657 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -149.49 153.27 36.79 Favored Pre-proline 0 CA--C 1.541 0.626 0 C-N-CA 126.477 1.911 . . . . 0.0 109.636 -172.505 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -64.47 117.08 4.16 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 123.932 3.088 . . . . 0.0 112.171 -169.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -78.78 170.76 17.63 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.856 3.037 . . . . 0.0 111.852 -179.446 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.57 -32.7 74.46 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -178.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -76.15 -10.79 59.69 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 -177.205 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -76.86 178.59 6.74 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 125.977 1.711 . . . . 0.0 114.491 -171.118 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -126.57 58.64 1.39 Allowed 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.408 1.483 . . . . 0.0 111.991 -168.172 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.473 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 1.8 mpp? -29.62 -40.62 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.075 1.75 . . . . 0.0 114.802 163.608 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 65.3 tt0 -45.51 -46.56 13.95 Favored 'General case' 0 CA--C 1.551 0.996 0 CA-C-N 120.479 1.49 . . . . 0.0 114.436 169.729 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 98.1 m -86.17 -13.21 47.71 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 127.556 2.342 . . . . 0.0 113.337 175.333 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.578 HD13 ' N ' ' A' ' 6' ' ' GLY . 37.1 tp -123.94 -17.36 6.31 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 121.3 -0.875 . . . . 0.0 112.211 -151.536 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.34 -39.17 72.39 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.371 -1.456 . . . . 0.0 109.749 153.227 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.8 mmt -63.36 8.13 0.08 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.062 1.745 . . . . 0.0 113.856 171.347 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -133.75 -44.28 0.81 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.233 1.813 . . . . 0.0 112.46 176.408 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.1 mtt -85.94 -21.82 27.72 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.719 2.008 . . . . 0.0 114.266 -177.281 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -165.37 66.29 0.12 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.281 1.832 . . . . 0.0 110.173 -177.553 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.8 m . . . . . 0 N--CA 1.473 0.696 0 C-N-CA 124.58 1.152 . . . . 0.0 113.768 -159.67 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.1 t . . . . . 0 N--CA 1.479 1.025 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -70.44 148.55 48.2 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.544 -0.722 . . . . 0.0 111.08 165.615 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 77.9 p -141.55 150.56 42.26 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.016 1.726 . . . . 0.0 108.057 173.307 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLY . . . . . 0.563 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -87.35 28.8 5.53 Favored Glycine 0 CA--C 1.525 0.671 0 CA-C-O 117.548 -1.695 . . . . 0.0 114.359 154.924 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.7 mt -76.0 159.65 80.19 Favored Pre-proline 0 CA--C 1.547 0.828 0 CA-C-N 120.333 2.067 . . . . 0.0 110.75 -175.495 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -68.86 174.97 7.94 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 122.644 2.23 . . . . 0.0 111.575 -179.629 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.61 33.37 0.05 Allowed 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 116.28 1.956 . . . . 0.0 116.28 -167.238 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -166.08 99.25 0.16 Allowed Glycine 0 CA--C 1.532 1.153 0 C-N-CA 125.968 1.747 . . . . 0.0 111.872 170.706 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 19.4 p-90 -155.58 147.46 23.28 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 115.208 1.558 . . . . 0.0 115.208 -175.429 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -159.9 150.52 18.96 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 128.843 2.857 . . . . 0.0 106.809 168.364 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 18.9 t -102.85 120.2 52.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 CA-C-N 120.561 1.528 . . . . 0.0 110.862 -170.726 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.4 mmp_? -111.86 115.75 29.51 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.572 0.749 . . . . 0.0 111.623 176.649 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 4.0 p80 -155.74 158.94 39.03 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.775 2.03 . . . . 0.0 110.945 175.243 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 41.7 p -137.53 170.31 16.29 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.586 0.708 . . . . 0.0 112.815 -173.33 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -58.87 -24.71 62.52 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.13 0.972 . . . . 0.0 113.452 167.491 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 67.9 m -91.47 -6.42 52.68 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.205 1.402 . . . . 0.0 113.7 176.845 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -163.16 111.59 1.27 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.499 1.519 . . . . 0.0 111.034 173.001 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -64.06 -33.28 75.39 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.714 0.806 . . . . 0.0 112.888 175.259 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.44 114.3 20.93 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 123.186 0.595 . . . . 0.0 111.239 -167.613 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -77.37 139.61 18.68 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 123.208 2.605 . . . . 0.0 111.425 -172.556 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 55.9 p90 -105.19 135.34 46.74 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 153.656 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -90.15 100.4 13.23 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 121.67 -0.644 . . . . 0.0 110.212 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -63.5 129.4 40.03 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.049 1.34 . . . . 0.0 110.979 -179.605 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 58.4 t-20 -88.29 121.52 70.31 Favored Pre-proline 0 CA--C 1.556 1.193 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 174.043 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -79.27 -19.96 10.11 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 124.509 3.472 . . . . 0.0 113.559 178.124 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -91.67 -40.74 11.12 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.834 0.854 . . . . 0.0 111.969 -175.031 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.8 m -120.33 142.23 49.32 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.614 1.966 . . . . 0.0 109.104 175.002 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 -65.09 97.67 0.26 Allowed 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.277 1.031 . . . . 0.0 110.265 168.681 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -175.21 158.5 2.4 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.892 2.077 . . . . 0.0 109.542 -172.188 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 88.1 p -134.16 118.28 17.49 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 120.789 -1.194 . . . . 0.0 112.568 168.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 11.2 tpp180 -70.02 128.5 36.54 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.898 1.679 . . . . 0.0 109.576 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -90.57 -45.76 8.72 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.922 1.289 . . . . 0.0 111.743 -167.061 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -152.67 163.22 24.22 Favored Pre-proline 0 CA--C 1.549 0.919 0 C-N-CA 128.128 2.571 . . . . 0.0 107.898 -165.082 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -60.63 123.37 12.88 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 122.942 2.428 . . . . 0.0 113.578 -168.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -87.12 162.45 8.63 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 124.612 3.541 . . . . 0.0 113.413 178.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.51 -6.92 2.67 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 125.441 1.496 . . . . 0.0 114.917 172.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -104.89 9.08 34.82 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.344 1.858 . . . . 0.0 113.613 179.302 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -90.13 -179.91 5.77 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.551 1.94 . . . . 0.0 111.314 179.115 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -103.54 -34.12 8.78 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 120.149 -1.594 . . . . 0.0 112.663 -169.871 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.509 ' HA ' ' HB3' ' A' ' 45' ' ' LEU 0.252 90.3 mtp 60.76 -38.45 0.1 Allowed 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 129.118 2.967 . . . . 0.0 115.577 -170.994 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -64.07 -53.33 51.5 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 122.382 2.355 . . . . 0.0 111.498 -178.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.2 m -65.3 -7.15 12.0 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 125.563 1.545 . . . . 0.0 112.937 170.085 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.563 HD13 ' N ' ' A' ' 6' ' ' GLY . 10.8 tp -112.6 -27.18 8.3 Favored 'General case' 0 C--O 1.217 -0.613 0 O-C-N 120.894 -1.128 . . . . 0.0 112.256 -166.461 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.68 -40.13 96.12 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 120.853 1.661 . . . . 0.0 110.378 170.231 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 14.6 ptm -63.72 -6.96 6.34 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 126.052 1.741 . . . . 0.0 114.941 169.029 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -108.7 -50.47 3.01 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.356 1.463 . . . . 0.0 111.985 174.512 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 85.1 mtp -62.62 -36.89 84.24 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 127.167 2.187 . . . . 0.0 112.029 -178.756 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.56 88.08 7.02 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 156.629 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 15.0 t . . . . . 0 N--CA 1.475 0.818 0 C-N-CA 125.497 1.519 . . . . 0.0 114.591 -165.311 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 32.9 m . . . . . 0 N--CA 1.48 1.047 0 CA-C-O 121.494 0.664 . . . . 0.0 111.541 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -139.49 154.11 47.65 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.678 0.791 . . . . 0.0 109.836 160.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 62.2 p -133.78 126.71 31.2 Favored 'General case' 0 CA--C 1.51 -0.567 0 C-N-CA 124.811 1.244 . . . . 0.0 109.046 -174.771 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -66.83 5.93 2.24 Favored Glycine 0 CA--C 1.532 1.124 0 C-N-CA 125.229 1.395 . . . . 0.0 114.445 163.597 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 31.8 mt -63.19 155.98 70.99 Favored Pre-proline 0 CA--C 1.551 0.983 0 CA-C-N 118.917 1.358 . . . . 0.0 110.391 175.556 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -79.35 -135.62 0.02 OUTLIER 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 123.452 2.768 . . . . 0.0 110.495 -178.797 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.97 -26.21 66.7 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 120.806 -1.184 . . . . 0.0 114.144 177.635 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -93.04 83.53 1.09 Allowed Glycine 0 C--N 1.338 0.651 0 C-N-CA 125.609 1.576 . . . . 0.0 109.493 176.389 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -136.38 -13.18 1.8 Allowed 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 117.583 2.438 . . . . 0.0 117.583 -166.8 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -92.09 117.85 30.25 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.834 1.197 . . . . 0.0 109.809 -170.114 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 20.9 t -75.12 123.3 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 O-C-N 121.047 -1.033 . . . . 0.0 110.691 -164.741 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.6 mmt180 -130.75 153.27 49.19 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.05 1.34 . . . . 0.0 110.259 176.113 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 32.1 p-80 -144.02 169.77 17.19 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.375 1.07 . . . . 0.0 112.78 -173.1 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.2 t -162.62 149.85 13.47 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.1 1.36 . . . . 0.0 111.521 -176.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.2 m120 -67.23 -19.22 65.5 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.236 -0.915 . . . . 0.0 111.925 170.549 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.5 m -88.31 9.84 21.82 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 125.136 1.375 . . . . 0.0 113.368 177.114 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.8 tptm -147.84 125.15 11.55 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.912 1.285 . . . . 0.0 111.196 179.312 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 53.7 m-80 -66.61 -8.07 24.73 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 115.782 1.771 . . . . 0.0 115.782 -169.472 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -157.53 165.53 18.53 Favored Pre-proline 0 CA--C 1.549 0.918 0 C-N-CA 126.8 2.04 . . . . 0.0 109.999 -173.376 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -77.99 159.55 30.62 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 123.152 2.568 . . . . 0.0 111.995 -175.401 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 51.5 p90 -123.69 143.61 50.16 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 126.048 1.739 . . . . 0.0 110.225 171.753 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -97.55 100.37 11.78 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.537 -0.727 . . . . 0.0 109.98 -173.399 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -63.55 137.01 57.96 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.887 1.675 . . . . 0.0 112.233 -173.495 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 57.5 t-20 -95.97 122.41 58.45 Favored Pre-proline 0 CA--C 1.547 0.836 0 C-N-CA 124.061 0.944 . . . . 0.0 108.793 167.824 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -78.34 -36.69 0.89 Allowed 'Trans proline' 0 CA--C 1.534 0.514 0 C-N-CA 122.498 2.132 . . . . 0.0 113.093 176.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -85.25 -12.63 52.05 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -169.947 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 30.3 m -135.19 141.14 45.8 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.608 1.963 . . . . 0.0 108.282 173.311 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -66.73 89.15 0.15 Allowed 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.476 1.035 . . . . 0.0 109.651 170.324 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -171.92 179.13 2.8 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.664 1.585 . . . . 0.0 110.114 -172.898 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.2 p -160.5 173.77 15.06 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.851 1.66 . . . . 0.0 109.825 172.22 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.6 tpp180 -125.88 138.31 53.79 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.368 1.067 . . . . 0.0 110.608 -172.811 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -104.71 -32.06 9.06 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.34 1.456 . . . . 0.0 112.99 -163.993 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -143.72 162.06 43.35 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 128.476 2.71 . . . . 0.0 107.866 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.67 114.76 1.99 Allowed 'Trans proline' 0 CA--C 1.549 1.273 0 C-N-CA 123.306 2.671 . . . . 0.0 111.218 166.247 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -79.09 -166.9 0.44 Allowed 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 124.776 3.651 . . . . 0.0 111.974 -177.423 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -81.61 -18.44 44.71 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 177.266 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -95.01 7.58 45.64 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.118 1.767 . . . . 0.0 113.355 -174.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.2 t -96.73 162.02 13.61 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 126.58 1.952 . . . . 0.0 112.836 -174.188 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -89.25 -34.47 16.61 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 121.287 0.565 . . . . 0.0 112.129 -157.79 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . 0.26 28.6 mtt 61.55 -37.03 0.11 Allowed 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 130.148 3.379 . . . . 0.0 115.675 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -60.82 -29.07 69.25 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.838 1.255 . . . . 0.0 112.065 168.341 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.4 m -102.86 26.16 8.43 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.681 1.592 . . . . 0.0 112.109 168.731 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 76.4 mt -129.4 -20.09 3.36 Favored 'General case' 0 CA--C 1.507 -0.674 0 O-C-N 119.507 -1.995 . . . . 0.0 115.554 170.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.74 -27.1 67.34 Favored 'General case' 0 CA--C 1.556 1.178 0 CA-C-N 123.092 2.678 . . . . 0.0 111.743 177.947 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 26.3 ptm -59.24 -14.62 11.6 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 128.053 2.541 . . . . 0.0 115.21 164.859 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -127.36 -57.15 1.3 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.688 1.595 . . . . 0.0 113.122 -165.821 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 67.7 mmm -66.04 -10.87 44.1 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 127.361 2.265 . . . . 0.0 114.981 -175.556 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.02 110.62 5.13 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.003 1.321 . . . . 0.0 109.527 169.863 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 55.4 m . . . . . 0 N--CA 1.475 0.815 0 C-N-CA 124.936 1.294 . . . . 0.0 113.808 -162.845 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.2 t . . . . . 0 N--CA 1.476 0.854 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 57.5 mtt -146.0 66.76 1.2 Allowed 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.521 1.128 . . . . 0.0 111.124 -161.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 22.8 m -123.96 158.46 30.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 125.532 1.533 . . . . 0.0 113.167 -171.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 22.0 m120 -94.37 133.83 37.53 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.312 1.045 . . . . 0.0 110.468 168.203 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.445 HG22 ' CD2' ' A' ' 48' ' ' TYR . 24.6 p -134.89 128.26 32.27 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.471 1.509 . . . . 0.0 108.635 174.745 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -73.25 47.65 1.37 Allowed Glycine 0 CA--C 1.525 0.69 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.871 158.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.8 mt -82.83 171.15 12.4 Favored Pre-proline 0 CA--C 1.545 0.765 0 O-C-N 121.586 -0.95 . . . . 0.0 109.711 171.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -66.39 153.0 79.68 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 N-CA-C 108.656 -1.325 . . . . 0.0 108.656 171.13 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.28 -25.65 3.96 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 116.067 1.877 . . . . 0.0 116.067 -165.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -77.36 57.03 3.72 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 125.028 1.299 . . . . 0.0 112.612 166.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 2.4 p90 -96.33 149.84 21.23 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.368 1.067 . . . . 0.0 113.343 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 174.42 99.16 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 130.089 3.355 . . . . 0.0 107.27 168.457 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 39.4 t -69.46 115.53 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 CA-C-N 119.112 0.869 . . . . 0.0 111.066 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -106.05 176.61 5.11 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.223 1.809 . . . . 0.0 109.636 165.141 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 16.9 p80 -161.84 147.21 13.28 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.954 -1.092 . . . . 0.0 112.299 -178.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.2 m -70.14 156.59 38.98 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -177.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -62.3 -46.14 90.1 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.349 1.06 . . . . 0.0 112.762 -176.478 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.1 m -130.17 -28.11 2.17 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.933 1.293 . . . . 0.0 112.936 -170.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.3 mttm -74.87 149.68 39.46 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 126.0 1.72 . . . . 0.0 111.476 172.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -96.07 -5.88 39.9 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 118.466 2.765 . . . . 0.0 118.466 -153.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -100.02 158.13 32.61 Favored Pre-proline 0 N--CA 1.481 1.114 0 CA-C-N 120.876 1.671 . . . . 0.0 112.374 177.471 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -77.41 174.99 11.86 Favored 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 124.018 3.145 . . . . 0.0 110.934 169.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 16.8 p90 -142.17 137.23 30.71 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.912 0.885 . . . . 0.0 110.247 159.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -98.76 102.62 14.41 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.057 -1.027 . . . . 0.0 110.378 -171.053 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -75.54 131.3 39.95 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.428 1.091 . . . . 0.0 111.287 -177.133 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 60.5 t-20 -87.66 121.18 71.1 Favored Pre-proline 0 CA--C 1.546 0.807 0 CA-C-O 118.652 -0.689 . . . . 0.0 109.648 167.133 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -76.63 -35.09 2.2 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 122.595 2.196 . . . . 0.0 113.204 174.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -90.51 -15.88 29.91 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 -169.706 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.0 m -132.47 138.88 47.75 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.538 1.935 . . . . 0.0 107.207 171.454 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 35.7 mtp-105 -70.41 87.74 0.64 Allowed 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 118.554 0.616 . . . . 0.0 110.421 175.188 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -165.79 170.54 13.83 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.96 2.104 . . . . 0.0 111.7 -172.019 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 79.6 p -152.97 155.86 37.77 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.01 1.324 . . . . 0.0 112.043 177.423 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -124.85 147.23 48.88 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 126.741 2.016 . . . . 0.0 109.315 -177.717 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -113.57 -34.61 5.49 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 113.221 0.822 . . . . 0.0 113.221 -160.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -144.03 167.11 16.17 Favored Pre-proline 0 CA--C 1.554 1.126 0 C-N-CA 129.416 3.087 . . . . 0.0 106.878 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -65.12 116.99 4.16 Favored 'Trans proline' 0 CA--C 1.553 1.448 0 C-N-CA 123.06 2.507 . . . . 0.0 113.029 -175.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -87.4 179.94 2.91 Favored 'Trans proline' 0 C--N 1.357 1.003 1 C-N-CA 125.468 4.112 . . . . 0.0 114.036 -175.797 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.76 -29.72 70.27 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.452 1.278 . . . . 0.0 114.452 175.246 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -76.82 0.04 22.2 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.89 1.276 . . . . 0.0 114.105 177.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.4 169.88 14.13 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.521 1.529 . . . . 0.0 112.458 -173.282 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -125.72 56.53 1.39 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.283 1.833 . . . . 0.0 110.907 -171.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.437 ' HA ' ' HB2' ' A' ' 45' ' ' LEU . 62.5 mtm -25.97 -42.44 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.424 0 C-N-CA 127.771 2.428 . . . . 0.0 116.538 171.489 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -53.57 -53.83 46.13 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 121.787 2.085 . . . . 0.0 112.032 172.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.8 m -71.95 -6.73 44.14 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 126.51 1.924 . . . . 0.0 112.238 173.136 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.437 ' HB2' ' HA ' ' A' ' 42' ' ' MET . 71.7 mt -95.81 -20.9 18.47 Favored 'General case' 0 CA--C 1.507 -0.681 0 O-C-N 120.254 -1.529 . . . . 0.0 113.954 166.628 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -68.15 -38.17 81.85 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 121.812 2.096 . . . . 0.0 109.707 -172.173 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 23.7 ptm -60.16 -13.01 9.98 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 128.422 2.689 . . . . 0.0 115.342 165.37 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.445 ' CD2' HG22 ' A' ' 5' ' ' THR . 39.8 t80 -110.42 -65.44 1.16 Allowed 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.016 1.726 . . . . 0.0 112.348 -177.616 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 55.5 mtp -63.17 -17.19 62.11 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 128.102 2.561 . . . . 0.0 114.752 -172.1 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -128.23 148.48 50.63 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.071 1.348 . . . . 0.0 111.081 173.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 90.6 m -96.92 -56.81 2.45 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.947 1.299 . . . . 0.0 110.924 -176.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -85.15 147.35 26.66 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 118.718 0.69 . . . . 0.0 110.28 160.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 32.9 m80 . . . . . 0 C--O 1.253 1.262 0 C-N-CA 124.137 0.975 . . . . 0.0 112.866 -173.857 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 23.3 t . . . . . 0 N--CA 1.477 0.877 0 N-CA-C 110.751 -0.092 . . . . 0.0 110.751 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.9 ppp? -68.22 166.31 16.57 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.016 1.726 . . . . 0.0 114.983 -173.225 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 17.7 m -142.82 146.61 21.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 124.513 1.125 . . . . 0.0 112.932 178.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 37.8 t-20 -95.0 154.58 17.11 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.121 1.368 . . . . 0.0 109.766 159.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.412 HG22 ' CD2' ' A' ' 48' ' ' TYR . 70.4 p -134.22 135.4 42.95 Favored 'General case' 0 CA--C 1.509 -0.626 0 C-N-CA 124.735 1.214 . . . . 0.0 109.129 170.333 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -81.01 45.24 3.15 Favored Glycine 0 CA--C 1.526 0.745 0 CA-C-N 114.528 -1.215 . . . . 0.0 111.966 155.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.9 mt -93.41 165.56 18.0 Favored Pre-proline 0 CA--C 1.553 1.093 0 CA-C-N 119.831 1.815 . . . . 0.0 110.256 173.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_endo -77.48 -153.86 0.05 OUTLIER 'Trans proline' 0 CA--C 1.548 1.188 0 C-N-CA 123.797 2.998 . . . . 0.0 111.457 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.12 -15.93 38.65 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.246 1.418 . . . . 0.0 114.733 173.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -108.29 83.2 0.32 Allowed Glycine 0 C--N 1.337 0.603 0 C-N-CA 126.524 2.012 . . . . 0.0 110.568 173.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -124.22 0.42 8.39 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 115.157 1.539 . . . . 0.0 115.157 -179.778 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -80.51 102.55 9.8 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.786 0.721 . . . . 0.0 110.438 -172.474 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 75.8 t -66.3 131.06 32.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 O-C-N 121.572 -0.705 . . . . 0.0 111.422 -172.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.7 mmt-85 -131.11 120.66 23.69 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.339 1.856 . . . . 0.0 109.312 172.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -92.03 14.03 17.07 Favored 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 -176.238 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.6 m -73.07 107.29 5.34 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.539 -1.35 . . . . 0.0 111.049 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 55.0 t-20 174.85 135.7 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 128.714 2.806 . . . . 0.0 107.133 -172.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 42.4 m -59.21 -24.92 63.54 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.09 1.356 . . . . 0.0 113.376 168.691 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.5 mmtt -103.01 141.06 36.44 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.14 1.376 . . . . 0.0 110.532 178.537 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -79.16 24.52 0.33 Allowed 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 -154.791 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -111.97 146.0 33.91 Favored Pre-proline 0 CA--C 1.544 0.726 0 C-N-CA 124.921 1.289 . . . . 0.0 110.509 171.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -76.87 166.71 26.48 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 123.587 2.858 . . . . 0.0 112.208 176.223 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 46.0 p90 -107.43 159.24 16.55 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.306 153.259 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -100.93 125.4 47.5 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 171.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PHE . . . . . 0.4 ' CE2' ' HA ' ' A' ' 27' ' ' PRO . 24.7 t80 -83.35 142.59 30.94 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 121.433 -0.792 . . . . 0.0 111.388 177.537 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -96.46 92.39 1.07 Allowed Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 126.041 1.736 . . . . 0.0 110.117 170.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.4 ' HA ' ' CE2' ' A' ' 25' ' ' PHE . 9.8 Cg_endo -54.7 -22.72 29.99 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.691 2.928 . . . . 0.0 115.827 -176.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -94.57 -4.85 47.13 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 115.402 1.63 . . . . 0.0 115.402 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.6 m -143.68 149.05 36.65 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 119.701 1.137 . . . . 0.0 111.11 -164.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 55.0 mtp180 -83.97 67.75 9.75 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 121.05 -1.031 . . . . 0.0 110.346 171.107 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -159.14 169.08 24.97 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 126.748 2.019 . . . . 0.0 109.777 -176.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 92.6 p -140.68 161.15 38.45 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.93 -1.106 . . . . 0.0 113.394 172.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -120.08 158.18 27.38 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.505 1.922 . . . . 0.0 110.221 178.635 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -144.5 -17.16 0.55 Allowed 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 114.368 1.248 . . . . 0.0 114.368 -160.101 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -154.7 161.4 29.47 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 128.159 2.584 . . . . 0.0 107.12 -173.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -70.64 117.52 5.18 Favored 'Trans proline' 0 CA--C 1.548 1.199 0 C-N-CA 123.05 2.5 . . . . 0.0 111.956 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -83.73 -161.07 0.13 Allowed 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 124.77 3.647 . . . . 0.0 112.476 -178.321 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -95.1 -21.82 18.29 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 120.51 -1.368 . . . . 0.0 114.02 -178.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -76.99 0.13 22.33 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.998 1.719 . . . . 0.0 112.862 169.526 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -82.63 172.75 12.61 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 126.968 2.107 . . . . 0.0 111.973 -178.904 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -129.94 65.72 1.49 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.103 1.761 . . . . 0.0 111.253 -173.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.433 ' HA ' ' HB2' ' A' ' 45' ' ' LEU . 41.1 mtm -37.83 -35.88 0.16 Allowed 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 116.582 2.067 . . . . 0.0 116.582 174.622 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -68.28 -12.71 61.47 Favored 'General case' 0 CA--C 1.56 1.346 0 CA-C-N 121.481 1.946 . . . . 0.0 114.081 176.221 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 31.9 m -107.42 -2.41 20.54 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 128.019 2.528 . . . . 0.0 111.837 166.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.433 ' HB2' ' HA ' ' A' ' 42' ' ' MET . 79.4 mt -98.68 -18.43 18.05 Favored 'General case' 0 CA--C 1.507 -0.698 0 CA-C-O 115.871 -2.014 . . . . 0.0 114.48 171.402 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.417 ' HE2' ' HA ' ' A' ' 46' ' ' LYS . 7.4 mmpt? -68.85 -37.28 79.02 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 123.392 2.814 . . . . 0.0 110.601 -175.705 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 23.1 ptp -51.86 -22.43 3.75 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.469 1.908 . . . . 0.0 114.054 164.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.412 ' CD2' HG22 ' A' ' 5' ' ' THR . 43.1 t80 -104.11 -70.03 0.78 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 126.497 1.919 . . . . 0.0 112.66 -178.109 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 12.9 mtt -66.05 -15.53 63.14 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 128.129 2.572 . . . . 0.0 115.265 -174.652 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -162.5 60.3 0.22 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.97 1.308 . . . . 0.0 111.351 -177.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 5.8 m -25.94 91.2 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 128.877 2.871 . . . . 0.0 115.187 -159.537 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -62.31 122.85 16.68 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.491 1.117 . . . . 0.0 111.907 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 5.9 t60 . . . . . 0 C--O 1.248 1.017 0 C-N-CA 123.986 0.914 . . . . 0.0 113.286 -164.976 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.6 m . . . . . 0 N--CA 1.476 0.849 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 59.7 mtt -93.79 150.03 20.73 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.997 0.919 . . . . 0.0 111.909 163.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -146.31 154.49 12.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 124.345 1.058 . . . . 0.0 111.791 -176.091 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -70.55 146.37 50.2 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.496 0.719 . . . . 0.0 111.713 169.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 63.6 p -136.83 142.55 42.87 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.857 1.663 . . . . 0.0 109.257 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.602 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -75.24 16.98 3.3 Favored Glycine 0 CA--C 1.535 1.29 0 CA-C-O 118.486 -1.175 . . . . 0.0 115.635 152.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 16.4 mt -71.88 156.12 91.34 Favored Pre-proline 0 CA--C 1.547 0.865 0 CA-C-N 120.391 2.095 . . . . 0.0 110.252 -177.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -78.67 -150.82 0.04 OUTLIER 'Trans proline' 0 CA--C 1.548 1.198 0 C-N-CA 122.872 2.382 . . . . 0.0 111.503 -172.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.73 -22.97 58.91 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 120.517 -1.364 . . . . 0.0 114.678 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -102.53 81.53 0.39 Allowed Glycine 0 C--N 1.34 0.761 0 C-N-CA 126.445 1.974 . . . . 0.0 110.542 174.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 10.2 p-90 -130.33 -6.96 4.26 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.73 1.381 . . . . 0.0 114.73 -175.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.2 tp10 -75.67 103.25 5.69 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 118.993 0.815 . . . . 0.0 109.191 -175.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.0 p -66.47 134.78 29.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.179 0.591 . . . . 0.0 111.589 -174.241 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -130.5 125.83 35.33 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.667 1.587 . . . . 0.0 110.179 176.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 28.1 p-80 -88.04 -11.52 46.98 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.248 1.419 . . . . 0.0 114.668 -173.437 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 44.6 m -51.19 108.09 0.23 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.918 1.287 . . . . 0.0 112.997 -174.186 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.1 p30 152.26 140.78 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 131.619 3.967 . . . . 0.0 109.835 -179.234 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 38.0 m -70.07 -15.9 63.06 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.709 1.604 . . . . 0.0 112.897 168.073 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.4 ttmt -79.1 -166.17 0.88 Allowed 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.71 1.204 . . . . 0.0 112.463 -179.34 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.1 m120 -94.93 -30.32 14.21 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 -154.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -114.77 156.16 45.3 Favored Pre-proline 0 N--CA 1.475 0.782 0 C-N-CA 124.662 1.185 . . . . 0.0 111.776 -177.071 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -79.57 -173.68 1.97 Allowed 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 123.828 3.018 . . . . 0.0 110.562 171.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 45.7 p90 -133.39 149.87 51.82 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.281 1.432 . . . . 0.0 110.05 161.1 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -93.34 132.13 37.85 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 121.313 -0.867 . . . . 0.0 110.312 174.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -100.42 147.92 25.31 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.514 1.125 . . . . 0.0 111.681 178.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.4 t-20 -102.47 110.02 61.96 Favored Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 123.914 0.885 . . . . 0.0 110.265 162.302 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -63.97 -29.94 66.81 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 123.137 2.558 . . . . 0.0 114.613 177.092 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.4 -30.77 57.6 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 -172.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 95.6 m -147.1 105.39 3.77 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 126.248 1.819 . . . . 0.0 107.616 177.024 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -47.18 104.56 0.05 Allowed 'General case' 0 C--O 1.237 0.419 0 C-N-CA 128.147 2.579 . . . . 0.0 111.927 -171.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -171.59 158.09 4.97 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.968 1.707 . . . . 0.0 109.799 -171.065 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 92.6 p -127.3 162.19 26.84 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 174.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 8.1 tpp85 -134.31 150.21 50.94 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 126.725 2.01 . . . . 0.0 109.249 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -142.54 -18.28 0.7 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.561 1.144 . . . . 0.0 112.863 -156.62 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -149.54 155.96 39.03 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 128.179 2.592 . . . . 0.0 107.504 -175.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -66.03 121.75 9.14 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.823 2.349 . . . . 0.0 110.87 178.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -80.07 167.91 19.4 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 123.545 2.83 . . . . 0.0 111.494 175.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.39 -28.17 68.42 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -176.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -71.48 -24.89 62.07 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.24 1.816 . . . . 0.0 113.859 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.41 164.38 23.14 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 127.034 2.134 . . . . 0.0 113.96 -163.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -107.88 53.42 0.69 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.216 1.407 . . . . 0.0 111.24 -162.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.428 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 77.4 mtm -27.2 -40.38 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 129.045 2.938 . . . . 0.0 115.103 166.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -50.61 -47.58 58.21 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 121.555 1.979 . . . . 0.0 113.542 173.219 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 21.5 m -78.52 -21.04 49.45 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 128.04 2.536 . . . . 0.0 112.162 176.047 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.602 HD13 ' N ' ' A' ' 6' ' ' GLY . 38.3 tp -117.48 -21.4 8.64 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 123.976 0.91 . . . . 0.0 111.3 -150.321 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.9 -35.48 69.03 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 120.598 1.544 . . . . 0.0 111.015 157.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 8.5 mmt -60.43 -24.96 65.61 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 172.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -97.36 -45.48 6.45 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.858 1.663 . . . . 0.0 112.78 -178.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 35.1 mtt -76.33 -17.25 59.51 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.268 1.827 . . . . 0.0 112.697 -177.03 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -104.3 165.01 11.33 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.044 1.338 . . . . 0.0 110.398 157.095 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -121.5 -2.75 9.41 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.078 1.351 . . . . 0.0 113.343 178.407 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -57.75 149.71 21.51 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.505 1.122 . . . . 0.0 112.249 157.487 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 78.7 t60 . . . . . 0 C--O 1.252 1.23 0 C-N-CA 125.17 1.388 . . . . 0.0 113.527 -176.174 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 80.8 p . . . . . 0 N--CA 1.476 0.85 0 CA-C-O 118.872 -0.585 . . . . 0.0 111.495 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 99.2 mmm -77.36 132.05 38.37 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.98 1.264 . . . . 0.0 110.612 178.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 18.5 t -107.83 158.43 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 127.048 2.139 . . . . 0.0 108.664 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.8 m120 -53.26 131.02 36.63 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 122.093 -0.38 . . . . 0.0 111.29 168.29 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 44.7 p -129.39 146.59 51.23 Favored 'General case' 0 CA--C 1.508 -0.668 0 C-N-CA 125.508 1.523 . . . . 0.0 108.337 171.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.412 ' H ' HD23 ' A' ' 45' ' ' LEU . . . -94.47 52.92 2.08 Favored Glycine 0 CA--C 1.524 0.616 0 CA-C-N 113.795 -1.548 . . . . 0.0 111.5 154.562 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.447 ' HG ' HD21 ' A' ' 45' ' ' LEU . 15.0 mt -88.63 169.06 14.24 Favored Pre-proline 0 CA--C 1.551 1.013 0 CA-C-N 118.699 1.25 . . . . 0.0 110.311 175.46 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -75.8 -158.34 0.08 OUTLIER 'Trans proline' 0 CA--C 1.548 1.209 0 C-N-CA 121.726 1.618 . . . . 0.0 110.801 177.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.4 12.8 0.54 Allowed 'General case' 0 CA--C 1.551 1.002 0 N-CA-C 115.657 1.725 . . . . 0.0 115.657 -172.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -142.14 102.32 0.3 Allowed Glycine 0 C--N 1.334 0.472 0 C-N-CA 126.046 1.784 . . . . 0.0 109.276 173.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 52.7 p-90 -141.64 -2.47 1.21 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.411 1.484 . . . . 0.0 114.264 -171.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.09 161.25 11.21 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.576 0.751 . . . . 0.0 110.927 159.487 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.5 m -118.51 149.28 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.37 1.068 . . . . 0.0 112.866 -173.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.406 ' HB2' ' CE1' ' A' ' 23' ' ' TYR . 22.9 mmt85 -141.44 118.89 11.53 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.473 1.909 . . . . 0.0 110.196 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 16.4 p-80 -74.52 166.16 23.99 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 113.631 0.974 . . . . 0.0 113.631 175.529 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 29.0 t -160.49 130.88 5.34 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 125.46 1.504 . . . . 0.0 110.176 176.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -58.9 -24.44 62.32 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 -176.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 69.5 m -71.94 -15.79 62.09 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.944 1.298 . . . . 0.0 114.063 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -108.21 168.03 9.59 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.566 1.546 . . . . 0.0 113.045 -171.23 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -92.97 -9.94 38.15 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 169.196 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -160.77 164.64 18.82 Favored Pre-proline 0 CA--C 1.55 0.947 0 C-N-CA 126.906 2.082 . . . . 0.0 109.598 -177.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.57 162.68 40.69 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 122.782 2.321 . . . . 0.0 113.125 -177.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.406 ' CE1' ' HB2' ' A' ' 14' ' ' ARG . 33.2 p90 -95.24 157.57 15.84 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.805 0.842 . . . . 0.0 110.953 160.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -83.0 143.42 30.65 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 121.683 -0.636 . . . . 0.0 110.388 171.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -116.83 145.2 43.7 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.301 1.04 . . . . 0.0 112.493 -174.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -101.13 98.15 8.31 Favored Pre-proline 0 CA--C 1.552 1.031 0 C-N-CA 124.702 1.201 . . . . 0.0 110.447 176.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -66.72 -29.67 42.55 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 122.692 2.261 . . . . 0.0 115.137 -167.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.73 -24.38 41.66 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.868 1.432 . . . . 0.0 114.868 -176.292 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.8 m -146.47 126.68 13.85 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 125.274 1.43 . . . . 0.0 109.51 178.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -50.36 101.12 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.196 1.798 . . . . 0.0 112.736 -176.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -168.08 154.48 7.54 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 127.019 2.128 . . . . 0.0 110.749 179.515 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 82.4 p -129.53 151.55 50.02 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.878 1.271 . . . . 0.0 112.735 176.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 18.0 tpp180 -126.34 146.35 50.07 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 127.471 2.308 . . . . 0.0 109.831 -176.022 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -130.62 -36.33 1.43 Allowed 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -158.228 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -146.28 150.53 41.52 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 126.554 1.942 . . . . 0.0 107.861 -178.037 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -48.27 112.61 0.62 Allowed 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 124.817 3.678 . . . . 0.0 114.391 -174.534 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -80.14 163.45 22.66 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 123.488 2.792 . . . . 0.0 112.203 -177.199 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.84 -22.71 66.87 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.058 1.132 . . . . 0.0 114.058 -178.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -90.75 -1.03 57.88 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.207 1.803 . . . . 0.0 113.998 -174.447 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.86 -173.6 1.93 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 126.009 1.723 . . . . 0.0 113.794 -170.659 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -119.09 60.27 0.82 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 126.149 1.78 . . . . 0.0 110.229 177.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 59.6 mtt -31.96 -46.33 0.12 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.901 1.68 . . . . 0.0 113.93 168.083 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -53.6 -36.58 62.11 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 120.351 1.432 . . . . 0.0 113.995 177.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 75.9 m -85.65 -28.19 24.91 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.28 1.432 . . . . 0.0 111.822 171.212 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.447 HD21 ' HG ' ' A' ' 7' ' ' LEU . 81.3 mt -72.31 -14.19 61.68 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 119.818 1.19 . . . . 0.0 112.536 174.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.24 -18.18 64.49 Favored 'General case' 0 CA--C 1.55 0.954 0 CA-C-N 120.624 1.556 . . . . 0.0 111.988 -175.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 93.3 mmm -79.84 -8.77 59.48 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 128.146 2.578 . . . . 0.0 113.688 168.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.406 ' HD2' HD22 ' A' ' 45' ' ' LEU . 67.9 t80 -121.27 -56.25 1.91 Allowed 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.786 2.034 . . . . 0.0 113.095 -166.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 88.3 mmm -67.16 -11.79 58.26 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.986 2.115 . . . . 0.0 113.267 178.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.3 151.0 40.0 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.636 1.974 . . . . 0.0 110.338 159.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 5.0 m -85.07 125.8 33.06 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.929 1.292 . . . . 0.0 110.229 -175.156 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -62.48 135.01 57.21 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.265 0.626 . . . . 0.0 111.903 176.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 21.0 t60 . . . . . 0 C--O 1.253 1.256 0 C-N-CA 124.375 1.07 . . . . 0.0 113.569 -167.028 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 57.1 m . . . . . 0 N--CA 1.478 0.937 0 CA-C-O 118.96 -0.543 . . . . 0.0 110.853 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 19.7 ptt? 166.04 145.49 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 128.636 2.775 . . . . 0.0 111.626 173.337 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 17.0 m -132.8 152.52 36.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 125.101 1.36 . . . . 0.0 111.475 177.039 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.7 m120 -111.24 128.66 56.0 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.113 0.965 . . . . 0.0 109.667 164.313 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 24.4 p -115.37 127.98 55.76 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.664 1.586 . . . . 0.0 108.217 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -76.33 55.0 3.23 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 110.797 -0.921 . . . . 0.0 110.797 158.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.8 mt -93.07 166.66 15.85 Favored Pre-proline 0 CA--C 1.55 0.964 0 CA-C-N 118.745 1.273 . . . . 0.0 110.905 176.264 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -77.24 -141.45 0.02 OUTLIER 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 123.526 2.817 . . . . 0.0 110.211 176.69 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.09 -21.43 64.97 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 120.451 -1.406 . . . . 0.0 113.675 177.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -98.52 81.33 0.6 Allowed Glycine 0 C--N 1.337 0.603 0 C-N-CA 126.974 2.226 . . . . 0.0 110.146 172.528 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 52.0 p-90 -119.46 -16.5 8.92 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 116.69 2.108 . . . . 0.0 116.69 -171.091 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -80.96 127.13 32.22 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 118.91 0.777 . . . . 0.0 110.759 -175.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.8 m -89.16 130.67 38.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 O-C-N 121.412 -0.805 . . . . 0.0 111.633 -166.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 80.8 mmt-85 -141.28 158.61 43.66 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.215 1.006 . . . . 0.0 112.254 -173.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 8.6 p80 -172.39 137.6 0.87 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.73 2.012 . . . . 0.0 112.118 177.107 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.9 m -70.18 159.3 34.21 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.672 -0.642 . . . . 0.0 111.968 175.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -68.47 -20.23 64.6 Favored 'General case' 0 CA--C 1.547 0.83 0 O-C-N 120.664 -1.272 . . . . 0.0 114.389 -176.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.4 m -78.89 -0.95 32.84 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.415 1.486 . . . . 0.0 113.756 173.21 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 59.9 mmtt -135.41 169.87 16.82 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.619 1.968 . . . . 0.0 112.751 -171.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -131.52 -29.76 1.73 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.435 1.494 . . . . 0.0 113.111 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -77.99 128.2 79.53 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 126.369 1.868 . . . . 0.0 110.071 178.401 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -80.99 159.26 20.86 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 123.188 2.592 . . . . 0.0 114.829 -170.555 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 34.1 p90 -116.63 153.26 32.59 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.816 1.647 . . . . 0.0 109.824 154.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 33.3 m-85 -110.84 112.2 23.89 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.167 0.987 . . . . 0.0 110.192 -172.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -79.84 137.25 36.9 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.071 1.748 . . . . 0.0 112.928 -171.086 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -93.35 109.87 43.07 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 124.479 1.112 . . . . 0.0 110.048 171.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.43 -37.21 10.28 Favored 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 121.771 1.647 . . . . 0.0 112.322 175.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.42 -21.81 62.78 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 116.028 1.862 . . . . 0.0 116.028 -170.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 31.6 m -153.67 146.46 24.33 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.256 1.823 . . . . 0.0 108.613 -173.254 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -70.86 87.08 0.71 Allowed 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.008 0.822 . . . . 0.0 111.844 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -166.23 178.98 5.93 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.839 2.056 . . . . 0.0 109.766 176.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 26.1 p -156.96 149.85 23.7 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.297 1.439 . . . . 0.0 112.552 170.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.7 tpp180 -101.32 135.67 42.43 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.626 2.37 . . . . 0.0 109.664 -176.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -102.03 -30.77 11.0 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 121.114 -0.991 . . . . 0.0 113.513 -167.172 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -148.58 156.7 41.92 Favored Pre-proline 0 CA--C 1.539 0.55 0 C-N-CA 126.938 2.095 . . . . 0.0 108.087 -161.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -67.27 120.72 7.8 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 122.195 1.93 . . . . 0.0 110.69 -173.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -78.19 170.13 19.15 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 122.873 2.382 . . . . 0.0 110.776 173.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -72.65 -27.9 62.4 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.554 -0.716 . . . . 0.0 111.768 164.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -65.23 -0.18 1.64 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 127.716 2.407 . . . . 0.0 114.648 179.14 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -88.53 172.84 9.03 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 126.658 1.983 . . . . 0.0 113.547 -170.246 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -107.09 48.43 0.84 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 127.288 2.235 . . . . 0.0 111.178 -171.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.414 ' HA ' ' HB2' ' A' ' 45' ' ' LEU . 69.1 mtm -29.38 -43.19 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 118.099 2.629 . . . . 0.0 118.099 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -49.29 -47.29 47.03 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 123.062 2.665 . . . . 0.0 111.912 174.174 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 36.6 m -77.66 -22.07 51.18 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 126.028 1.731 . . . . 0.0 111.713 178.26 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.414 ' HB2' ' HA ' ' A' ' 42' ' ' MET . 66.8 mt -82.19 -21.46 36.46 Favored 'General case' 0 CA--C 1.506 -0.741 0 CA-C-O 117.625 -1.179 . . . . 0.0 113.245 171.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.71 -10.13 57.1 Favored 'General case' 0 CA--C 1.554 1.134 0 CA-C-N 121.197 1.817 . . . . 0.0 111.38 176.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.2 mmm -89.33 5.64 44.1 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 127.922 2.489 . . . . 0.0 113.066 167.398 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 49.6 t80 -135.42 -58.35 0.78 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 126.36 1.864 . . . . 0.0 113.031 -172.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 36.0 mtp -72.29 -4.68 31.09 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 127.829 2.452 . . . . 0.0 112.322 172.325 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -154.6 -165.99 2.21 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 129.168 2.987 . . . . 0.0 108.055 166.275 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 29.1 p -132.25 165.31 24.43 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.497 1.119 . . . . 0.0 111.23 170.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -127.58 131.76 49.93 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.363 1.865 . . . . 0.0 110.875 -178.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 . . . . . 0 C--O 1.255 1.353 0 C-N-CA 127.793 2.437 . . . . 0.0 108.812 -173.557 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 26.6 m . . . . . 0 N--CA 1.473 0.704 0 CA-C-O 120.585 0.231 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 98.1 mmm -63.1 142.11 58.51 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 125.013 1.325 . . . . 0.0 112.176 -177.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.0 m -129.04 127.27 65.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 123.866 0.866 . . . . 0.0 110.541 172.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.2 m120 -78.48 132.5 37.28 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.407 0.683 . . . . 0.0 109.503 166.693 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.517 ' HB ' ' H ' ' A' ' 7' ' ' LEU . 71.9 p -132.59 144.21 50.22 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 126.733 2.013 . . . . 0.0 108.588 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -81.22 8.69 57.32 Favored Glycine 0 CA--C 1.536 1.366 0 CA-C-N 115.093 -0.958 . . . . 0.0 113.622 156.593 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.517 ' H ' ' HB ' ' A' ' 5' ' ' THR . 30.4 mt -61.96 155.17 64.76 Favored Pre-proline 0 CA--C 1.542 0.669 0 CA-C-N 119.902 1.851 . . . . 0.0 110.696 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -70.36 179.18 4.21 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 121.098 1.199 . . . . 0.0 112.308 -169.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.88 -39.74 69.01 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.453 1.101 . . . . 0.0 113.049 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -82.15 68.16 3.56 Favored Glycine 0 CA--C 1.526 0.747 0 C-N-CA 125.405 1.479 . . . . 0.0 111.649 174.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -143.25 163.8 31.95 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 171.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 175.73 140.85 0.06 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 131.22 3.808 . . . . 0.0 106.231 164.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 9.1 p -81.54 141.74 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 CA-C-N 120.195 1.361 . . . . 0.0 112.172 -174.019 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -142.74 102.54 4.06 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.704 1.202 . . . . 0.0 111.934 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 76.5 m-70 -72.41 112.45 8.48 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.938 0.895 . . . . 0.0 111.892 175.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 29.2 t -59.63 151.23 25.28 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 -167.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -73.88 -36.95 64.86 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.053 1.341 . . . . 0.0 111.451 165.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.2 t -86.29 -25.13 25.64 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -175.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -133.67 153.45 51.67 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.299 1.039 . . . . 0.0 112.002 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -80.63 52.61 1.7 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 124.424 1.09 . . . . 0.0 111.471 176.474 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -154.16 135.29 8.69 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 125.245 1.418 . . . . 0.0 110.16 -158.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -82.04 131.37 6.88 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 123.33 2.687 . . . . 0.0 112.635 174.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 53.8 p90 -96.36 165.48 12.17 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 122.892 0.477 . . . . 0.0 110.11 151.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -105.19 129.84 53.48 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.321 -0.862 . . . . 0.0 110.65 170.439 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -87.86 139.41 30.55 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.579 1.151 . . . . 0.0 110.44 174.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -99.13 108.0 47.33 Favored Pre-proline 0 CA--C 1.551 1.015 0 O-C-N 121.855 -0.528 . . . . 0.0 109.858 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -73.48 -36.62 3.78 Favored 'Trans proline' 0 C--N 1.354 0.853 0 C-N-CA 122.512 2.141 . . . . 0.0 112.581 174.356 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.26 -26.24 64.67 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -174.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 76.9 m -150.21 132.0 15.04 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 127.904 2.482 . . . . 0.0 106.861 -176.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -65.0 97.89 0.26 Allowed 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.604 1.093 . . . . 0.0 110.633 -177.101 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -171.63 172.65 4.91 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 126.472 1.909 . . . . 0.0 110.542 -167.105 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 36.6 p -140.02 143.96 36.68 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 120.823 -1.173 . . . . 0.0 111.862 166.073 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 20.2 tpp180 -107.33 143.49 35.53 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 126.788 2.035 . . . . 0.0 110.218 -178.354 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -127.3 -6.54 5.91 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.41 1.484 . . . . 0.0 114.528 -166.025 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -165.98 168.92 7.25 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 127.763 2.425 . . . . 0.0 107.941 -173.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -68.01 122.38 9.47 Favored 'Trans proline' 0 CA--C 1.546 1.093 0 C-N-CA 122.07 1.846 . . . . 0.0 111.239 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -82.12 174.77 9.77 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 124.505 3.47 . . . . 0.0 111.465 176.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.37 -44.46 88.87 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 176.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -68.96 -11.48 60.74 Favored 'General case' 0 CA--C 1.553 1.066 0 N-CA-C 115.645 1.72 . . . . 0.0 115.645 -167.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.3 t -75.83 164.29 26.38 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 126.382 1.873 . . . . 0.0 114.872 -164.594 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -115.17 56.57 0.74 Allowed 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.749 2.02 . . . . 0.0 111.174 -163.277 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.405 ' HA ' ' HB2' ' A' ' 45' ' ' LEU . 27.0 mtt -30.86 -40.75 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.87 1.668 . . . . 0.0 114.805 169.32 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -39.65 -54.75 1.99 Allowed 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 126.412 1.885 . . . . 0.0 114.082 166.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 95.6 m -78.79 -31.06 45.85 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.961 2.104 . . . . 0.0 111.409 170.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.405 ' HB2' ' HA ' ' A' ' 42' ' ' MET . 0.3 OUTLIER -80.03 -19.99 46.38 Favored 'General case' 0 C--O 1.224 -0.251 0 O-C-N 121.171 -0.956 . . . . 0.0 112.58 -162.972 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.25 -27.41 67.93 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 120.707 1.594 . . . . 0.0 112.17 175.387 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 95.6 mmm -62.05 -8.03 4.79 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.714 1.205 . . . . 0.0 113.816 167.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -115.85 -59.55 1.98 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.615 1.966 . . . . 0.0 111.547 178.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -7.45 41.81 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.247 1.819 . . . . 0.0 113.99 -178.713 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -138.45 53.58 1.79 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.469 1.508 . . . . 0.0 110.238 167.429 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 7.4 m -55.38 126.98 27.36 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.245 1.418 . . . . 0.0 110.647 -174.426 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -70.12 147.71 49.6 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.6 0.76 . . . . 0.0 112.729 -175.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 54.0 t60 . . . . . 0 C--O 1.25 1.118 0 C-N-CA 125.305 1.442 . . . . 0.0 110.832 -173.07 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 56.9 p . . . . . 0 N--CA 1.476 0.853 0 CA-C-O 118.682 -0.675 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.5 pmm? -168.67 162.68 11.91 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 120.048 1.295 . . . . 0.0 113.178 -167.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 3.4 t -117.21 140.94 37.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 125.651 1.58 . . . . 0.0 108.557 168.197 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -70.32 128.72 37.19 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 122.09 -0.382 . . . . 0.0 111.188 175.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 24.5 p -133.03 132.49 41.9 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 127.206 2.202 . . . . 0.0 107.843 -176.207 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.537 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -68.86 34.12 0.29 Allowed Glycine 0 CA--C 1.532 1.142 0 CA-C-O 118.435 -1.203 . . . . 0.0 115.651 155.363 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.7 mt -83.77 165.04 41.84 Favored Pre-proline 0 CA--C 1.548 0.872 0 CA-C-N 119.633 1.716 . . . . 0.0 109.61 177.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -77.95 -147.15 0.03 OUTLIER 'Trans proline' 0 CA--C 1.545 1.036 0 C-N-CA 121.608 1.539 . . . . 0.0 109.128 174.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.28 -21.04 64.82 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.212 -1.555 . . . . 0.0 112.91 173.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -80.94 68.79 3.36 Favored Glycine 0 CA--C 1.527 0.805 0 C-N-CA 126.025 1.774 . . . . 0.0 111.545 170.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 12.1 p-90 -120.37 -12.43 8.99 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 116.588 2.07 . . . . 0.0 116.588 -173.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -70.3 114.91 8.9 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 120.077 1.308 . . . . 0.0 110.448 -179.122 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 6.0 t -72.16 134.17 30.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 CA-C-N 119.168 0.895 . . . . 0.0 109.826 178.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.2 mmt85 -131.9 128.98 39.71 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 125.087 1.355 . . . . 0.0 111.331 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 38.0 p-80 -62.8 137.57 58.3 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 121.771 -0.58 . . . . 0.0 110.476 159.259 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.8 t -97.69 150.93 20.64 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.037 -1.04 . . . . 0.0 112.391 -174.128 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -69.03 -41.41 77.72 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.388 -0.82 . . . . 0.0 110.156 162.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 85.1 p -106.91 -3.73 19.9 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 115.691 1.738 . . . . 0.0 115.691 -158.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.5 ttmm -138.43 146.34 42.03 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.484 1.038 . . . . 0.0 113.564 -169.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -88.1 46.67 1.41 Allowed 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.74 1.616 . . . . 0.0 111.946 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 16.6 tp -170.63 151.9 3.67 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 128.258 2.623 . . . . 0.0 107.322 -171.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -71.18 166.37 29.42 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 121.607 1.538 . . . . 0.0 110.645 169.039 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 17.2 p90 -127.86 160.93 30.27 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.725 1.21 . . . . 0.0 109.949 164.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -103.98 139.44 39.11 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.6 -0.688 . . . . 0.0 110.537 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -118.04 142.19 47.66 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.658 1.583 . . . . 0.0 111.581 -172.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 65.0 t-20 -98.15 109.41 51.84 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 124.576 1.15 . . . . 0.0 110.362 171.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -75.79 -26.22 9.92 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 123.087 2.525 . . . . 0.0 113.243 177.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.83 -29.4 40.17 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 118.948 0.795 . . . . 0.0 112.771 -175.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.9 m -143.27 88.99 2.06 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.144 1.378 . . . . 0.0 108.707 174.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -32.7 103.1 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 128.557 2.743 . . . . 0.0 114.005 -173.542 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -173.19 165.13 4.87 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.299 1.84 . . . . 0.0 109.821 -170.559 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 57.1 p -120.38 173.4 7.17 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.482 1.513 . . . . 0.0 113.352 175.659 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.05 141.28 17.48 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.837 2.055 . . . . 0.0 109.254 -178.268 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -134.5 -25.92 1.46 Allowed 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -151.772 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -142.91 152.75 59.64 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 127.976 2.51 . . . . 0.0 107.556 172.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -51.04 113.0 0.91 Allowed 'Trans proline' 0 CA--C 1.544 1.012 0 C-N-CA 124.19 3.26 . . . . 0.0 112.923 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -79.15 169.39 19.17 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 123.34 2.693 . . . . 0.0 111.924 -176.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.94 -38.02 81.2 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -78.44 0.13 27.04 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 127.463 2.305 . . . . 0.0 114.5 -175.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.78 174.7 10.19 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 126.008 1.723 . . . . 0.0 111.063 178.214 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -103.6 -35.6 8.23 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 120.949 -1.095 . . . . 0.0 112.402 -166.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.521 ' HA ' ' HB3' ' A' ' 45' ' ' LEU 0.263 33.7 mtt 60.99 -40.05 0.11 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 128.542 2.737 . . . . 0.0 115.741 -176.9 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -62.23 -51.99 65.53 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 122.343 2.338 . . . . 0.0 111.783 177.288 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.0 m -66.53 -11.16 51.34 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 125.91 1.684 . . . . 0.0 112.175 169.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.537 HD13 ' N ' ' A' ' 6' ' ' GLY . 8.6 tp -105.06 -23.76 12.89 Favored 'General case' 0 N--CA 1.447 -0.602 0 O-C-N 120.942 -1.099 . . . . 0.0 111.225 -170.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.24 -37.7 88.26 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 120.957 1.708 . . . . 0.0 110.213 169.534 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 25.1 ptp -69.87 18.31 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 126.101 1.761 . . . . 0.0 114.573 166.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -138.28 -32.38 0.72 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.691 1.997 . . . . 0.0 112.297 171.544 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 93.4 mmm -95.12 -8.95 34.99 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 127.287 2.235 . . . . 0.0 115.095 -179.331 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -141.23 165.6 27.07 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 120.327 1.421 . . . . 0.0 113.179 -176.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 10.9 t -147.39 145.31 29.21 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 125.118 1.367 . . . . 0.0 113.288 -170.116 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 24.0 t80 -85.82 161.27 19.19 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.213 1.005 . . . . 0.0 112.729 172.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 27.8 p-80 . . . . . 0 C--O 1.252 1.213 0 C-N-CA 126.812 2.045 . . . . 0.0 113.246 -173.138 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.478 0.949 0 CA-C-O 119.788 -0.149 . . . . 0.0 110.888 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 24.1 ptt? -59.28 166.07 2.39 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 126.723 2.009 . . . . 0.0 115.13 -178.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.8 m -138.5 145.61 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 125.609 1.564 . . . . 0.0 111.459 175.312 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -83.39 140.65 32.27 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.201 0.6 . . . . 0.0 110.345 167.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.576 ' HB ' ' H ' ' A' ' 7' ' ' LEU . 63.1 p -139.98 141.76 36.36 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 122.727 1.251 . . . . 0.0 109.714 170.787 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.662 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -73.76 4.14 31.17 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-N 113.785 -1.552 . . . . 0.0 116.074 152.083 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.576 ' H ' ' HB ' ' A' ' 5' ' ' THR . 15.1 mt -71.02 153.9 94.43 Favored Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 120.708 2.254 . . . . 0.0 109.074 -173.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -77.3 -152.23 0.04 OUTLIER 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 122.253 1.969 . . . . 0.0 109.989 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.09 -30.98 71.38 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 120.871 -1.143 . . . . 0.0 113.198 -178.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -91.74 74.26 1.54 Allowed Glycine 0 C--N 1.339 0.737 0 C-N-CA 126.799 2.142 . . . . 0.0 112.271 174.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 55.1 p-90 -109.71 -19.56 13.13 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 117.237 2.31 . . . . 0.0 117.237 -174.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -87.04 116.62 25.21 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 119.821 1.192 . . . . 0.0 111.198 -167.381 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.8 p -67.41 131.36 32.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 119.449 1.022 . . . . 0.0 112.306 -177.244 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.3 mmt180 -139.36 162.01 36.06 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.109 1.763 . . . . 0.0 111.469 -173.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -142.78 165.01 28.56 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.118 1.367 . . . . 0.0 111.74 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.4 m -136.08 173.9 11.21 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.27 1.428 . . . . 0.0 112.877 -169.349 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 10.4 p-10 -81.92 -11.51 58.86 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 115.581 1.697 . . . . 0.0 115.581 -171.191 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.3 t -127.27 -31.84 2.52 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -178.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.5 tttp -60.14 155.16 17.86 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.513 1.525 . . . . 0.0 112.208 170.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -106.63 -28.2 10.37 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.126 0.97 . . . . 0.0 113.502 175.177 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 8.5 mp -95.64 160.49 30.25 Favored Pre-proline 0 N--CA 1.476 0.843 0 C-N-CA 125.604 1.562 . . . . 0.0 111.972 175.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -79.11 174.26 12.34 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 123.324 2.683 . . . . 0.0 112.272 168.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 39.7 p90 -147.75 152.22 37.37 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.72 2.408 . . . . 0.0 109.876 172.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 -87.06 141.51 28.61 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.129 -0.982 . . . . 0.0 110.689 173.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -124.16 146.15 48.85 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.78 1.632 . . . . 0.0 111.52 -170.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 57.4 t-20 -97.94 113.73 64.14 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 124.066 0.947 . . . . 0.0 111.401 177.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -70.41 -30.37 19.36 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 123.159 2.573 . . . . 0.0 113.552 178.067 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.28 -51.25 10.42 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.231 0.923 . . . . 0.0 112.036 -176.302 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 23.2 m -117.55 125.63 51.15 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.584 1.554 . . . . 0.0 107.917 177.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 46.4 mtm105 -62.89 107.56 1.01 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.956 1.253 . . . . 0.0 109.873 177.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -174.06 162.77 3.86 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 129.304 3.042 . . . . 0.0 109.127 -173.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 30.9 p -128.51 175.66 8.36 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.781 1.233 . . . . 0.0 114.234 -179.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.55 145.24 25.0 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 127.298 2.239 . . . . 0.0 109.06 174.057 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 2.0 m-90 -111.7 -23.26 10.74 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 121.295 -0.878 . . . . 0.0 113.162 -155.188 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -157.77 167.41 14.55 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 131.545 3.938 . . . . 0.0 106.373 -175.278 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -62.12 120.09 7.51 Favored 'Trans proline' 0 CA--C 1.551 1.328 0 CA-C-N 121.954 1.734 . . . . 0.0 110.201 172.081 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -85.37 -167.99 0.46 Allowed 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 124.391 3.394 . . . . 0.0 112.486 -171.301 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -75.06 -47.0 31.03 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 121.282 -0.886 . . . . 0.0 113.35 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -63.65 -13.08 39.3 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.03 1.332 . . . . 0.0 114.315 -175.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -71.0 164.94 24.52 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 127.872 2.469 . . . . 0.0 112.646 -171.114 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -110.05 24.87 12.45 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.267 -0.895 . . . . 0.0 112.482 -154.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.606 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 51.6 mtt -5.35 -45.39 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.508 1 C-N-CA 132.103 4.161 . . . . 0.0 120.059 -176.122 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -55.65 -42.66 75.34 Favored 'General case' 0 CA--C 1.55 0.96 0 CA-C-N 122.657 2.48 . . . . 0.0 112.564 170.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.3 m -73.33 -7.9 53.58 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 127.876 2.47 . . . . 0.0 113.25 172.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.662 HD13 ' N ' ' A' ' 6' ' ' GLY . 11.4 tp -121.71 -24.16 5.36 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 120.994 -1.066 . . . . 0.0 111.734 -163.471 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -57.81 -42.95 85.33 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 120.163 1.347 . . . . 0.0 110.091 163.801 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 21.7 ptp -61.83 -9.48 6.8 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.518 1.527 . . . . 0.0 114.521 172.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.0 t80 -109.65 -44.03 3.94 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.456 1.503 . . . . 0.0 112.885 176.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 12.2 mmt -78.22 -36.42 47.17 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.369 1.868 . . . . 0.0 113.328 -175.253 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -95.4 161.8 13.93 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.458 1.103 . . . . 0.0 112.557 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 38.0 p -89.89 -14.12 34.94 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 115.482 1.66 . . . . 0.0 115.482 -174.353 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -88.26 156.06 19.4 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 120.054 1.297 . . . . 0.0 113.558 -178.537 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 15.2 p-80 . . . . . 0 C--O 1.253 1.281 0 C-N-CA 125.343 1.457 . . . . 0.0 113.11 -178.473 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 18.1 m . . . . . 0 N--CA 1.474 0.732 0 N-CA-C 111.706 0.261 . . . . 0.0 111.706 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 96.3 mmm -82.05 117.86 22.57 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 162.204 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.8 m -159.44 138.19 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 125.988 1.715 . . . . 0.0 110.07 -172.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 56.0 m-80 -72.17 135.82 46.27 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.658 0.742 . . . . 0.0 111.887 173.275 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 77.1 p -124.02 148.41 47.04 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 126.751 2.02 . . . . 0.0 107.349 174.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.637 ' H ' HD13 ' A' ' 45' ' ' LEU . . . -76.62 2.47 58.54 Favored Glycine 0 CA--C 1.532 1.15 0 CA-C-O 118.681 -1.066 . . . . 0.0 114.545 157.257 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.434 ' HG ' HD11 ' A' ' 45' ' ' LEU . 14.7 mt -61.31 153.71 66.86 Favored Pre-proline 0 CA--C 1.541 0.611 0 CA-C-N 119.383 1.592 . . . . 0.0 110.012 -171.722 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -71.42 162.25 42.93 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 CA-C-N 120.009 1.039 . . . . 0.0 109.632 -176.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.77 -25.82 8.36 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 115.555 1.687 . . . . 0.0 115.555 -169.435 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -82.38 72.27 2.84 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 124.181 0.896 . . . . 0.0 111.119 166.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 2.1 p-90 -142.3 153.09 43.6 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.603 1.161 . . . . 0.0 114.113 169.188 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 174.72 124.96 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 130.589 3.556 . . . . 0.0 105.254 176.091 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 35.4 t -73.99 129.65 36.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 CA-C-N 121.329 1.877 . . . . 0.0 110.586 -174.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.0 mmt-85 -114.09 132.94 55.86 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 126.029 1.732 . . . . 0.0 111.349 171.262 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -102.85 25.45 9.27 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.564 1.546 . . . . 0.0 112.201 170.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.1 m -77.98 54.24 1.28 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.21 1.804 . . . . 0.0 114.151 -171.521 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -155.59 138.0 14.91 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 126.468 1.907 . . . . 0.0 108.452 -177.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 17.6 t -62.45 -32.88 73.82 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 125.715 1.606 . . . . 0.0 111.706 170.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -70.73 143.12 51.38 Favored 'General case' 0 CA--C 1.547 0.865 0 O-C-N 121.049 -1.032 . . . . 0.0 110.828 167.468 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -82.17 32.78 0.39 Allowed 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.366 1.466 . . . . 0.0 114.475 -165.161 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -107.6 157.88 34.71 Favored Pre-proline 0 N--CA 1.474 0.741 0 C-N-CA 125.821 1.648 . . . . 0.0 110.869 175.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -86.92 172.18 6.53 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 123.622 2.882 . . . . 0.0 110.329 164.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 49.0 p90 -142.21 165.54 27.15 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.027 1.331 . . . . 0.0 109.214 151.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -98.8 125.08 44.07 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 120.782 -1.199 . . . . 0.0 110.475 176.303 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -74.11 149.23 41.16 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 120.64 -1.288 . . . . 0.0 110.709 168.02 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -99.02 96.91 4.48 Favored Pre-proline 0 CA--C 1.545 0.765 0 C-N-CA 122.996 0.518 . . . . 0.0 110.365 173.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -66.49 -29.45 44.77 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.453 2.102 . . . . 0.0 112.519 171.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.54 -19.11 62.92 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 -174.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.5 m -174.27 130.31 0.37 Allowed 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 129.042 2.937 . . . . 0.0 106.476 177.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 55.5 mtt85 -61.33 108.55 0.95 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.946 0.898 . . . . 0.0 111.011 -170.042 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -170.98 -180.0 2.93 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 130.552 3.541 . . . . 0.0 106.752 -170.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 14.8 m -149.97 130.25 13.71 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 119.463 -2.023 . . . . 0.0 111.963 165.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 12.8 tpp180 -86.91 121.72 29.77 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 127.583 2.353 . . . . 0.0 110.557 -178.074 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -76.16 -32.99 59.35 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 127.105 2.162 . . . . 0.0 114.209 -168.339 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -166.21 168.9 7.09 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 127.304 2.241 . . . . 0.0 108.565 -172.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -55.66 124.75 17.06 Favored 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 122.69 2.26 . . . . 0.0 112.551 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -85.29 -168.86 0.54 Allowed 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 124.761 3.641 . . . . 0.0 111.644 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.0 -42.75 31.66 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.061 0.945 . . . . 0.0 113.461 177.203 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -78.87 5.64 11.0 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 -172.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.5 t -74.41 152.02 39.57 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.188 1.795 . . . . 0.0 112.241 177.224 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -105.14 48.3 0.84 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.384 1.074 . . . . 0.0 112.905 -155.438 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.427 ' O ' ' HE3' ' A' ' 46' ' ' LYS . 65.2 mtm -22.07 -47.2 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 118.792 2.886 . . . . 0.0 118.792 -169.243 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -51.65 -42.61 62.2 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 123.335 2.788 . . . . 0.0 113.328 175.051 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 55.9 m -75.07 -23.08 57.97 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.098 1.359 . . . . 0.0 112.023 173.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.637 HD13 ' H ' ' A' ' 6' ' ' GLY . 3.2 mm? -79.87 -19.84 47.33 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 116.781 -1.58 . . . . 0.0 113.139 171.128 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.427 ' HE3' ' O ' ' A' ' 42' ' ' MET . 8.0 mmpt? -69.01 -23.37 64.08 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 122.289 2.313 . . . . 0.0 111.751 -172.836 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.2 ptm -70.21 -17.89 63.16 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.485 1.514 . . . . 0.0 113.998 168.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.508 ' CD2' HD12 ' A' ' 45' ' ' LEU . 47.1 t80 -107.2 -61.75 1.51 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.967 2.507 . . . . 0.0 112.157 -171.633 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 27.9 mtp -66.74 -7.73 23.16 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.967 2.107 . . . . 0.0 114.489 -178.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -151.69 152.56 32.95 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.371 1.468 . . . . 0.0 109.997 163.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 6.4 t -139.12 -22.14 0.93 Allowed 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 118.022 -0.989 . . . . 0.0 112.929 170.438 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 34.5 t80 -55.51 144.02 27.49 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.384 1.474 . . . . 0.0 111.908 171.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.9 p80 . . . . . 0 C--O 1.251 1.174 0 CA-C-O 116.669 -1.634 . . . . 0.0 114.025 -167.604 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.2 m . . . . . 0 N--CA 1.473 0.722 0 CA-C-O 119.363 -0.351 . . . . 0.0 110.693 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 34.3 tpp -112.69 125.37 54.23 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.393 1.077 . . . . 0.0 111.294 174.03 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.5 m -71.95 140.1 18.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 175.468 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -95.49 142.79 27.43 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 125.029 1.332 . . . . 0.0 109.514 159.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.577 ' HB ' ' H ' ' A' ' 7' ' ' LEU . 76.2 p -133.93 144.14 48.65 Favored 'General case' 0 CA--C 1.514 -0.416 0 C-N-CA 126.085 1.754 . . . . 0.0 108.814 174.84 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.41 ' H ' HD23 ' A' ' 45' ' ' LEU . . . -78.44 3.11 64.15 Favored Glycine 0 CA--C 1.534 1.249 0 CA-C-O 119.015 -0.88 . . . . 0.0 113.141 155.143 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.577 ' H ' ' HB ' ' A' ' 5' ' ' THR . 37.6 mt -61.91 153.78 71.13 Favored Pre-proline 0 CA--C 1.545 0.775 0 CA-C-N 119.881 1.841 . . . . 0.0 110.594 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -80.52 -149.5 0.04 OUTLIER 'Trans proline' 0 CA--C 1.544 1.0 0 C-N-CA 122.695 2.263 . . . . 0.0 110.419 -176.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.24 4.65 0.2 Allowed 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 115.825 1.787 . . . . 0.0 115.825 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -127.92 97.34 0.45 Allowed Glycine 0 C--N 1.338 0.648 0 C-N-CA 127.115 2.293 . . . . 0.0 109.501 171.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 61.8 p-90 -139.47 -23.84 0.87 Allowed 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 116.445 2.017 . . . . 0.0 116.445 -165.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -83.14 105.22 13.94 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 119.131 0.878 . . . . 0.0 109.366 -169.046 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 6.1 p -70.49 128.18 33.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 CA-C-N 119.219 0.918 . . . . 0.0 112.732 -169.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -128.46 165.09 21.34 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.767 2.027 . . . . 0.0 110.895 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 3.1 p80 -168.02 -179.52 4.17 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 126.121 1.769 . . . . 0.0 112.06 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.2 m -145.95 166.42 26.07 Favored 'General case' 0 N--CA 1.476 0.868 0 O-C-N 120.48 -1.387 . . . . 0.0 112.499 177.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -60.13 -44.22 95.07 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.844 1.257 . . . . 0.0 113.812 -174.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.5 m -87.16 -5.82 58.86 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.527 1.131 . . . . 0.0 112.751 174.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -133.8 67.75 1.51 Allowed 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.566 1.546 . . . . 0.0 110.642 -174.567 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -65.37 -24.81 67.34 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.407 1.483 . . . . 0.0 113.892 -174.063 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -74.14 119.41 76.19 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 123.819 0.847 . . . . 0.0 108.866 178.485 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -76.99 166.32 26.96 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 123.145 2.564 . . . . 0.0 113.98 -165.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 44.1 p90 -137.48 146.08 43.82 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 126.154 1.782 . . . . 0.0 110.959 171.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -93.65 118.46 31.41 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.157 -0.964 . . . . 0.0 110.578 178.552 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -81.33 138.67 35.65 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.719 1.208 . . . . 0.0 112.055 -175.519 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -92.69 117.83 67.73 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 124.424 1.089 . . . . 0.0 109.101 172.286 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -69.87 -46.1 1.3 Allowed 'Trans proline' 0 C--N 1.35 0.623 0 C-N-CA 121.907 1.738 . . . . 0.0 112.664 179.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -90.73 9.48 29.79 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 115.254 1.576 . . . . 0.0 115.254 -170.271 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 92.6 m -151.85 140.89 21.19 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.906 1.683 . . . . 0.0 109.715 -176.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 64.7 mtp85 -70.95 95.71 1.21 Allowed 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.593 0.757 . . . . 0.0 108.994 168.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -174.66 157.42 2.53 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.608 1.963 . . . . 0.0 110.452 -169.525 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.3 p -139.84 133.19 29.97 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 123.804 0.842 . . . . 0.0 110.394 159.286 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 4.3 tpp180 -81.87 117.31 22.04 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 122.231 1.015 . . . . 0.0 109.767 174.336 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -88.25 -22.25 24.05 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.573 1.549 . . . . 0.0 113.975 -170.561 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -160.55 156.28 22.13 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 127.608 2.363 . . . . 0.0 108.537 -164.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.32 119.46 6.46 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.058 2.505 . . . . 0.0 112.141 -170.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_endo -84.07 -168.04 0.51 Allowed 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 124.628 3.552 . . . . 0.0 111.92 -177.34 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -88.21 -31.43 19.08 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.062 1.345 . . . . 0.0 112.896 171.367 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -69.83 -3.13 14.32 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 125.302 1.441 . . . . 0.0 113.492 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.1 t -80.92 159.4 24.97 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.743 2.017 . . . . 0.0 112.112 176.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -123.68 59.7 1.11 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 127.151 2.18 . . . . 0.0 111.333 -162.249 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.2 mpp? -32.92 -38.15 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 116.922 2.193 . . . . 0.0 116.922 173.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.09 -40.5 67.29 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 121.269 1.85 . . . . 0.0 113.002 171.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 55.2 m -80.46 -26.31 38.39 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.918 1.687 . . . . 0.0 111.712 168.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.41 HD23 ' H ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -94.1 -24.57 17.52 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 -161.558 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.75 -13.79 62.46 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 121.744 2.066 . . . . 0.0 112.101 172.361 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 23.7 mmt -71.15 -12.17 61.34 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.171 0.988 . . . . 0.0 113.518 164.018 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -113.1 -50.82 2.86 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.213 1.805 . . . . 0.0 112.118 -179.574 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 82.8 mmm -77.09 -4.28 43.57 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.696 1.998 . . . . 0.0 114.174 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -148.28 172.66 14.01 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.325 1.85 . . . . 0.0 109.856 170.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 3.9 t -137.07 158.63 44.01 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.935 1.294 . . . . 0.0 110.198 177.478 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -97.26 131.1 44.3 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.568 1.147 . . . . 0.0 111.981 177.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 14.5 t-80 . . . . . 0 C--O 1.254 1.295 0 C-N-CA 125.737 1.615 . . . . 0.0 113.681 -179.605 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.5 m . . . . . 0 N--CA 1.478 0.949 0 N-CA-C 111.525 0.194 . . . . 0.0 111.525 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -102.29 174.01 6.11 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.628 1.571 . . . . 0.0 111.296 177.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 14.9 m -132.21 137.85 53.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 125.117 1.367 . . . . 0.0 111.759 173.684 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -98.55 122.08 41.3 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.435 1.094 . . . . 0.0 109.525 168.734 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 32.6 p -117.02 124.15 48.61 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.343 1.457 . . . . 0.0 108.701 -175.415 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.464 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -69.78 41.45 0.43 Allowed Glycine 0 CA--C 1.532 1.128 0 CA-C-O 118.768 -1.018 . . . . 0.0 115.381 158.596 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.1 mt -85.67 168.18 21.07 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 125.858 1.663 . . . . 0.0 110.432 179.408 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -75.26 -157.29 0.06 OUTLIER 'Trans proline' 0 CA--C 1.548 1.196 0 C-N-CA 122.576 2.184 . . . . 0.0 111.197 176.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.02 -33.98 74.12 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.541 -1.35 . . . . 0.0 112.645 173.334 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -80.24 62.25 4.29 Favored Glycine 0 CA--C 1.526 0.772 0 C-N-CA 125.522 1.534 . . . . 0.0 112.398 171.75 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 36.0 p-90 -108.14 -17.65 13.97 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 115.445 1.646 . . . . 0.0 115.445 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -72.45 103.22 3.41 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 119.282 0.946 . . . . 0.0 110.113 -167.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.3 p -67.86 120.85 15.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-N 118.589 0.632 . . . . 0.0 110.708 -174.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -107.12 139.12 42.03 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.852 1.261 . . . . 0.0 108.812 166.229 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 3.6 p80 -157.19 -178.95 7.74 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.53 1.132 . . . . 0.0 111.523 -169.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.6 m -135.49 174.18 10.89 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.318 1.447 . . . . 0.0 111.608 177.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -112.21 -27.62 8.27 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.729 1.211 . . . . 0.0 111.747 166.058 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.8 m -82.2 -6.16 59.01 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.534 1.134 . . . . 0.0 113.538 171.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -133.75 165.26 25.37 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 128.231 2.613 . . . . 0.0 108.794 163.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 49.3 t-20 -136.94 65.79 1.49 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.142 0.977 . . . . 0.0 111.947 -179.17 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -156.17 123.99 2.82 Favored Pre-proline 0 CA--C 1.549 0.906 0 C-N-CA 125.015 1.326 . . . . 0.0 109.43 173.773 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -88.6 168.21 5.98 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.73 2.953 . . . . 0.0 112.634 -173.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 44.4 p90 -139.19 132.71 30.32 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.887 0.875 . . . . 0.0 110.759 156.639 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -86.73 116.51 24.87 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.943 0.897 . . . . 0.0 109.242 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -101.19 142.62 32.35 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.567 1.147 . . . . 0.0 112.61 -165.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 58.5 t-20 -98.53 114.78 65.68 Favored Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 124.975 1.31 . . . . 0.0 109.3 166.644 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -81.34 -23.13 5.31 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 123.371 2.714 . . . . 0.0 114.298 178.077 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.85 -33.11 46.16 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.384 0.993 . . . . 0.0 112.115 -176.124 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 70.9 m -134.56 110.74 9.54 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 126.201 1.8 . . . . 0.0 106.36 170.005 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.3 mtt85 -57.24 106.9 0.37 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.615 0.766 . . . . 0.0 111.025 -172.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -166.6 153.65 9.24 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.208 1.803 . . . . 0.0 109.896 -168.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 97.4 p -124.11 163.64 21.08 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 114.439 1.274 . . . . 0.0 114.439 178.038 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.37 152.05 48.07 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 128.632 2.773 . . . . 0.0 108.483 176.382 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -125.3 -26.88 3.56 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -153.256 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 -154.15 170.49 8.36 Favored Pre-proline 0 CA--C 1.552 1.033 0 C-N-CA 130.181 3.392 . . . . 0.0 106.316 177.286 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -54.11 122.05 10.74 Favored 'Trans proline' 0 CA--C 1.546 1.118 0 C-N-CA 122.803 2.335 . . . . 0.0 112.129 172.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -90.29 -162.1 0.11 Allowed 'Trans proline' 0 CA--C 1.546 1.082 0 C-N-CA 124.215 3.276 . . . . 0.0 110.658 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -102.1 -27.06 13.13 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -178.158 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -80.87 10.1 5.49 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 125.637 1.575 . . . . 0.0 113.19 177.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -77.08 -177.94 4.75 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 129.687 3.195 . . . . 0.0 112.924 -177.605 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -90.42 -54.27 4.08 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-O 122.975 1.369 . . . . 0.0 109.548 -175.756 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.464 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 8.7 ttp 86.6 -43.0 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 129.711 3.204 . . . . 0.0 114.078 170.504 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -64.8 -48.37 74.7 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 121.494 1.952 . . . . 0.0 111.904 178.139 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 16.0 m -60.72 -21.58 63.09 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 125.656 1.582 . . . . 0.0 111.463 167.411 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.464 ' HB3' ' HA ' ' A' ' 42' ' ' MET . 11.1 tp -93.69 -21.66 19.21 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 118.014 -0.993 . . . . 0.0 111.197 -170.576 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.488 ' HE2' ' HA ' ' A' ' 46' ' ' LYS . 7.9 mmpt? -60.97 -40.62 94.09 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 120.889 1.677 . . . . 0.0 111.229 171.939 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.7 ptt? -67.88 6.95 0.59 Allowed 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 172.242 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -124.11 -44.4 2.04 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.106 1.762 . . . . 0.0 112.572 172.019 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 92.4 mtp -66.25 -24.67 66.63 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.819 2.048 . . . . 0.0 112.496 177.145 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -128.61 158.44 38.48 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.588 1.555 . . . . 0.0 111.772 172.75 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 87.1 m -82.17 137.69 34.88 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.167 1.387 . . . . 0.0 108.625 168.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 92.5 t80 -118.36 121.9 41.5 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.036 1.334 . . . . 0.0 110.952 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.6 p80 . . . . . 0 C--O 1.249 1.04 0 C-N-CA 125.328 1.451 . . . . 0.0 113.365 -173.052 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 77.6 p . . . . . 0 N--CA 1.476 0.841 0 CA-C-O 119.798 -0.144 . . . . 0.0 111.322 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 22.5 ptt? -151.75 20.74 0.7 Allowed 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 116.491 2.034 . . . . 0.0 116.491 -162.212 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.0 m -82.42 151.88 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.315 0 CA-C-N 120.238 1.381 . . . . 0.0 110.87 168.241 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -84.1 122.59 29.02 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 122.07 -0.393 . . . . 0.0 110.351 172.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.476 ' HB ' ' H ' ' A' ' 7' ' ' LEU . 73.7 p -126.5 146.68 50.02 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.268 1.427 . . . . 0.0 108.396 168.024 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.522 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -80.94 16.32 16.22 Favored Glycine 0 CA--C 1.532 1.148 0 N-CA-C 115.537 0.975 . . . . 0.0 115.537 150.433 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.476 ' H ' ' HB ' ' A' ' 5' ' ' THR . 13.4 mt -68.82 157.41 88.86 Favored Pre-proline 0 CA--C 1.548 0.894 0 CA-C-N 119.995 1.898 . . . . 0.0 110.292 -176.037 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -73.98 -170.48 0.71 Allowed 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 122.927 2.418 . . . . 0.0 109.494 177.182 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.43 -23.15 9.16 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -175.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -88.45 77.47 1.82 Allowed Glycine 0 CA--C 1.527 0.833 0 C-N-CA 126.173 1.844 . . . . 0.0 111.864 165.189 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 1.7 p90 -110.83 -8.69 14.51 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 -177.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -89.18 110.25 21.02 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 120.228 1.376 . . . . 0.0 111.338 -172.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.6 p -61.15 136.72 24.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 O-C-N 121.101 -1.0 . . . . 0.0 112.658 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -133.28 112.97 12.1 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.892 1.677 . . . . 0.0 109.848 174.747 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 31.1 p80 -103.77 155.2 18.78 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.415 1.086 . . . . 0.0 112.122 173.192 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 99.4 p -161.35 158.2 26.57 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 125.126 1.371 . . . . 0.0 110.707 -172.691 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.9 p30 -75.27 -18.91 59.96 Favored 'General case' 0 CA--C 1.548 0.878 0 O-C-N 120.416 -1.428 . . . . 0.0 113.538 177.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.7 m -75.86 -30.05 58.76 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.456 1.502 . . . . 0.0 112.811 -175.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -109.08 146.11 34.54 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.262 1.425 . . . . 0.0 111.239 -176.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -88.69 12.29 15.22 Favored 'General case' 0 CA--C 1.555 1.15 0 N-CA-C 114.313 1.227 . . . . 0.0 114.313 -178.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -166.33 159.26 12.16 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 127.335 2.254 . . . . 0.0 109.338 172.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -75.16 169.45 22.53 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.964 2.443 . . . . 0.0 111.576 -178.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 52.9 p90 -126.49 148.05 49.74 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.404 1.082 . . . . 0.0 111.125 168.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -103.73 107.25 18.03 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.582 0.753 . . . . 0.0 109.836 -175.341 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -95.3 149.75 21.0 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.929 1.692 . . . . 0.0 112.959 -165.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 61.0 t-20 -99.34 113.73 65.04 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 125.135 1.374 . . . . 0.0 110.018 171.8 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.2 -29.67 14.06 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.871 2.381 . . . . 0.0 113.533 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -80.91 -38.24 28.25 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -171.202 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 92.2 m -127.85 138.92 52.87 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.264 1.826 . . . . 0.0 107.898 169.329 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 84.8 mtm-85 -61.67 104.43 0.43 Allowed 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.127 0.876 . . . . 0.0 111.071 178.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -163.62 153.56 15.16 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.915 1.286 . . . . 0.0 111.983 178.537 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 31.4 t -133.69 152.75 51.96 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.369 1.467 . . . . 0.0 111.093 176.65 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.7 tpp180 -128.0 136.82 51.81 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.612 1.565 . . . . 0.0 110.486 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -126.11 0.88 7.19 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.587 1.555 . . . . 0.0 113.324 -157.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -169.17 156.28 6.69 Favored Pre-proline 0 CA--C 1.544 0.714 0 C-N-CA 128.772 2.829 . . . . 0.0 107.69 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -62.09 113.37 1.85 Allowed 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.282 2.655 . . . . 0.0 110.483 175.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -85.56 159.28 10.8 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.773 2.315 . . . . 0.0 112.253 -171.348 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.48 -22.02 41.2 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 178.222 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -81.36 -15.32 55.63 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 126.279 1.832 . . . . 0.0 113.797 -179.413 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.62 179.01 4.97 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.597 1.559 . . . . 0.0 112.989 -170.283 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -130.12 51.33 2.11 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 122.105 0.955 . . . . 0.0 111.363 -160.282 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.503 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 32.6 mtt -27.3 -42.28 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 128.195 2.598 . . . . 0.0 116.113 169.62 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -48.24 -42.44 30.39 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 121.316 1.871 . . . . 0.0 113.751 173.195 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.3 m -82.87 -26.25 31.76 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 127.216 2.207 . . . . 0.0 112.399 173.402 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.522 HD13 ' N ' ' A' ' 6' ' ' GLY . 43.9 tp -109.9 -16.51 13.84 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 124.423 1.089 . . . . 0.0 112.244 -151.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.33 -34.17 66.32 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.673 -1.267 . . . . 0.0 111.336 159.324 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.7 mmt -60.9 -22.31 64.21 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.614 0.766 . . . . 0.0 112.751 173.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -103.51 -36.05 8.1 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.306 1.842 . . . . 0.0 112.801 -177.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 29.2 mtp -95.34 -1.37 51.38 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.046 1.738 . . . . 0.0 114.824 -178.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -151.11 67.24 0.91 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.188 1.795 . . . . 0.0 111.686 170.511 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 2.1 t -78.57 -10.68 59.82 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 115.139 1.533 . . . . 0.0 115.139 -172.095 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -65.47 137.1 57.22 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-N 119.699 1.136 . . . . 0.0 113.027 175.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 . . . . . 0 C--O 1.249 1.069 0 C-N-CA 125.058 1.343 . . . . 0.0 113.811 -176.286 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 43.3 m . . . . . 0 N--CA 1.473 0.709 0 N-CA-C 110.533 -0.173 . . . . 0.0 110.533 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -68.9 139.31 55.13 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.747 0.819 . . . . 0.0 111.196 179.055 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 3.4 m -150.55 127.82 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 124.833 1.253 . . . . 0.0 110.606 -176.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 -69.61 123.46 21.39 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 121.777 -0.577 . . . . 0.0 110.386 175.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 73.9 p -127.99 149.69 50.24 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.666 1.586 . . . . 0.0 108.304 173.035 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -77.57 6.04 48.25 Favored Glycine 0 CA--C 1.529 0.938 0 CA-C-O 118.223 -1.321 . . . . 0.0 115.125 155.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 27.9 mt -62.13 150.2 84.58 Favored Pre-proline 0 CA--C 1.544 0.714 0 CA-C-N 120.141 1.971 . . . . 0.0 111.986 -168.578 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -70.47 159.95 51.15 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 122.17 1.913 . . . . 0.0 109.868 -176.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -52.31 -35.62 51.02 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 116.717 2.117 . . . . 0.0 116.717 -154.147 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -93.22 74.0 1.26 Allowed Glycine 0 CA--C 1.524 0.655 0 C-N-CA 125.894 1.711 . . . . 0.0 111.362 -177.334 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 11.4 p-90 -136.04 154.19 51.12 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.933 1.293 . . . . 0.0 113.556 178.475 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -169.76 128.07 0.93 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 129.575 3.15 . . . . 0.0 104.578 177.003 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.9 t -79.93 130.6 35.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 CA-C-N 120.044 1.293 . . . . 0.0 109.814 -171.373 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.1 mmt180 -138.07 156.95 47.27 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.808 1.243 . . . . 0.0 111.839 177.314 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 10.7 p-80 -168.59 152.29 5.63 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.243 1.017 . . . . 0.0 113.156 -169.773 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 82.6 p -171.37 163.68 6.96 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 125.772 1.629 . . . . 0.0 109.987 -170.164 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -65.25 -5.74 7.86 Favored 'General case' 0 CA--C 1.554 1.128 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 179.485 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.6 t -73.77 -19.96 60.62 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.131 1.772 . . . . 0.0 113.089 170.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.81 138.87 24.65 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 120.436 -1.415 . . . . 0.0 113.905 -178.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -76.11 -40.85 51.98 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.179 0.992 . . . . 0.0 112.854 -170.644 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 7.9 mp -100.92 155.21 36.58 Favored Pre-proline 0 CA--C 1.54 0.573 0 C-N-CA 125.157 1.383 . . . . 0.0 109.91 169.036 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -63.29 155.21 63.2 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 122.91 2.407 . . . . 0.0 111.113 175.147 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 34.0 p90 -116.04 140.87 48.83 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 125.832 1.653 . . . . 0.0 109.429 171.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -94.9 95.67 8.8 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.9 0.857 . . . . 0.0 108.745 -175.441 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -63.21 137.9 58.37 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.929 1.692 . . . . 0.0 110.171 177.834 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 56.3 t-20 -82.58 116.9 66.44 Favored Pre-proline 0 CA--C 1.553 1.079 0 O-C-N 121.531 -0.731 . . . . 0.0 110.044 173.278 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.9 -19.87 34.89 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 123.611 2.874 . . . . 0.0 114.358 -179.544 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -88.45 -97.71 0.09 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.708 0.803 . . . . 0.0 109.865 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.8 p -63.91 150.54 44.77 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.367 1.467 . . . . 0.0 110.696 171.059 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -79.74 95.25 5.92 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 121.602 -0.686 . . . . 0.0 109.243 -178.562 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -159.73 -177.65 6.51 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.223 1.409 . . . . 0.0 110.243 -179.311 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 80.3 p -158.09 146.15 18.64 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 120.422 -1.424 . . . . 0.0 112.595 177.004 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 15.8 tpp180 -101.26 131.69 47.15 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 127.071 2.148 . . . . 0.0 108.953 172.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 1.4 m-90 -86.05 -37.38 18.96 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 122.276 1.036 . . . . 0.0 113.476 -163.152 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -154.11 162.96 25.58 Favored Pre-proline 0 CA--C 1.54 0.577 0 C-N-CA 129.112 2.965 . . . . 0.0 106.709 -167.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -57.95 117.72 4.48 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 122.343 2.029 . . . . 0.0 110.547 176.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.463 ' O ' HG22 ' A' ' 40' ' ' THR . 91.9 Cg_endo -78.79 168.63 20.71 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 124.077 3.185 . . . . 0.0 111.165 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.27 -30.28 69.35 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.648 -0.657 . . . . 0.0 112.656 170.066 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -65.17 -9.44 23.17 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 127.092 2.157 . . . . 0.0 115.781 -176.41 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.463 HG22 ' O ' ' A' ' 37' ' ' PRO . 6.2 t -87.72 167.45 13.84 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 126.02 1.728 . . . . 0.0 112.748 -170.752 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -95.53 54.54 1.59 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 125.506 1.522 . . . . 0.0 110.687 -176.457 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.472 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 33.5 mtt -30.36 -39.0 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 127.416 2.286 . . . . 0.0 115.921 173.275 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -54.53 -39.19 67.41 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 121.505 1.957 . . . . 0.0 114.01 172.664 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 84.8 m -82.37 -16.02 50.66 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 127.616 2.366 . . . . 0.0 112.735 172.596 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.472 ' HB3' ' HA ' ' A' ' 42' ' ' MET . 3.0 tm? -123.48 -20.17 5.65 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.218 -0.926 . . . . 0.0 112.833 -151.726 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.63 -26.34 66.95 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 120.16 -1.588 . . . . 0.0 111.524 156.517 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 4.4 mmt -67.09 -19.55 65.66 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.758 0.823 . . . . 0.0 112.906 170.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -104.39 -54.02 2.61 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.31 1.444 . . . . 0.0 112.139 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 68.5 mmm -65.48 -17.43 64.55 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.598 1.959 . . . . 0.0 113.448 -179.747 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -139.14 178.93 6.82 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.337 1.855 . . . . 0.0 110.197 172.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 20.2 p -108.21 98.88 8.36 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.369 1.067 . . . . 0.0 112.265 -172.604 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -81.29 171.57 14.66 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 127.528 2.331 . . . . 0.0 112.077 173.037 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 51.3 t-80 . . . . . 0 C--O 1.255 1.348 0 C-N-CA 124.719 1.207 . . . . 0.0 112.722 -173.457 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 75.2 m . . . . . 0 N--CA 1.474 0.755 0 CA-C-O 119.162 -0.447 . . . . 0.0 110.177 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 27.2 ttt -147.43 94.77 2.43 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.536 0.734 . . . . 0.0 111.403 176.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -161.7 148.7 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 125.737 1.615 . . . . 0.0 111.94 -166.235 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -82.94 93.78 7.6 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.283 1.033 . . . . 0.0 110.337 172.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.5 p -100.15 135.0 42.25 Favored 'General case' 0 CA--C 1.506 -0.731 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 176.105 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.52 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -76.29 26.39 1.55 Allowed Glycine 0 CA--C 1.532 1.127 0 CA-C-O 117.924 -1.487 . . . . 0.0 116.101 151.207 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 16.0 mt -71.58 160.36 82.81 Favored Pre-proline 0 CA--C 1.547 0.84 0 CA-C-N 121.135 2.468 . . . . 0.0 110.533 -178.651 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -72.94 168.98 23.28 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 120.992 1.128 . . . . 0.0 111.147 -175.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.35 -21.15 5.27 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 118.305 2.706 . . . . 0.0 118.305 -157.333 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -138.32 94.34 0.21 Allowed Glycine 0 N--CA 1.468 0.777 0 C-N-CA 124.87 1.224 . . . . 0.0 112.692 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 33.5 p-90 -135.06 159.59 41.02 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.095 1.358 . . . . 0.0 114.028 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -150.43 150.28 31.15 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 127.418 2.287 . . . . 0.0 107.829 166.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.3 p -87.85 146.75 5.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 CA-C-N 120.774 1.625 . . . . 0.0 110.852 172.342 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -127.98 113.17 15.49 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.73 1.612 . . . . 0.0 110.779 174.061 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 45.1 p-80 -78.7 149.61 32.73 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.659 0.784 . . . . 0.0 110.92 160.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.9 t -162.81 132.59 4.39 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 121.27 -0.894 . . . . 0.0 112.015 178.09 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 10.5 m-20 -68.28 -7.92 35.04 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.708 1.203 . . . . 0.0 113.337 176.37 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.8 t -75.59 -19.5 59.21 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.956 1.303 . . . . 0.0 112.833 167.55 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -116.78 161.02 19.92 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.67 1.588 . . . . 0.0 111.863 -170.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -89.69 -39.1 13.41 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.625 0.77 . . . . 0.0 112.247 173.678 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -104.69 176.43 1.75 Allowed Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 127.127 2.171 . . . . 0.0 110.102 176.72 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -69.58 157.91 59.06 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.456 2.104 . . . . 0.0 110.832 155.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 47.6 p90 -120.07 163.89 16.98 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.889 0.876 . . . . 0.0 109.963 157.016 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.9 m-85 -101.61 137.88 39.33 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 120.938 -1.102 . . . . 0.0 110.973 176.442 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -97.42 150.59 20.86 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.724 1.209 . . . . 0.0 109.977 169.669 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -115.2 99.13 51.95 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 124.486 1.114 . . . . 0.0 110.97 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -69.31 -22.75 33.7 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 122.419 2.079 . . . . 0.0 115.05 -173.801 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -75.81 -41.58 52.36 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 119.762 1.164 . . . . 0.0 113.517 -177.296 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 23.0 m -131.19 100.42 5.19 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 168.176 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -47.82 110.12 0.29 Allowed 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.533 1.533 . . . . 0.0 112.198 -171.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -174.23 177.14 2.34 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 127.834 2.453 . . . . 0.0 107.839 -169.08 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 69.5 p -117.69 171.53 7.97 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.898 -1.127 . . . . 0.0 112.846 170.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.5 139.69 40.69 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 127.13 2.172 . . . . 0.0 109.103 175.85 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -126.02 -46.57 1.67 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.155 -0.929 . . . . 0.0 112.444 -152.228 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -144.56 150.84 48.78 Favored Pre-proline 0 CA--C 1.542 0.657 0 C-N-CA 127.917 2.487 . . . . 0.0 107.478 -179.438 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -56.53 115.38 2.44 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 123.597 2.865 . . . . 0.0 112.956 -159.373 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -74.43 163.81 35.38 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 123.657 2.905 . . . . 0.0 112.147 -172.443 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.11 -21.85 65.84 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 -172.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -78.82 -21.38 47.79 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.127 1.371 . . . . 0.0 112.899 172.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -71.18 156.47 39.53 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.528 1.531 . . . . 0.0 112.926 -170.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -108.95 49.53 0.81 Allowed 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.544 1.538 . . . . 0.0 110.723 -164.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.479 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 72.3 mtm -25.29 -47.42 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 127.029 2.132 . . . . 0.0 115.296 173.325 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -50.19 -46.82 54.64 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 121.694 2.043 . . . . 0.0 114.5 174.424 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 99.2 m -68.39 -38.44 81.34 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.189 1.796 . . . . 0.0 111.665 169.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.52 HD13 ' N ' ' A' ' 6' ' ' GLY . 54.2 tp -94.27 -16.68 23.36 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 124.67 1.188 . . . . 0.0 110.964 -153.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.09 -28.78 66.82 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 120.512 -1.367 . . . . 0.0 112.093 161.23 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 20.3 mmt -65.46 -16.66 63.87 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 119.633 1.106 . . . . 0.0 112.509 172.11 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -105.61 -44.49 4.67 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.185 1.794 . . . . 0.0 112.701 177.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.6 mtp -78.61 -8.04 58.22 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.842 1.657 . . . . 0.0 113.607 -176.415 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -130.96 153.83 48.78 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.154 1.382 . . . . 0.0 112.044 175.488 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 9.7 t -81.59 -54.73 5.17 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.49 1.116 . . . . 0.0 111.766 179.175 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 62.3 t80 -76.0 127.83 33.77 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.494 1.118 . . . . 0.0 112.996 -172.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 35.6 m80 . . . . . 0 C--O 1.249 1.026 0 C-N-CA 125.794 1.638 . . . . 0.0 111.881 176.469 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 65.4 m . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 119.579 -0.248 . . . . 0.0 110.82 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 19.1 mmt -78.0 165.13 24.42 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.726 0.811 . . . . 0.0 110.248 164.138 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 15.9 m -142.4 135.44 27.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.84 1.256 . . . . 0.0 112.173 176.383 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -81.45 136.06 35.65 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.983 0.913 . . . . 0.0 110.561 164.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 62.9 p -134.84 133.15 39.43 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.659 1.584 . . . . 0.0 108.43 178.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.568 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -66.58 16.41 0.27 Allowed Glycine 0 CA--C 1.531 1.038 0 N-CA-C 115.523 0.969 . . . . 0.0 115.523 157.291 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 28.3 mt -67.23 156.66 87.59 Favored Pre-proline 0 CA--C 1.549 0.92 0 CA-C-N 119.909 1.855 . . . . 0.0 110.648 -176.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -80.35 -133.08 0.01 OUTLIER 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 123.17 2.58 . . . . 0.0 110.017 -179.225 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.99 -26.12 67.4 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -102.22 86.65 0.58 Allowed Glycine 0 C--N 1.339 0.711 0 C-N-CA 126.275 1.893 . . . . 0.0 109.534 176.283 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 69.5 p-90 -127.06 -28.01 2.93 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 117.226 2.306 . . . . 0.0 117.226 -167.586 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -83.96 112.04 19.81 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.313 0.961 . . . . 0.0 110.489 -168.337 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 24.1 t -61.84 132.2 27.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 O-C-N 121.615 -0.678 . . . . 0.0 111.048 -177.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 60.7 mmt-85 -132.65 132.69 42.7 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.787 1.635 . . . . 0.0 110.567 174.311 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -130.7 2.51 4.47 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 115.065 1.506 . . . . 0.0 115.065 -172.248 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.6 t -72.71 82.11 1.14 Allowed 'General case' 0 N--CA 1.473 0.682 0 O-C-N 120.855 -1.153 . . . . 0.0 108.054 156.576 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -178.19 116.57 0.08 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 127.335 2.254 . . . . 0.0 109.381 -165.401 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.2 m -76.5 -2.18 30.94 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 115.901 1.815 . . . . 0.0 115.901 -170.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.489 ' HG3' ' H ' ' A' ' 20' ' ' ASN . 2.0 tppp? -71.42 179.64 2.87 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 119.522 1.056 . . . . 0.0 111.983 178.257 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.489 ' H ' ' HG3' ' A' ' 19' ' ' LYS . 10.6 m120 -61.99 -43.11 99.54 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.7 1.6 . . . . 0.0 113.729 -175.042 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 10.3 mp -122.96 162.68 37.74 Favored Pre-proline 0 CA--C 1.547 0.827 0 C-N-CA 126.415 1.886 . . . . 0.0 110.866 -177.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.86 159.96 50.93 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 123.184 2.589 . . . . 0.0 111.098 168.322 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 34.1 p90 -108.21 146.08 33.31 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.504 1.121 . . . . 0.0 111.627 177.34 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -92.25 101.16 13.66 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 121.452 0.644 . . . . 0.0 109.377 177.127 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -67.13 145.86 54.85 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.43 1.092 . . . . 0.0 111.8 -178.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -104.71 85.08 1.08 Allowed Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 125.944 1.697 . . . . 0.0 109.828 178.075 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -62.39 -24.61 75.76 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.601 2.201 . . . . 0.0 115.694 -170.265 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.33 -13.64 60.13 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.129 1.159 . . . . 0.0 114.129 -179.12 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.7 m -169.54 124.44 0.82 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 127.082 2.153 . . . . 0.0 108.375 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 24.8 mmt85 -52.15 98.08 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.825 0 CA-C-O 122.702 1.239 . . . . 0.0 112.838 -174.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -163.67 178.05 8.24 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 127.572 2.349 . . . . 0.0 109.825 -174.58 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.3 p -149.48 174.01 12.95 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 120.531 -1.355 . . . . 0.0 113.877 173.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 20.3 tpp180 -138.5 158.7 43.76 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 128.218 2.607 . . . . 0.0 107.948 171.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -140.48 -58.73 0.53 Allowed 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.777 -0.577 . . . . 0.0 111.305 -158.541 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -107.55 153.89 41.09 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 126.003 1.721 . . . . 0.0 109.446 166.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -69.17 121.95 8.78 Favored 'Trans proline' 0 CA--C 1.544 1.018 0 C-N-CA 123.337 2.691 . . . . 0.0 112.059 -167.329 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -83.88 166.27 13.24 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 124.47 3.447 . . . . 0.0 112.358 -172.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.32 -20.81 64.77 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 115.236 1.569 . . . . 0.0 115.236 -174.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -80.96 -7.54 59.55 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 125.177 1.391 . . . . 0.0 113.773 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -74.59 170.12 16.4 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.151 1.78 . . . . 0.0 114.726 -168.311 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -105.18 50.69 0.78 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.811 1.645 . . . . 0.0 110.965 -171.043 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.442 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 10.2 mtm -30.02 -35.54 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 127.164 2.186 . . . . 0.0 116.238 172.804 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.1 -27.35 69.04 Favored 'General case' 0 CA--C 1.553 1.092 0 CA-C-N 122.734 2.516 . . . . 0.0 114.183 175.352 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 69.4 m -94.52 -5.16 46.67 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 128.119 2.568 . . . . 0.0 112.297 171.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.568 HD13 ' N ' ' A' ' 6' ' ' GLY . 26.1 tp -131.07 -20.2 2.78 Favored 'General case' 0 C--O 1.219 -0.528 0 O-C-N 120.844 -1.16 . . . . 0.0 111.69 -155.445 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.01 -36.32 76.96 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 120.607 1.549 . . . . 0.0 111.308 157.092 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 15.2 ptt? -67.65 -9.68 45.47 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.347 1.059 . . . . 0.0 113.485 171.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -104.66 -46.32 4.37 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.037 1.335 . . . . 0.0 112.077 173.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 83.4 mmm -72.85 -8.61 56.37 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 127.493 2.317 . . . . 0.0 113.536 -175.586 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -161.42 146.98 13.89 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.734 2.014 . . . . 0.0 109.679 166.412 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 22.3 m -78.82 147.13 33.36 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.441 -0.787 . . . . 0.0 110.304 -178.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -70.09 146.13 51.14 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.929 0.891 . . . . 0.0 113.226 -176.172 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 68.2 m80 . . . . . 0 C--O 1.247 0.963 0 C-N-CA 127.559 2.344 . . . . 0.0 114.4 179.588 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.7 t . . . . . 0 N--CA 1.476 0.843 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 22.3 mmt -71.13 151.13 44.75 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.855 0.862 . . . . 0.0 110.782 167.519 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 15.7 t -121.58 147.47 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 125.321 1.448 . . . . 0.0 109.258 178.383 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 27.4 m120 -59.39 120.95 10.29 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 122.925 0.49 . . . . 0.0 110.731 173.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 75.5 p -113.11 149.48 33.47 Favored 'General case' 0 CA--C 1.509 -0.623 0 C-N-CA 125.308 1.443 . . . . 0.0 108.1 171.706 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.686 ' H ' HD13 ' A' ' 45' ' ' LEU . . . -84.65 9.52 64.88 Favored Glycine 0 CA--C 1.534 1.266 0 CA-C-N 113.827 -1.533 . . . . 0.0 115.749 158.714 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.4 mt -65.59 150.56 95.93 Favored Pre-proline 0 CA--C 1.546 0.801 0 CA-C-N 118.946 1.373 . . . . 0.0 110.925 -168.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -77.45 177.58 8.67 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.896 1.731 . . . . 0.0 110.978 -175.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.93 -32.94 55.25 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 115.331 1.604 . . . . 0.0 115.331 -170.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -79.1 42.54 2.35 Favored Glycine 0 CA--C 1.533 1.175 0 CA-C-O 118.443 -1.198 . . . . 0.0 115.118 -177.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 1.3 p-90 -122.95 152.54 40.75 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 -176.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 179.51 119.91 0.05 Allowed 'General case' 0 CA--C 1.54 0.569 1 C-N-CA 131.753 4.021 . . . . 0.0 104.085 175.55 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 5.7 t -78.59 126.93 38.97 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 120.604 1.547 . . . . 0.0 110.979 -169.455 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -119.43 113.7 21.18 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.451 1.501 . . . . 0.0 110.319 172.478 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -88.03 163.68 16.16 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.244 1.017 . . . . 0.0 112.049 165.163 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.4 t -159.64 144.44 15.25 Favored 'General case' 0 N--CA 1.467 0.409 0 O-C-N 120.924 -1.11 . . . . 0.0 113.022 -168.444 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 60.5 m-20 -71.89 -7.74 50.26 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.694 0.798 . . . . 0.0 113.066 169.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.0 m -91.7 -14.64 29.67 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 120.787 -1.196 . . . . 0.0 113.511 175.581 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -123.71 146.79 48.0 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.637 1.108 . . . . 0.0 113.425 -162.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -81.6 -9.38 59.69 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 175.435 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 23.3 mt -140.98 167.9 15.96 Favored Pre-proline 0 CA--C 1.539 0.553 0 C-N-CA 126.936 2.095 . . . . 0.0 109.117 176.02 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -68.41 167.04 23.5 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 122.118 1.879 . . . . 0.0 110.207 163.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 39.8 p90 -126.84 157.85 38.19 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.889 1.275 . . . . 0.0 109.416 160.334 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -103.09 115.16 30.06 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.336 -0.852 . . . . 0.0 109.663 -177.226 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -76.03 134.29 40.14 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.569 1.148 . . . . 0.0 110.312 176.715 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 60.2 t-20 -87.54 114.23 57.89 Favored Pre-proline 0 CA--C 1.547 0.839 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 168.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -74.14 -34.64 4.75 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.072 1.848 . . . . 0.0 112.569 176.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -80.15 -19.23 47.69 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.023 1.12 . . . . 0.0 114.023 -171.568 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 26.3 m -147.63 143.83 27.97 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.847 1.659 . . . . 0.0 108.725 -174.455 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -70.52 44.07 0.07 Allowed 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 116.863 2.171 . . . . 0.0 116.863 -170.67 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.411 ' HG3' ' H ' ' A' ' 32' ' ' SER . 6.3 tp10 -129.07 -175.64 3.62 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.815 2.046 . . . . 0.0 111.312 -176.421 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.411 ' H ' ' HG3' ' A' ' 31' ' ' GLU . 78.1 p -145.68 164.96 30.15 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 126.068 1.747 . . . . 0.0 110.804 172.498 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.3 tpp180 -118.64 132.34 56.18 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.66 1.584 . . . . 0.0 109.307 177.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 1.8 m-90 -98.84 -47.54 5.25 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.472 0.709 . . . . 0.0 112.278 -156.009 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -128.56 173.31 5.73 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 127.259 2.224 . . . . 0.0 108.397 165.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -57.67 120.21 7.97 Favored 'Trans proline' 0 CA--C 1.55 1.313 0 C-N-CA 122.509 2.139 . . . . 0.0 111.872 172.428 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.421 ' O ' HG22 ' A' ' 40' ' ' THR . 71.5 Cg_endo -81.18 167.21 17.95 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 125.211 3.941 . . . . 0.0 113.025 -173.261 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -69.93 -4.65 21.54 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 177.314 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -93.66 -6.08 47.18 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 127.469 2.307 . . . . 0.0 113.025 177.678 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.421 HG22 ' O ' ' A' ' 37' ' ' PRO . 2.1 t -85.54 176.35 8.27 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.28 1.432 . . . . 0.0 113.171 -171.708 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -107.67 36.79 2.62 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.287 1.035 . . . . 0.0 111.8 -166.304 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 56.7 mtt -18.41 -43.33 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 130.29 3.436 . . . . 0.0 119.186 -173.297 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -52.28 -45.73 65.58 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-N 122.121 2.237 . . . . 0.0 112.222 170.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 23.6 m -74.65 -15.46 60.81 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 127.457 2.303 . . . . 0.0 112.894 173.221 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.686 HD13 ' H ' ' A' ' 6' ' ' GLY . 3.5 mm? -88.67 -17.17 30.56 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 120.127 1.33 . . . . 0.0 112.08 167.838 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.11 -17.74 62.56 Favored 'General case' 0 CA--C 1.553 1.062 0 CA-C-N 121.377 1.898 . . . . 0.0 111.931 -174.343 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 24.0 ptp -82.88 -7.52 59.65 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 127.864 2.466 . . . . 0.0 114.14 167.383 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.46 ' CD2' HD12 ' A' ' 45' ' ' LEU . 54.2 t80 -116.07 -55.07 2.44 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.65 1.98 . . . . 0.0 112.833 -173.19 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 93.5 mmm -68.85 5.77 1.04 Allowed 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 127.976 2.51 . . . . 0.0 113.439 173.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -158.66 151.06 21.69 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 128.346 2.659 . . . . 0.0 109.316 171.062 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 46.1 p -108.56 163.0 13.62 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.828 1.651 . . . . 0.0 114.315 -166.489 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -77.65 145.31 36.77 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.705 1.602 . . . . 0.0 112.163 173.342 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 . . . . . 0 C--O 1.252 1.188 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -168.68 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 65.3 m . . . . . 0 N--CA 1.479 0.984 0 CA-C-O 121.271 0.557 . . . . 0.0 111.607 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -140.25 159.4 42.26 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 126.096 1.758 . . . . 0.0 111.044 -177.452 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 25.9 m -111.51 144.18 19.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 123.347 0.659 . . . . 0.0 111.854 174.451 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -81.64 136.51 35.52 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.291 1.036 . . . . 0.0 109.735 165.355 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 67.4 p -146.32 150.91 36.64 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-O 122.204 1.002 . . . . 0.0 110.434 170.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.67 ' H ' HD13 ' A' ' 45' ' ' LEU . . . -92.42 18.71 53.93 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-N 113.974 -1.466 . . . . 0.0 114.796 156.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.453 ' HG ' HD11 ' A' ' 45' ' ' LEU . 16.5 mt -70.38 148.93 95.73 Favored Pre-proline 0 CA--C 1.546 0.796 0 CA-C-N 119.61 1.705 . . . . 0.0 110.919 -170.401 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -74.61 158.0 44.0 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 121.978 1.785 . . . . 0.0 110.538 -175.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.75 -11.77 5.86 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 117.195 2.294 . . . . 0.0 117.195 -160.209 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -94.37 59.66 1.91 Allowed Glycine 0 CA--C 1.53 0.995 0 C-N-CA 125.148 1.356 . . . . 0.0 111.871 171.387 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 9.7 p-90 -133.24 165.07 25.65 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 115.534 1.679 . . . . 0.0 115.534 -177.389 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 176.09 172.97 0.36 Allowed 'General case' 0 CA--C 1.543 0.676 1 C-N-CA 132.564 4.345 . . . . 0.0 106.127 -177.026 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.5 t -123.99 142.99 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 125.371 1.468 . . . . 0.0 110.072 -178.212 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -138.68 149.09 44.76 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.935 1.694 . . . . 0.0 110.596 177.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -141.94 162.74 34.72 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -169.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.4 t -173.37 151.29 1.97 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.283 1.833 . . . . 0.0 111.714 -177.141 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -63.95 -15.98 60.45 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.541 1.136 . . . . 0.0 112.525 167.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.4 t -66.27 -13.99 61.28 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.752 1.621 . . . . 0.0 113.921 -177.773 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.3 ptmt -150.42 161.88 41.64 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.028 1.331 . . . . 0.0 112.87 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -71.9 -35.1 69.61 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 -170.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.3 mp -122.51 173.51 4.15 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 127.431 2.292 . . . . 0.0 111.151 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -75.86 171.27 18.49 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 123.269 2.646 . . . . 0.0 111.737 169.029 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 46.2 p90 -126.24 162.49 25.32 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.894 1.678 . . . . 0.0 110.731 166.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -105.23 150.13 25.37 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 121.388 -0.82 . . . . 0.0 112.359 -176.234 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 84.2 t80 -136.13 143.42 44.51 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.515 1.126 . . . . 0.0 112.969 -168.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 62.8 t-20 -95.18 118.0 66.59 Favored Pre-proline 0 CA--C 1.556 1.185 0 C-N-CA 123.198 0.599 . . . . 0.0 111.319 170.222 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -75.15 -19.61 17.37 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.205 2.604 . . . . 0.0 114.414 174.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -93.29 -15.6 25.64 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -172.386 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 88.5 m -154.02 142.63 20.82 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 128.113 2.565 . . . . 0.0 107.485 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 49.1 mmm-85 -68.17 100.63 1.04 Allowed 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.496 1.044 . . . . 0.0 110.666 177.399 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -165.73 149.59 8.08 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.099 1.759 . . . . 0.0 110.495 176.881 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 57.5 p -114.97 -179.47 3.64 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.302 1.041 . . . . 0.0 113.192 169.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 17.8 tpp180 -149.65 137.73 20.46 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.734 1.613 . . . . 0.0 109.801 178.749 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -129.81 -33.13 1.83 Allowed 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.069 0.948 . . . . 0.0 112.987 -154.253 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -145.43 160.09 46.25 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 129.198 2.999 . . . . 0.0 106.887 177.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -67.69 121.42 8.48 Favored 'Trans proline' 0 CA--C 1.546 1.113 0 C-N-CA 122.008 1.805 . . . . 0.0 112.43 -167.252 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -77.6 165.32 27.23 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 124.063 3.175 . . . . 0.0 111.799 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.63 -41.18 76.7 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 179.245 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -71.37 -0.99 11.46 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.27 1.428 . . . . 0.0 114.46 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -85.52 157.17 20.49 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.231 1.013 . . . . 0.0 111.404 177.582 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -88.46 -29.38 20.21 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-O 121.934 0.873 . . . . 0.0 113.085 -163.372 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.488 ' H ' HD23 ' A' ' 45' ' ' LEU . 43.6 mtt 69.57 -43.71 0.53 Allowed 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 129.792 3.237 . . . . 0.0 113.72 176.748 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -55.99 -52.29 64.72 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 120.009 1.277 . . . . 0.0 110.9 170.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.0 m -75.13 1.24 13.75 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 172.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.67 HD13 ' H ' ' A' ' 6' ' ' GLY . 2.7 mm? -104.12 -22.15 13.46 Favored 'General case' 0 CA--C 1.508 -0.655 0 O-C-N 120.257 -1.527 . . . . 0.0 113.963 169.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.29 -22.92 64.7 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 120.895 1.68 . . . . 0.0 111.082 -176.562 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 22.6 ptp -76.76 -6.12 50.93 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.484 2.314 . . . . 0.0 114.731 168.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' TYR . . . . . 0.468 ' HD2' HD12 ' A' ' 45' ' ' LEU . 56.6 t80 -122.69 -58.1 1.69 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.21 1.804 . . . . 0.0 113.342 -169.339 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 54.9 mtp -67.66 -47.74 68.66 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.891 1.277 . . . . 0.0 111.178 -175.058 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -88.74 143.64 26.78 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 148.002 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 2.0 t -76.78 175.43 9.43 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 121.318 0.58 . . . . 0.0 112.431 -176.129 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 84.7 t80 -114.79 145.15 42.44 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.916 2.087 . . . . 0.0 110.684 170.089 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 21.8 m170 . . . . . 0 C--O 1.25 1.13 0 CA-C-O 117.011 -1.471 . . . . 0.0 112.489 -179.339 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 64.5 p . . . . . 0 N--CA 1.474 0.745 0 N-CA-C 111.608 0.225 . . . . 0.0 111.608 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.6 6.29 0.87 Allowed 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 117.676 2.473 . . . . 0.0 117.676 -158.038 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.5 m -93.82 148.61 4.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 127.142 2.177 . . . . 0.0 112.652 -169.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -74.3 143.65 44.89 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.435 1.094 . . . . 0.0 111.765 166.129 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.8 p -147.27 143.49 28.15 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.524 1.53 . . . . 0.0 109.369 169.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.578 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -82.19 7.67 63.15 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 125.864 1.697 . . . . 0.0 116.231 160.135 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 15.5 mt -65.11 155.85 82.81 Favored Pre-proline 0 CA--C 1.553 1.088 0 CA-C-N 119.703 1.751 . . . . 0.0 111.228 -169.118 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -70.16 174.57 9.65 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.071 1.847 . . . . 0.0 111.67 -175.663 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.11 -9.48 0.4 Allowed 'General case' 0 CA--C 1.554 1.101 0 N-CA-C 117.992 2.59 . . . . 0.0 117.992 -166.517 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -105.07 63.95 0.31 Allowed Glycine 0 CA--C 1.531 1.092 0 C-N-CA 125.715 1.626 . . . . 0.0 112.143 170.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 66.5 p-90 -109.91 146.75 34.63 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 -171.009 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 169.2 174.14 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.749 1 C-N-CA 132.314 4.245 . . . . 0.0 106.71 173.544 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.6 p -141.36 143.06 28.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 CA-C-N 119.581 1.082 . . . . 0.0 112.289 175.014 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -137.72 162.91 32.63 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.958 1.703 . . . . 0.0 111.189 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -145.86 172.34 13.48 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.98 1.312 . . . . 0.0 112.245 178.199 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.2 p -157.4 172.74 18.05 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.871 -1.143 . . . . 0.0 113.152 -177.187 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -73.48 -14.38 61.22 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 121.304 -0.872 . . . . 0.0 112.497 170.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 26.6 m -79.55 -31.04 41.95 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 -171.608 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -143.6 146.47 33.31 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.308 1.843 . . . . 0.0 110.056 -173.405 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -79.26 -27.64 42.34 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.222 1.409 . . . . 0.0 112.864 179.14 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -75.62 149.42 83.59 Favored Pre-proline 0 CA--C 1.546 0.824 0 O-C-N 121.4 -0.813 . . . . 0.0 111.043 170.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -73.99 -179.55 4.75 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 123.891 3.061 . . . . 0.0 110.302 167.33 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 54.1 p90 -135.64 140.81 44.83 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.041 0.936 . . . . 0.0 110.85 159.799 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -84.58 119.66 25.46 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -90.54 127.96 36.41 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 124.097 0.959 . . . . 0.0 111.699 -169.306 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 59.7 t-20 -89.94 118.0 68.56 Favored Pre-proline 0 CA--C 1.549 0.931 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 170.532 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -79.32 -33.91 1.24 Allowed 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.609 2.206 . . . . 0.0 113.034 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -90.77 -18.2 25.35 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -168.092 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.7 m -138.31 137.56 37.52 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 126.989 2.116 . . . . 0.0 107.643 172.734 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.25 88.79 0.85 Allowed 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.778 0.831 . . . . 0.0 110.143 -175.938 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -161.04 170.82 19.75 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.391 1.477 . . . . 0.0 110.383 -172.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 18.4 p -151.01 137.14 18.34 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.296 1.039 . . . . 0.0 111.227 173.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 19.7 tpp180 -99.29 149.38 23.18 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.534 1.934 . . . . 0.0 109.641 -178.331 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -120.79 -30.0 4.54 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.666 1.186 . . . . 0.0 113.502 -165.657 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -149.49 153.27 36.79 Favored Pre-proline 0 CA--C 1.541 0.626 0 C-N-CA 126.477 1.911 . . . . 0.0 109.636 -172.505 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -64.47 117.08 4.16 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 123.932 3.088 . . . . 0.0 112.171 -169.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -78.78 170.76 17.63 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.856 3.037 . . . . 0.0 111.852 -179.446 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.57 -32.7 74.46 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -178.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -76.15 -10.79 59.69 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 -177.205 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -76.86 178.59 6.74 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 125.977 1.711 . . . . 0.0 114.491 -171.118 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -126.57 58.64 1.39 Allowed 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.408 1.483 . . . . 0.0 111.991 -168.172 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.473 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 1.8 mpp? -29.62 -40.62 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.075 1.75 . . . . 0.0 114.802 163.608 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 65.3 tt0 -45.51 -46.56 13.95 Favored 'General case' 0 CA--C 1.551 0.996 0 CA-C-N 120.479 1.49 . . . . 0.0 114.436 169.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 98.1 m -86.17 -13.21 47.71 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 127.556 2.342 . . . . 0.0 113.337 175.333 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.578 HD13 ' N ' ' A' ' 6' ' ' GLY . 37.1 tp -123.94 -17.36 6.31 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 121.3 -0.875 . . . . 0.0 112.211 -151.536 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.34 -39.17 72.39 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.371 -1.456 . . . . 0.0 109.749 153.227 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.8 mmt -63.36 8.13 0.08 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.062 1.745 . . . . 0.0 113.856 171.347 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -133.75 -44.28 0.81 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.233 1.813 . . . . 0.0 112.46 176.408 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.1 mtt -85.94 -21.82 27.72 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.719 2.008 . . . . 0.0 114.266 -177.281 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -165.37 66.29 0.12 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.281 1.832 . . . . 0.0 110.173 -177.553 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.8 m -63.35 124.64 21.8 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.58 1.152 . . . . 0.0 113.768 -159.67 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -82.4 150.42 27.13 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.322 1.849 . . . . 0.0 111.876 168.337 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 32.6 m170 . . . . . 0 C--O 1.257 1.488 0 C-N-CA 126.76 2.024 . . . . 0.0 111.527 175.766 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 75.4 p . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 116.836 -1.554 . . . . 0.0 109.625 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 83.4 mtp -62.7 150.05 42.1 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 121.85 2.114 . . . . 0.0 112.581 173.206 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.1 t -125.15 154.13 33.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.025 0 C-N-CA 126.311 1.844 . . . . 0.0 109.96 179.442 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -70.44 148.55 48.2 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.544 -0.722 . . . . 0.0 111.08 165.615 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 77.9 p -141.55 150.56 42.26 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.016 1.726 . . . . 0.0 108.057 173.307 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLY . . . . . 0.563 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -87.35 28.8 5.53 Favored Glycine 0 CA--C 1.525 0.671 0 CA-C-O 117.548 -1.695 . . . . 0.0 114.359 154.924 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.7 mt -76.0 159.65 80.19 Favored Pre-proline 0 CA--C 1.547 0.828 0 CA-C-N 120.333 2.067 . . . . 0.0 110.75 -175.495 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -68.86 174.97 7.94 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 122.644 2.23 . . . . 0.0 111.575 -179.629 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.61 33.37 0.05 Allowed 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 116.28 1.956 . . . . 0.0 116.28 -167.238 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -166.08 99.25 0.16 Allowed Glycine 0 CA--C 1.532 1.153 0 C-N-CA 125.968 1.747 . . . . 0.0 111.872 170.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 19.4 p-90 -155.58 147.46 23.28 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 115.208 1.558 . . . . 0.0 115.208 -175.429 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -159.9 150.52 18.96 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 128.843 2.857 . . . . 0.0 106.809 168.364 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 18.9 t -102.85 120.2 52.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 CA-C-N 120.561 1.528 . . . . 0.0 110.862 -170.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.4 mmp_? -111.86 115.75 29.51 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.572 0.749 . . . . 0.0 111.623 176.649 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 4.0 p80 -155.74 158.94 39.03 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.775 2.03 . . . . 0.0 110.945 175.243 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 41.7 p -137.53 170.31 16.29 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.586 0.708 . . . . 0.0 112.815 -173.33 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -58.87 -24.71 62.52 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.13 0.972 . . . . 0.0 113.452 167.491 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 67.9 m -91.47 -6.42 52.68 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.205 1.402 . . . . 0.0 113.7 176.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -163.16 111.59 1.27 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.499 1.519 . . . . 0.0 111.034 173.001 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -64.06 -33.28 75.39 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.714 0.806 . . . . 0.0 112.888 175.259 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.44 114.3 20.93 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 123.186 0.595 . . . . 0.0 111.239 -167.613 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -77.37 139.61 18.68 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 123.208 2.605 . . . . 0.0 111.425 -172.556 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 55.9 p90 -105.19 135.34 46.74 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 153.656 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -90.15 100.4 13.23 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 121.67 -0.644 . . . . 0.0 110.212 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -63.5 129.4 40.03 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.049 1.34 . . . . 0.0 110.979 -179.605 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 58.4 t-20 -88.29 121.52 70.31 Favored Pre-proline 0 CA--C 1.556 1.193 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 174.043 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -79.27 -19.96 10.11 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 124.509 3.472 . . . . 0.0 113.559 178.124 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -91.67 -40.74 11.12 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.834 0.854 . . . . 0.0 111.969 -175.031 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.8 m -120.33 142.23 49.32 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.614 1.966 . . . . 0.0 109.104 175.002 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 -65.09 97.67 0.26 Allowed 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.277 1.031 . . . . 0.0 110.265 168.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -175.21 158.5 2.4 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.892 2.077 . . . . 0.0 109.542 -172.188 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 88.1 p -134.16 118.28 17.49 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 120.789 -1.194 . . . . 0.0 112.568 168.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 11.2 tpp180 -70.02 128.5 36.54 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.898 1.679 . . . . 0.0 109.576 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -90.57 -45.76 8.72 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.922 1.289 . . . . 0.0 111.743 -167.061 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -152.67 163.22 24.22 Favored Pre-proline 0 CA--C 1.549 0.919 0 C-N-CA 128.128 2.571 . . . . 0.0 107.898 -165.082 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -60.63 123.37 12.88 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 122.942 2.428 . . . . 0.0 113.578 -168.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -87.12 162.45 8.63 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 124.612 3.541 . . . . 0.0 113.413 178.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.51 -6.92 2.67 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 125.441 1.496 . . . . 0.0 114.917 172.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -104.89 9.08 34.82 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.344 1.858 . . . . 0.0 113.613 179.302 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -90.13 -179.91 5.77 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.551 1.94 . . . . 0.0 111.314 179.115 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -103.54 -34.12 8.78 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 120.149 -1.594 . . . . 0.0 112.663 -169.871 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.509 ' HA ' ' HB3' ' A' ' 45' ' ' LEU 0.252 90.3 mtp 60.76 -38.45 0.1 Allowed 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 129.118 2.967 . . . . 0.0 115.577 -170.994 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -64.07 -53.33 51.5 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 122.382 2.355 . . . . 0.0 111.498 -178.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.2 m -65.3 -7.15 12.0 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 125.563 1.545 . . . . 0.0 112.937 170.085 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.563 HD13 ' N ' ' A' ' 6' ' ' GLY . 10.8 tp -112.6 -27.18 8.3 Favored 'General case' 0 C--O 1.217 -0.613 0 O-C-N 120.894 -1.128 . . . . 0.0 112.256 -166.461 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.68 -40.13 96.12 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 120.853 1.661 . . . . 0.0 110.378 170.231 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 14.6 ptm -63.72 -6.96 6.34 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 126.052 1.741 . . . . 0.0 114.941 169.029 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -108.7 -50.47 3.01 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.356 1.463 . . . . 0.0 111.985 174.512 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 85.1 mtp -62.62 -36.89 84.24 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 127.167 2.187 . . . . 0.0 112.029 -178.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.56 88.08 7.02 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 156.629 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 15.0 t -84.6 -9.78 57.97 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.497 1.519 . . . . 0.0 114.591 -165.311 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 10.3 t80 -87.54 126.27 34.82 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 118.881 0.764 . . . . 0.0 112.122 175.308 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 12.7 m80 . . . . . 0 C--O 1.252 1.185 0 C-N-CA 126.602 1.961 . . . . 0.0 112.145 -172.319 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.2 m . . . . . 0 N--CA 1.472 0.668 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 92.6 mtp -98.84 152.68 19.46 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.64 1.176 . . . . 0.0 112.931 -168.418 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 32.9 m -84.26 165.28 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 123.847 0.859 . . . . 0.0 111.541 173.283 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -139.49 154.11 47.65 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.678 0.791 . . . . 0.0 109.836 160.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 62.2 p -133.78 126.71 31.2 Favored 'General case' 0 CA--C 1.51 -0.567 0 C-N-CA 124.811 1.244 . . . . 0.0 109.046 -174.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -66.83 5.93 2.24 Favored Glycine 0 CA--C 1.532 1.124 0 C-N-CA 125.229 1.395 . . . . 0.0 114.445 163.597 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 31.8 mt -63.19 155.98 70.99 Favored Pre-proline 0 CA--C 1.551 0.983 0 CA-C-N 118.917 1.358 . . . . 0.0 110.391 175.556 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -79.35 -135.62 0.02 OUTLIER 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 123.452 2.768 . . . . 0.0 110.495 -178.797 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.97 -26.21 66.7 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 120.806 -1.184 . . . . 0.0 114.144 177.635 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -93.04 83.53 1.09 Allowed Glycine 0 C--N 1.338 0.651 0 C-N-CA 125.609 1.576 . . . . 0.0 109.493 176.389 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -136.38 -13.18 1.8 Allowed 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 117.583 2.438 . . . . 0.0 117.583 -166.8 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -92.09 117.85 30.25 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.834 1.197 . . . . 0.0 109.809 -170.114 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 20.9 t -75.12 123.3 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 O-C-N 121.047 -1.033 . . . . 0.0 110.691 -164.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.6 mmt180 -130.75 153.27 49.19 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.05 1.34 . . . . 0.0 110.259 176.113 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 32.1 p-80 -144.02 169.77 17.19 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.375 1.07 . . . . 0.0 112.78 -173.1 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.2 t -162.62 149.85 13.47 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.1 1.36 . . . . 0.0 111.521 -176.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.2 m120 -67.23 -19.22 65.5 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.236 -0.915 . . . . 0.0 111.925 170.549 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.5 m -88.31 9.84 21.82 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 125.136 1.375 . . . . 0.0 113.368 177.114 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.8 tptm -147.84 125.15 11.55 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.912 1.285 . . . . 0.0 111.196 179.312 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 53.7 m-80 -66.61 -8.07 24.73 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 115.782 1.771 . . . . 0.0 115.782 -169.472 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -157.53 165.53 18.53 Favored Pre-proline 0 CA--C 1.549 0.918 0 C-N-CA 126.8 2.04 . . . . 0.0 109.999 -173.376 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -77.99 159.55 30.62 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 123.152 2.568 . . . . 0.0 111.995 -175.401 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 51.5 p90 -123.69 143.61 50.16 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 126.048 1.739 . . . . 0.0 110.225 171.753 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -97.55 100.37 11.78 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.537 -0.727 . . . . 0.0 109.98 -173.399 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -63.55 137.01 57.96 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.887 1.675 . . . . 0.0 112.233 -173.495 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 57.5 t-20 -95.97 122.41 58.45 Favored Pre-proline 0 CA--C 1.547 0.836 0 C-N-CA 124.061 0.944 . . . . 0.0 108.793 167.824 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -78.34 -36.69 0.89 Allowed 'Trans proline' 0 CA--C 1.534 0.514 0 C-N-CA 122.498 2.132 . . . . 0.0 113.093 176.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -85.25 -12.63 52.05 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -169.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 30.3 m -135.19 141.14 45.8 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.608 1.963 . . . . 0.0 108.282 173.311 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -66.73 89.15 0.15 Allowed 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.476 1.035 . . . . 0.0 109.651 170.324 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -171.92 179.13 2.8 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.664 1.585 . . . . 0.0 110.114 -172.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.2 p -160.5 173.77 15.06 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.851 1.66 . . . . 0.0 109.825 172.22 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.6 tpp180 -125.88 138.31 53.79 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.368 1.067 . . . . 0.0 110.608 -172.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -104.71 -32.06 9.06 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.34 1.456 . . . . 0.0 112.99 -163.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -143.72 162.06 43.35 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 128.476 2.71 . . . . 0.0 107.866 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.67 114.76 1.99 Allowed 'Trans proline' 0 CA--C 1.549 1.273 0 C-N-CA 123.306 2.671 . . . . 0.0 111.218 166.247 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -79.09 -166.9 0.44 Allowed 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 124.776 3.651 . . . . 0.0 111.974 -177.423 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -81.61 -18.44 44.71 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 177.266 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -95.01 7.58 45.64 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.118 1.767 . . . . 0.0 113.355 -174.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.2 t -96.73 162.02 13.61 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 126.58 1.952 . . . . 0.0 112.836 -174.188 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -89.25 -34.47 16.61 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 121.287 0.565 . . . . 0.0 112.129 -157.79 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . 0.26 28.6 mtt 61.55 -37.03 0.11 Allowed 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 130.148 3.379 . . . . 0.0 115.675 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -60.82 -29.07 69.25 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.838 1.255 . . . . 0.0 112.065 168.341 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.4 m -102.86 26.16 8.43 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.681 1.592 . . . . 0.0 112.109 168.731 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 76.4 mt -129.4 -20.09 3.36 Favored 'General case' 0 CA--C 1.507 -0.674 0 O-C-N 119.507 -1.995 . . . . 0.0 115.554 170.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.74 -27.1 67.34 Favored 'General case' 0 CA--C 1.556 1.178 0 CA-C-N 123.092 2.678 . . . . 0.0 111.743 177.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 26.3 ptm -59.24 -14.62 11.6 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 128.053 2.541 . . . . 0.0 115.21 164.859 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -127.36 -57.15 1.3 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.688 1.595 . . . . 0.0 113.122 -165.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 67.7 mmm -66.04 -10.87 44.1 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 127.361 2.265 . . . . 0.0 114.981 -175.556 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.02 110.62 5.13 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.003 1.321 . . . . 0.0 109.527 169.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 55.4 m -69.97 -51.75 29.98 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.936 1.294 . . . . 0.0 113.808 -162.845 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -98.86 -13.82 19.9 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 -166.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 54.1 t-80 . . . . . 0 C--O 1.253 1.243 0 C-N-CA 126.447 1.899 . . . . 0.0 111.436 174.175 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 22.8 m . . . . . 0 N--CA 1.48 1.05 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 22.0 m120 -94.37 133.83 37.53 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.312 1.045 . . . . 0.0 110.468 168.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.445 HG22 ' CD2' ' A' ' 48' ' ' TYR . 24.6 p -134.89 128.26 32.27 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.471 1.509 . . . . 0.0 108.635 174.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -73.25 47.65 1.37 Allowed Glycine 0 CA--C 1.525 0.69 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.871 158.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.8 mt -82.83 171.15 12.4 Favored Pre-proline 0 CA--C 1.545 0.765 0 O-C-N 121.586 -0.95 . . . . 0.0 109.711 171.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -66.39 153.0 79.68 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 N-CA-C 108.656 -1.325 . . . . 0.0 108.656 171.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.28 -25.65 3.96 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 116.067 1.877 . . . . 0.0 116.067 -165.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -77.36 57.03 3.72 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 125.028 1.299 . . . . 0.0 112.612 166.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 2.4 p90 -96.33 149.84 21.23 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.368 1.067 . . . . 0.0 113.343 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 174.42 99.16 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 130.089 3.355 . . . . 0.0 107.27 168.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 39.4 t -69.46 115.53 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 CA-C-N 119.112 0.869 . . . . 0.0 111.066 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -106.05 176.61 5.11 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.223 1.809 . . . . 0.0 109.636 165.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 16.9 p80 -161.84 147.21 13.28 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.954 -1.092 . . . . 0.0 112.299 -178.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.2 m -70.14 156.59 38.98 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -177.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -62.3 -46.14 90.1 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.349 1.06 . . . . 0.0 112.762 -176.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.1 m -130.17 -28.11 2.17 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.933 1.293 . . . . 0.0 112.936 -170.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.3 mttm -74.87 149.68 39.46 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 126.0 1.72 . . . . 0.0 111.476 172.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -96.07 -5.88 39.9 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 118.466 2.765 . . . . 0.0 118.466 -153.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -100.02 158.13 32.61 Favored Pre-proline 0 N--CA 1.481 1.114 0 CA-C-N 120.876 1.671 . . . . 0.0 112.374 177.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -77.41 174.99 11.86 Favored 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 124.018 3.145 . . . . 0.0 110.934 169.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 16.8 p90 -142.17 137.23 30.71 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.912 0.885 . . . . 0.0 110.247 159.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -98.76 102.62 14.41 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.057 -1.027 . . . . 0.0 110.378 -171.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -75.54 131.3 39.95 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.428 1.091 . . . . 0.0 111.287 -177.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 60.5 t-20 -87.66 121.18 71.1 Favored Pre-proline 0 CA--C 1.546 0.807 0 CA-C-O 118.652 -0.689 . . . . 0.0 109.648 167.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -76.63 -35.09 2.2 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 122.595 2.196 . . . . 0.0 113.204 174.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -90.51 -15.88 29.91 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 -169.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.0 m -132.47 138.88 47.75 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.538 1.935 . . . . 0.0 107.207 171.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 35.7 mtp-105 -70.41 87.74 0.64 Allowed 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 118.554 0.616 . . . . 0.0 110.421 175.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -165.79 170.54 13.83 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.96 2.104 . . . . 0.0 111.7 -172.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 79.6 p -152.97 155.86 37.77 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.01 1.324 . . . . 0.0 112.043 177.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -124.85 147.23 48.88 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 126.741 2.016 . . . . 0.0 109.315 -177.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -113.57 -34.61 5.49 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 113.221 0.822 . . . . 0.0 113.221 -160.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -144.03 167.11 16.17 Favored Pre-proline 0 CA--C 1.554 1.126 0 C-N-CA 129.416 3.087 . . . . 0.0 106.878 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -65.12 116.99 4.16 Favored 'Trans proline' 0 CA--C 1.553 1.448 0 C-N-CA 123.06 2.507 . . . . 0.0 113.029 -175.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -87.4 179.94 2.91 Favored 'Trans proline' 0 C--N 1.357 1.003 1 C-N-CA 125.468 4.112 . . . . 0.0 114.036 -175.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.76 -29.72 70.27 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.452 1.278 . . . . 0.0 114.452 175.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -76.82 0.04 22.2 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.89 1.276 . . . . 0.0 114.105 177.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.4 169.88 14.13 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.521 1.529 . . . . 0.0 112.458 -173.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -125.72 56.53 1.39 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.283 1.833 . . . . 0.0 110.907 -171.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.437 ' HA ' ' HB2' ' A' ' 45' ' ' LEU . 62.5 mtm -25.97 -42.44 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.424 0 C-N-CA 127.771 2.428 . . . . 0.0 116.538 171.489 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -53.57 -53.83 46.13 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 121.787 2.085 . . . . 0.0 112.032 172.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.8 m -71.95 -6.73 44.14 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 126.51 1.924 . . . . 0.0 112.238 173.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.437 ' HB2' ' HA ' ' A' ' 42' ' ' MET . 71.7 mt -95.81 -20.9 18.47 Favored 'General case' 0 CA--C 1.507 -0.681 0 O-C-N 120.254 -1.529 . . . . 0.0 113.954 166.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -68.15 -38.17 81.85 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 121.812 2.096 . . . . 0.0 109.707 -172.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 23.7 ptm -60.16 -13.01 9.98 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 128.422 2.689 . . . . 0.0 115.342 165.37 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.445 ' CD2' HG22 ' A' ' 5' ' ' THR . 39.8 t80 -110.42 -65.44 1.16 Allowed 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.016 1.726 . . . . 0.0 112.348 -177.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 55.5 mtp -63.17 -17.19 62.11 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 128.102 2.561 . . . . 0.0 114.752 -172.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -128.23 148.48 50.63 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.071 1.348 . . . . 0.0 111.081 173.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 90.6 m . . . . . 0 N--CA 1.478 0.961 0 C-N-CA 124.947 1.299 . . . . 0.0 110.924 -176.836 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 17.7 m . . . . . 0 N--CA 1.479 0.977 0 N-CA-C 112.932 0.716 . . . . 0.0 112.932 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 37.8 t-20 -95.0 154.58 17.11 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.121 1.368 . . . . 0.0 109.766 159.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.412 HG22 ' CD2' ' A' ' 48' ' ' TYR . 70.4 p -134.22 135.4 42.95 Favored 'General case' 0 CA--C 1.509 -0.626 0 C-N-CA 124.735 1.214 . . . . 0.0 109.129 170.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -81.01 45.24 3.15 Favored Glycine 0 CA--C 1.526 0.745 0 CA-C-N 114.528 -1.215 . . . . 0.0 111.966 155.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.9 mt -93.41 165.56 18.0 Favored Pre-proline 0 CA--C 1.553 1.093 0 CA-C-N 119.831 1.815 . . . . 0.0 110.256 173.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_endo -77.48 -153.86 0.05 OUTLIER 'Trans proline' 0 CA--C 1.548 1.188 0 C-N-CA 123.797 2.998 . . . . 0.0 111.457 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.12 -15.93 38.65 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.246 1.418 . . . . 0.0 114.733 173.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -108.29 83.2 0.32 Allowed Glycine 0 C--N 1.337 0.603 0 C-N-CA 126.524 2.012 . . . . 0.0 110.568 173.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -124.22 0.42 8.39 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 115.157 1.539 . . . . 0.0 115.157 -179.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -80.51 102.55 9.8 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.786 0.721 . . . . 0.0 110.438 -172.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 75.8 t -66.3 131.06 32.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 O-C-N 121.572 -0.705 . . . . 0.0 111.422 -172.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.7 mmt-85 -131.11 120.66 23.69 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.339 1.856 . . . . 0.0 109.312 172.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -92.03 14.03 17.07 Favored 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 -176.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.6 m -73.07 107.29 5.34 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.539 -1.35 . . . . 0.0 111.049 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 55.0 t-20 174.85 135.7 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 128.714 2.806 . . . . 0.0 107.133 -172.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 42.4 m -59.21 -24.92 63.54 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.09 1.356 . . . . 0.0 113.376 168.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.5 mmtt -103.01 141.06 36.44 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.14 1.376 . . . . 0.0 110.532 178.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -79.16 24.52 0.33 Allowed 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 -154.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -111.97 146.0 33.91 Favored Pre-proline 0 CA--C 1.544 0.726 0 C-N-CA 124.921 1.289 . . . . 0.0 110.509 171.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -76.87 166.71 26.48 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 123.587 2.858 . . . . 0.0 112.208 176.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 46.0 p90 -107.43 159.24 16.55 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.306 153.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -100.93 125.4 47.5 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 171.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . 0.4 ' CE2' ' HA ' ' A' ' 27' ' ' PRO . 24.7 t80 -83.35 142.59 30.94 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 121.433 -0.792 . . . . 0.0 111.388 177.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -96.46 92.39 1.07 Allowed Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 126.041 1.736 . . . . 0.0 110.117 170.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.4 ' HA ' ' CE2' ' A' ' 25' ' ' PHE . 9.8 Cg_endo -54.7 -22.72 29.99 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.691 2.928 . . . . 0.0 115.827 -176.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -94.57 -4.85 47.13 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 115.402 1.63 . . . . 0.0 115.402 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.6 m -143.68 149.05 36.65 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 119.701 1.137 . . . . 0.0 111.11 -164.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 55.0 mtp180 -83.97 67.75 9.75 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 121.05 -1.031 . . . . 0.0 110.346 171.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -159.14 169.08 24.97 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 126.748 2.019 . . . . 0.0 109.777 -176.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 92.6 p -140.68 161.15 38.45 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.93 -1.106 . . . . 0.0 113.394 172.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -120.08 158.18 27.38 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.505 1.922 . . . . 0.0 110.221 178.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -144.5 -17.16 0.55 Allowed 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 114.368 1.248 . . . . 0.0 114.368 -160.101 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -154.7 161.4 29.47 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 128.159 2.584 . . . . 0.0 107.12 -173.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -70.64 117.52 5.18 Favored 'Trans proline' 0 CA--C 1.548 1.199 0 C-N-CA 123.05 2.5 . . . . 0.0 111.956 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -83.73 -161.07 0.13 Allowed 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 124.77 3.647 . . . . 0.0 112.476 -178.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -95.1 -21.82 18.29 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 120.51 -1.368 . . . . 0.0 114.02 -178.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -76.99 0.13 22.33 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.998 1.719 . . . . 0.0 112.862 169.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -82.63 172.75 12.61 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 126.968 2.107 . . . . 0.0 111.973 -178.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -129.94 65.72 1.49 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.103 1.761 . . . . 0.0 111.253 -173.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.433 ' HA ' ' HB2' ' A' ' 45' ' ' LEU . 41.1 mtm -37.83 -35.88 0.16 Allowed 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 116.582 2.067 . . . . 0.0 116.582 174.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -68.28 -12.71 61.47 Favored 'General case' 0 CA--C 1.56 1.346 0 CA-C-N 121.481 1.946 . . . . 0.0 114.081 176.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 31.9 m -107.42 -2.41 20.54 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 128.019 2.528 . . . . 0.0 111.837 166.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.433 ' HB2' ' HA ' ' A' ' 42' ' ' MET . 79.4 mt -98.68 -18.43 18.05 Favored 'General case' 0 CA--C 1.507 -0.698 0 CA-C-O 115.871 -2.014 . . . . 0.0 114.48 171.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.417 ' HE2' ' HA ' ' A' ' 46' ' ' LYS . 7.4 mmpt? -68.85 -37.28 79.02 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 123.392 2.814 . . . . 0.0 110.601 -175.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 23.1 ptp -51.86 -22.43 3.75 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.469 1.908 . . . . 0.0 114.054 164.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.412 ' CD2' HG22 ' A' ' 5' ' ' THR . 43.1 t80 -104.11 -70.03 0.78 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 126.497 1.919 . . . . 0.0 112.66 -178.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 12.9 mtt -66.05 -15.53 63.14 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 128.129 2.572 . . . . 0.0 115.265 -174.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -162.5 60.3 0.22 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.97 1.308 . . . . 0.0 111.351 -177.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 5.8 m . . . . . 0 N--CA 1.48 1.051 0 C-N-CA 128.877 2.871 . . . . 0.0 115.187 -159.537 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.479 0.994 0 N-CA-C 111.791 0.293 . . . . 0.0 111.791 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -70.55 146.37 50.2 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.496 0.719 . . . . 0.0 111.713 169.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 63.6 p -136.83 142.55 42.87 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.857 1.663 . . . . 0.0 109.257 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.602 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -75.24 16.98 3.3 Favored Glycine 0 CA--C 1.535 1.29 0 CA-C-O 118.486 -1.175 . . . . 0.0 115.635 152.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 16.4 mt -71.88 156.12 91.34 Favored Pre-proline 0 CA--C 1.547 0.865 0 CA-C-N 120.391 2.095 . . . . 0.0 110.252 -177.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -78.67 -150.82 0.04 OUTLIER 'Trans proline' 0 CA--C 1.548 1.198 0 C-N-CA 122.872 2.382 . . . . 0.0 111.503 -172.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.73 -22.97 58.91 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 120.517 -1.364 . . . . 0.0 114.678 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -102.53 81.53 0.39 Allowed Glycine 0 C--N 1.34 0.761 0 C-N-CA 126.445 1.974 . . . . 0.0 110.542 174.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 10.2 p-90 -130.33 -6.96 4.26 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.73 1.381 . . . . 0.0 114.73 -175.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.2 tp10 -75.67 103.25 5.69 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 118.993 0.815 . . . . 0.0 109.191 -175.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.0 p -66.47 134.78 29.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.179 0.591 . . . . 0.0 111.589 -174.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -130.5 125.83 35.33 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.667 1.587 . . . . 0.0 110.179 176.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 28.1 p-80 -88.04 -11.52 46.98 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.248 1.419 . . . . 0.0 114.668 -173.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 44.6 m -51.19 108.09 0.23 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.918 1.287 . . . . 0.0 112.997 -174.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.1 p30 152.26 140.78 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 131.619 3.967 . . . . 0.0 109.835 -179.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 38.0 m -70.07 -15.9 63.06 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.709 1.604 . . . . 0.0 112.897 168.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.4 ttmt -79.1 -166.17 0.88 Allowed 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.71 1.204 . . . . 0.0 112.463 -179.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.1 m120 -94.93 -30.32 14.21 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 -154.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -114.77 156.16 45.3 Favored Pre-proline 0 N--CA 1.475 0.782 0 C-N-CA 124.662 1.185 . . . . 0.0 111.776 -177.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -79.57 -173.68 1.97 Allowed 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 123.828 3.018 . . . . 0.0 110.562 171.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 45.7 p90 -133.39 149.87 51.82 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.281 1.432 . . . . 0.0 110.05 161.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -93.34 132.13 37.85 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 121.313 -0.867 . . . . 0.0 110.312 174.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -100.42 147.92 25.31 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.514 1.125 . . . . 0.0 111.681 178.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.4 t-20 -102.47 110.02 61.96 Favored Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 123.914 0.885 . . . . 0.0 110.265 162.302 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -63.97 -29.94 66.81 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 123.137 2.558 . . . . 0.0 114.613 177.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.4 -30.77 57.6 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 -172.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 95.6 m -147.1 105.39 3.77 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 126.248 1.819 . . . . 0.0 107.616 177.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -47.18 104.56 0.05 Allowed 'General case' 0 C--O 1.237 0.419 0 C-N-CA 128.147 2.579 . . . . 0.0 111.927 -171.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -171.59 158.09 4.97 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.968 1.707 . . . . 0.0 109.799 -171.065 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 92.6 p -127.3 162.19 26.84 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 174.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 8.1 tpp85 -134.31 150.21 50.94 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 126.725 2.01 . . . . 0.0 109.249 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -142.54 -18.28 0.7 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.561 1.144 . . . . 0.0 112.863 -156.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -149.54 155.96 39.03 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 128.179 2.592 . . . . 0.0 107.504 -175.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -66.03 121.75 9.14 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.823 2.349 . . . . 0.0 110.87 178.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -80.07 167.91 19.4 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 123.545 2.83 . . . . 0.0 111.494 175.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.39 -28.17 68.42 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -176.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -71.48 -24.89 62.07 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.24 1.816 . . . . 0.0 113.859 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.41 164.38 23.14 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 127.034 2.134 . . . . 0.0 113.96 -163.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -107.88 53.42 0.69 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.216 1.407 . . . . 0.0 111.24 -162.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.428 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 77.4 mtm -27.2 -40.38 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 129.045 2.938 . . . . 0.0 115.103 166.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -50.61 -47.58 58.21 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 121.555 1.979 . . . . 0.0 113.542 173.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 21.5 m -78.52 -21.04 49.45 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 128.04 2.536 . . . . 0.0 112.162 176.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.602 HD13 ' N ' ' A' ' 6' ' ' GLY . 38.3 tp -117.48 -21.4 8.64 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 123.976 0.91 . . . . 0.0 111.3 -150.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.9 -35.48 69.03 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 120.598 1.544 . . . . 0.0 111.015 157.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 8.5 mmt -60.43 -24.96 65.61 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 172.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -97.36 -45.48 6.45 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.858 1.663 . . . . 0.0 112.78 -178.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 35.1 mtt -76.33 -17.25 59.51 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.268 1.827 . . . . 0.0 112.697 -177.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -104.3 165.01 11.33 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.044 1.338 . . . . 0.0 110.398 157.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.48 1.072 0 C-N-CA 125.078 1.351 . . . . 0.0 113.343 178.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 18.5 t . . . . . 0 N--CA 1.472 0.65 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.8 m120 -53.26 131.02 36.63 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 122.093 -0.38 . . . . 0.0 111.29 168.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 44.7 p -129.39 146.59 51.23 Favored 'General case' 0 CA--C 1.508 -0.668 0 C-N-CA 125.508 1.523 . . . . 0.0 108.337 171.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.412 ' H ' HD23 ' A' ' 45' ' ' LEU . . . -94.47 52.92 2.08 Favored Glycine 0 CA--C 1.524 0.616 0 CA-C-N 113.795 -1.548 . . . . 0.0 111.5 154.562 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.447 ' HG ' HD21 ' A' ' 45' ' ' LEU . 15.0 mt -88.63 169.06 14.24 Favored Pre-proline 0 CA--C 1.551 1.013 0 CA-C-N 118.699 1.25 . . . . 0.0 110.311 175.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -75.8 -158.34 0.08 OUTLIER 'Trans proline' 0 CA--C 1.548 1.209 0 C-N-CA 121.726 1.618 . . . . 0.0 110.801 177.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.4 12.8 0.54 Allowed 'General case' 0 CA--C 1.551 1.002 0 N-CA-C 115.657 1.725 . . . . 0.0 115.657 -172.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -142.14 102.32 0.3 Allowed Glycine 0 C--N 1.334 0.472 0 C-N-CA 126.046 1.784 . . . . 0.0 109.276 173.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 52.7 p-90 -141.64 -2.47 1.21 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.411 1.484 . . . . 0.0 114.264 -171.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.09 161.25 11.21 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.576 0.751 . . . . 0.0 110.927 159.487 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.5 m -118.51 149.28 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.37 1.068 . . . . 0.0 112.866 -173.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.406 ' HB2' ' CE1' ' A' ' 23' ' ' TYR . 22.9 mmt85 -141.44 118.89 11.53 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.473 1.909 . . . . 0.0 110.196 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 16.4 p-80 -74.52 166.16 23.99 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 113.631 0.974 . . . . 0.0 113.631 175.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 29.0 t -160.49 130.88 5.34 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 125.46 1.504 . . . . 0.0 110.176 176.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -58.9 -24.44 62.32 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 -176.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 69.5 m -71.94 -15.79 62.09 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.944 1.298 . . . . 0.0 114.063 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -108.21 168.03 9.59 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.566 1.546 . . . . 0.0 113.045 -171.23 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -92.97 -9.94 38.15 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 169.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -160.77 164.64 18.82 Favored Pre-proline 0 CA--C 1.55 0.947 0 C-N-CA 126.906 2.082 . . . . 0.0 109.598 -177.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.57 162.68 40.69 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 122.782 2.321 . . . . 0.0 113.125 -177.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.406 ' CE1' ' HB2' ' A' ' 14' ' ' ARG . 33.2 p90 -95.24 157.57 15.84 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.805 0.842 . . . . 0.0 110.953 160.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -83.0 143.42 30.65 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 121.683 -0.636 . . . . 0.0 110.388 171.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -116.83 145.2 43.7 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.301 1.04 . . . . 0.0 112.493 -174.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -101.13 98.15 8.31 Favored Pre-proline 0 CA--C 1.552 1.031 0 C-N-CA 124.702 1.201 . . . . 0.0 110.447 176.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -66.72 -29.67 42.55 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 122.692 2.261 . . . . 0.0 115.137 -167.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.73 -24.38 41.66 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.868 1.432 . . . . 0.0 114.868 -176.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.8 m -146.47 126.68 13.85 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 125.274 1.43 . . . . 0.0 109.51 178.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -50.36 101.12 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.196 1.798 . . . . 0.0 112.736 -176.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -168.08 154.48 7.54 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 127.019 2.128 . . . . 0.0 110.749 179.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 82.4 p -129.53 151.55 50.02 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.878 1.271 . . . . 0.0 112.735 176.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 18.0 tpp180 -126.34 146.35 50.07 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 127.471 2.308 . . . . 0.0 109.831 -176.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -130.62 -36.33 1.43 Allowed 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -158.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -146.28 150.53 41.52 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 126.554 1.942 . . . . 0.0 107.861 -178.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -48.27 112.61 0.62 Allowed 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 124.817 3.678 . . . . 0.0 114.391 -174.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -80.14 163.45 22.66 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 123.488 2.792 . . . . 0.0 112.203 -177.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.84 -22.71 66.87 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.058 1.132 . . . . 0.0 114.058 -178.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -90.75 -1.03 57.88 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.207 1.803 . . . . 0.0 113.998 -174.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.86 -173.6 1.93 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 126.009 1.723 . . . . 0.0 113.794 -170.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -119.09 60.27 0.82 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 126.149 1.78 . . . . 0.0 110.229 177.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 59.6 mtt -31.96 -46.33 0.12 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.901 1.68 . . . . 0.0 113.93 168.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -53.6 -36.58 62.11 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 120.351 1.432 . . . . 0.0 113.995 177.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 75.9 m -85.65 -28.19 24.91 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.28 1.432 . . . . 0.0 111.822 171.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.447 HD21 ' HG ' ' A' ' 7' ' ' LEU . 81.3 mt -72.31 -14.19 61.68 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 119.818 1.19 . . . . 0.0 112.536 174.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.24 -18.18 64.49 Favored 'General case' 0 CA--C 1.55 0.954 0 CA-C-N 120.624 1.556 . . . . 0.0 111.988 -175.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 93.3 mmm -79.84 -8.77 59.48 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 128.146 2.578 . . . . 0.0 113.688 168.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.406 ' HD2' HD22 ' A' ' 45' ' ' LEU . 67.9 t80 -121.27 -56.25 1.91 Allowed 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.786 2.034 . . . . 0.0 113.095 -166.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 88.3 mmm -67.16 -11.79 58.26 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.986 2.115 . . . . 0.0 113.267 178.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.3 151.0 40.0 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.636 1.974 . . . . 0.0 110.338 159.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 5.0 m . . . . . 0 N--CA 1.47 0.543 0 C-N-CA 124.929 1.292 . . . . 0.0 110.229 -175.156 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 17.0 m . . . . . 0 N--CA 1.474 0.774 0 CA-C-O 121.035 0.445 . . . . 0.0 111.475 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.7 m120 -111.24 128.66 56.0 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.113 0.965 . . . . 0.0 109.667 164.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 24.4 p -115.37 127.98 55.76 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.664 1.586 . . . . 0.0 108.217 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -76.33 55.0 3.23 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 110.797 -0.921 . . . . 0.0 110.797 158.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.8 mt -93.07 166.66 15.85 Favored Pre-proline 0 CA--C 1.55 0.964 0 CA-C-N 118.745 1.273 . . . . 0.0 110.905 176.264 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -77.24 -141.45 0.02 OUTLIER 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 123.526 2.817 . . . . 0.0 110.211 176.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.09 -21.43 64.97 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 120.451 -1.406 . . . . 0.0 113.675 177.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -98.52 81.33 0.6 Allowed Glycine 0 C--N 1.337 0.603 0 C-N-CA 126.974 2.226 . . . . 0.0 110.146 172.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 52.0 p-90 -119.46 -16.5 8.92 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 116.69 2.108 . . . . 0.0 116.69 -171.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -80.96 127.13 32.22 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 118.91 0.777 . . . . 0.0 110.759 -175.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.8 m -89.16 130.67 38.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 O-C-N 121.412 -0.805 . . . . 0.0 111.633 -166.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 80.8 mmt-85 -141.28 158.61 43.66 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.215 1.006 . . . . 0.0 112.254 -173.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 8.6 p80 -172.39 137.6 0.87 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.73 2.012 . . . . 0.0 112.118 177.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.9 m -70.18 159.3 34.21 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.672 -0.642 . . . . 0.0 111.968 175.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -68.47 -20.23 64.6 Favored 'General case' 0 CA--C 1.547 0.83 0 O-C-N 120.664 -1.272 . . . . 0.0 114.389 -176.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.4 m -78.89 -0.95 32.84 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.415 1.486 . . . . 0.0 113.756 173.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 59.9 mmtt -135.41 169.87 16.82 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.619 1.968 . . . . 0.0 112.751 -171.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -131.52 -29.76 1.73 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.435 1.494 . . . . 0.0 113.111 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -77.99 128.2 79.53 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 126.369 1.868 . . . . 0.0 110.071 178.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -80.99 159.26 20.86 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 123.188 2.592 . . . . 0.0 114.829 -170.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 34.1 p90 -116.63 153.26 32.59 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.816 1.647 . . . . 0.0 109.824 154.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 33.3 m-85 -110.84 112.2 23.89 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.167 0.987 . . . . 0.0 110.192 -172.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -79.84 137.25 36.9 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.071 1.748 . . . . 0.0 112.928 -171.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -93.35 109.87 43.07 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 124.479 1.112 . . . . 0.0 110.048 171.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.43 -37.21 10.28 Favored 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 121.771 1.647 . . . . 0.0 112.322 175.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.42 -21.81 62.78 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 116.028 1.862 . . . . 0.0 116.028 -170.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 31.6 m -153.67 146.46 24.33 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.256 1.823 . . . . 0.0 108.613 -173.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -70.86 87.08 0.71 Allowed 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.008 0.822 . . . . 0.0 111.844 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -166.23 178.98 5.93 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.839 2.056 . . . . 0.0 109.766 176.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 26.1 p -156.96 149.85 23.7 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.297 1.439 . . . . 0.0 112.552 170.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.7 tpp180 -101.32 135.67 42.43 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.626 2.37 . . . . 0.0 109.664 -176.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -102.03 -30.77 11.0 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 121.114 -0.991 . . . . 0.0 113.513 -167.172 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -148.58 156.7 41.92 Favored Pre-proline 0 CA--C 1.539 0.55 0 C-N-CA 126.938 2.095 . . . . 0.0 108.087 -161.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -67.27 120.72 7.8 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 122.195 1.93 . . . . 0.0 110.69 -173.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -78.19 170.13 19.15 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 122.873 2.382 . . . . 0.0 110.776 173.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -72.65 -27.9 62.4 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.554 -0.716 . . . . 0.0 111.768 164.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -65.23 -0.18 1.64 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 127.716 2.407 . . . . 0.0 114.648 179.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -88.53 172.84 9.03 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 126.658 1.983 . . . . 0.0 113.547 -170.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -107.09 48.43 0.84 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 127.288 2.235 . . . . 0.0 111.178 -171.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.414 ' HA ' ' HB2' ' A' ' 45' ' ' LEU . 69.1 mtm -29.38 -43.19 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 118.099 2.629 . . . . 0.0 118.099 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -49.29 -47.29 47.03 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 123.062 2.665 . . . . 0.0 111.912 174.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 36.6 m -77.66 -22.07 51.18 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 126.028 1.731 . . . . 0.0 111.713 178.26 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.414 ' HB2' ' HA ' ' A' ' 42' ' ' MET . 66.8 mt -82.19 -21.46 36.46 Favored 'General case' 0 CA--C 1.506 -0.741 0 CA-C-O 117.625 -1.179 . . . . 0.0 113.245 171.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.71 -10.13 57.1 Favored 'General case' 0 CA--C 1.554 1.134 0 CA-C-N 121.197 1.817 . . . . 0.0 111.38 176.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.2 mmm -89.33 5.64 44.1 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 127.922 2.489 . . . . 0.0 113.066 167.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 49.6 t80 -135.42 -58.35 0.78 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 126.36 1.864 . . . . 0.0 113.031 -172.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 36.0 mtp -72.29 -4.68 31.09 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 127.829 2.452 . . . . 0.0 112.322 172.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -154.6 -165.99 2.21 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 129.168 2.987 . . . . 0.0 108.055 166.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 29.1 p . . . . . 0 N--CA 1.474 0.73 0 C-N-CA 124.497 1.119 . . . . 0.0 111.23 170.874 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.0 m . . . . . 0 N--CA 1.469 0.514 0 CA-C-O 121.499 0.666 . . . . 0.0 110.541 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.2 m120 -78.48 132.5 37.28 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.407 0.683 . . . . 0.0 109.503 166.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.517 ' HB ' ' H ' ' A' ' 7' ' ' LEU . 71.9 p -132.59 144.21 50.22 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 126.733 2.013 . . . . 0.0 108.588 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -81.22 8.69 57.32 Favored Glycine 0 CA--C 1.536 1.366 0 CA-C-N 115.093 -0.958 . . . . 0.0 113.622 156.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.517 ' H ' ' HB ' ' A' ' 5' ' ' THR . 30.4 mt -61.96 155.17 64.76 Favored Pre-proline 0 CA--C 1.542 0.669 0 CA-C-N 119.902 1.851 . . . . 0.0 110.696 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -70.36 179.18 4.21 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 121.098 1.199 . . . . 0.0 112.308 -169.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.88 -39.74 69.01 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.453 1.101 . . . . 0.0 113.049 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -82.15 68.16 3.56 Favored Glycine 0 CA--C 1.526 0.747 0 C-N-CA 125.405 1.479 . . . . 0.0 111.649 174.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -143.25 163.8 31.95 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 171.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 175.73 140.85 0.06 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 131.22 3.808 . . . . 0.0 106.231 164.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 9.1 p -81.54 141.74 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 CA-C-N 120.195 1.361 . . . . 0.0 112.172 -174.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -142.74 102.54 4.06 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.704 1.202 . . . . 0.0 111.934 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 76.5 m-70 -72.41 112.45 8.48 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.938 0.895 . . . . 0.0 111.892 175.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 29.2 t -59.63 151.23 25.28 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 -167.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -73.88 -36.95 64.86 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.053 1.341 . . . . 0.0 111.451 165.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.2 t -86.29 -25.13 25.64 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -175.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -133.67 153.45 51.67 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.299 1.039 . . . . 0.0 112.002 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -80.63 52.61 1.7 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 124.424 1.09 . . . . 0.0 111.471 176.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -154.16 135.29 8.69 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 125.245 1.418 . . . . 0.0 110.16 -158.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -82.04 131.37 6.88 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 123.33 2.687 . . . . 0.0 112.635 174.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 53.8 p90 -96.36 165.48 12.17 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 122.892 0.477 . . . . 0.0 110.11 151.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -105.19 129.84 53.48 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.321 -0.862 . . . . 0.0 110.65 170.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -87.86 139.41 30.55 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.579 1.151 . . . . 0.0 110.44 174.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -99.13 108.0 47.33 Favored Pre-proline 0 CA--C 1.551 1.015 0 O-C-N 121.855 -0.528 . . . . 0.0 109.858 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -73.48 -36.62 3.78 Favored 'Trans proline' 0 C--N 1.354 0.853 0 C-N-CA 122.512 2.141 . . . . 0.0 112.581 174.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.26 -26.24 64.67 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -174.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 76.9 m -150.21 132.0 15.04 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 127.904 2.482 . . . . 0.0 106.861 -176.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -65.0 97.89 0.26 Allowed 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.604 1.093 . . . . 0.0 110.633 -177.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -171.63 172.65 4.91 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 126.472 1.909 . . . . 0.0 110.542 -167.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 36.6 p -140.02 143.96 36.68 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 120.823 -1.173 . . . . 0.0 111.862 166.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 20.2 tpp180 -107.33 143.49 35.53 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 126.788 2.035 . . . . 0.0 110.218 -178.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -127.3 -6.54 5.91 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.41 1.484 . . . . 0.0 114.528 -166.025 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -165.98 168.92 7.25 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 127.763 2.425 . . . . 0.0 107.941 -173.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -68.01 122.38 9.47 Favored 'Trans proline' 0 CA--C 1.546 1.093 0 C-N-CA 122.07 1.846 . . . . 0.0 111.239 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -82.12 174.77 9.77 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 124.505 3.47 . . . . 0.0 111.465 176.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.37 -44.46 88.87 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 176.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -68.96 -11.48 60.74 Favored 'General case' 0 CA--C 1.553 1.066 0 N-CA-C 115.645 1.72 . . . . 0.0 115.645 -167.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.3 t -75.83 164.29 26.38 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 126.382 1.873 . . . . 0.0 114.872 -164.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -115.17 56.57 0.74 Allowed 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.749 2.02 . . . . 0.0 111.174 -163.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.405 ' HA ' ' HB2' ' A' ' 45' ' ' LEU . 27.0 mtt -30.86 -40.75 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.87 1.668 . . . . 0.0 114.805 169.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -39.65 -54.75 1.99 Allowed 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 126.412 1.885 . . . . 0.0 114.082 166.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 95.6 m -78.79 -31.06 45.85 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.961 2.104 . . . . 0.0 111.409 170.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.405 ' HB2' ' HA ' ' A' ' 42' ' ' MET . 0.3 OUTLIER -80.03 -19.99 46.38 Favored 'General case' 0 C--O 1.224 -0.251 0 O-C-N 121.171 -0.956 . . . . 0.0 112.58 -162.972 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.25 -27.41 67.93 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 120.707 1.594 . . . . 0.0 112.17 175.387 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 95.6 mmm -62.05 -8.03 4.79 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.714 1.205 . . . . 0.0 113.816 167.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -115.85 -59.55 1.98 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.615 1.966 . . . . 0.0 111.547 178.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -7.45 41.81 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.247 1.819 . . . . 0.0 113.99 -178.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -138.45 53.58 1.79 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.469 1.508 . . . . 0.0 110.238 167.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 7.4 m . . . . . 0 N--CA 1.476 0.874 0 C-N-CA 125.245 1.418 . . . . 0.0 110.647 -174.426 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 3.4 t . . . . . 0 N--CA 1.474 0.758 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -70.32 128.72 37.19 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 122.09 -0.382 . . . . 0.0 111.188 175.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 24.5 p -133.03 132.49 41.9 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 127.206 2.202 . . . . 0.0 107.843 -176.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.537 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -68.86 34.12 0.29 Allowed Glycine 0 CA--C 1.532 1.142 0 CA-C-O 118.435 -1.203 . . . . 0.0 115.651 155.363 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.7 mt -83.77 165.04 41.84 Favored Pre-proline 0 CA--C 1.548 0.872 0 CA-C-N 119.633 1.716 . . . . 0.0 109.61 177.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -77.95 -147.15 0.03 OUTLIER 'Trans proline' 0 CA--C 1.545 1.036 0 C-N-CA 121.608 1.539 . . . . 0.0 109.128 174.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.28 -21.04 64.82 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.212 -1.555 . . . . 0.0 112.91 173.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -80.94 68.79 3.36 Favored Glycine 0 CA--C 1.527 0.805 0 C-N-CA 126.025 1.774 . . . . 0.0 111.545 170.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 12.1 p-90 -120.37 -12.43 8.99 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 116.588 2.07 . . . . 0.0 116.588 -173.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -70.3 114.91 8.9 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 120.077 1.308 . . . . 0.0 110.448 -179.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 6.0 t -72.16 134.17 30.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 CA-C-N 119.168 0.895 . . . . 0.0 109.826 178.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.2 mmt85 -131.9 128.98 39.71 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 125.087 1.355 . . . . 0.0 111.331 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 38.0 p-80 -62.8 137.57 58.3 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 121.771 -0.58 . . . . 0.0 110.476 159.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.8 t -97.69 150.93 20.64 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.037 -1.04 . . . . 0.0 112.391 -174.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -69.03 -41.41 77.72 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.388 -0.82 . . . . 0.0 110.156 162.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 85.1 p -106.91 -3.73 19.9 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 115.691 1.738 . . . . 0.0 115.691 -158.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.5 ttmm -138.43 146.34 42.03 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.484 1.038 . . . . 0.0 113.564 -169.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -88.1 46.67 1.41 Allowed 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.74 1.616 . . . . 0.0 111.946 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 16.6 tp -170.63 151.9 3.67 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 128.258 2.623 . . . . 0.0 107.322 -171.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -71.18 166.37 29.42 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 121.607 1.538 . . . . 0.0 110.645 169.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 17.2 p90 -127.86 160.93 30.27 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.725 1.21 . . . . 0.0 109.949 164.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -103.98 139.44 39.11 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.6 -0.688 . . . . 0.0 110.537 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -118.04 142.19 47.66 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.658 1.583 . . . . 0.0 111.581 -172.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 65.0 t-20 -98.15 109.41 51.84 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 124.576 1.15 . . . . 0.0 110.362 171.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -75.79 -26.22 9.92 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 123.087 2.525 . . . . 0.0 113.243 177.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.83 -29.4 40.17 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 118.948 0.795 . . . . 0.0 112.771 -175.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.9 m -143.27 88.99 2.06 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.144 1.378 . . . . 0.0 108.707 174.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -32.7 103.1 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 128.557 2.743 . . . . 0.0 114.005 -173.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -173.19 165.13 4.87 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.299 1.84 . . . . 0.0 109.821 -170.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 57.1 p -120.38 173.4 7.17 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.482 1.513 . . . . 0.0 113.352 175.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.05 141.28 17.48 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.837 2.055 . . . . 0.0 109.254 -178.268 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -134.5 -25.92 1.46 Allowed 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -151.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -142.91 152.75 59.64 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 127.976 2.51 . . . . 0.0 107.556 172.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -51.04 113.0 0.91 Allowed 'Trans proline' 0 CA--C 1.544 1.012 0 C-N-CA 124.19 3.26 . . . . 0.0 112.923 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -79.15 169.39 19.17 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 123.34 2.693 . . . . 0.0 111.924 -176.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.94 -38.02 81.2 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -78.44 0.13 27.04 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 127.463 2.305 . . . . 0.0 114.5 -175.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.78 174.7 10.19 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 126.008 1.723 . . . . 0.0 111.063 178.214 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -103.6 -35.6 8.23 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 120.949 -1.095 . . . . 0.0 112.402 -166.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.521 ' HA ' ' HB3' ' A' ' 45' ' ' LEU 0.263 33.7 mtt 60.99 -40.05 0.11 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 128.542 2.737 . . . . 0.0 115.741 -176.9 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -62.23 -51.99 65.53 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 122.343 2.338 . . . . 0.0 111.783 177.288 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.0 m -66.53 -11.16 51.34 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 125.91 1.684 . . . . 0.0 112.175 169.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.537 HD13 ' N ' ' A' ' 6' ' ' GLY . 8.6 tp -105.06 -23.76 12.89 Favored 'General case' 0 N--CA 1.447 -0.602 0 O-C-N 120.942 -1.099 . . . . 0.0 111.225 -170.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.24 -37.7 88.26 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 120.957 1.708 . . . . 0.0 110.213 169.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 25.1 ptp -69.87 18.31 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 126.101 1.761 . . . . 0.0 114.573 166.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -138.28 -32.38 0.72 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.691 1.997 . . . . 0.0 112.297 171.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 93.4 mmm -95.12 -8.95 34.99 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 127.287 2.235 . . . . 0.0 115.095 -179.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -141.23 165.6 27.07 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 120.327 1.421 . . . . 0.0 113.179 -176.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 10.9 t . . . . . 0 N--CA 1.479 0.989 0 C-N-CA 125.118 1.367 . . . . 0.0 113.288 -170.116 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.8 m . . . . . 0 N--CA 1.479 1.01 0 CA-C-O 120.616 0.246 . . . . 0.0 111.459 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -83.39 140.65 32.27 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.201 0.6 . . . . 0.0 110.345 167.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.576 ' HB ' ' H ' ' A' ' 7' ' ' LEU . 63.1 p -139.98 141.76 36.36 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 122.727 1.251 . . . . 0.0 109.714 170.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.662 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -73.76 4.14 31.17 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-N 113.785 -1.552 . . . . 0.0 116.074 152.083 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.576 ' H ' ' HB ' ' A' ' 5' ' ' THR . 15.1 mt -71.02 153.9 94.43 Favored Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 120.708 2.254 . . . . 0.0 109.074 -173.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -77.3 -152.23 0.04 OUTLIER 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 122.253 1.969 . . . . 0.0 109.989 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.09 -30.98 71.38 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 120.871 -1.143 . . . . 0.0 113.198 -178.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -91.74 74.26 1.54 Allowed Glycine 0 C--N 1.339 0.737 0 C-N-CA 126.799 2.142 . . . . 0.0 112.271 174.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 55.1 p-90 -109.71 -19.56 13.13 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 117.237 2.31 . . . . 0.0 117.237 -174.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -87.04 116.62 25.21 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 119.821 1.192 . . . . 0.0 111.198 -167.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.8 p -67.41 131.36 32.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 119.449 1.022 . . . . 0.0 112.306 -177.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.3 mmt180 -139.36 162.01 36.06 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.109 1.763 . . . . 0.0 111.469 -173.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -142.78 165.01 28.56 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.118 1.367 . . . . 0.0 111.74 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.4 m -136.08 173.9 11.21 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.27 1.428 . . . . 0.0 112.877 -169.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 10.4 p-10 -81.92 -11.51 58.86 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 115.581 1.697 . . . . 0.0 115.581 -171.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.3 t -127.27 -31.84 2.52 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -178.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.5 tttp -60.14 155.16 17.86 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.513 1.525 . . . . 0.0 112.208 170.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -106.63 -28.2 10.37 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.126 0.97 . . . . 0.0 113.502 175.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 8.5 mp -95.64 160.49 30.25 Favored Pre-proline 0 N--CA 1.476 0.843 0 C-N-CA 125.604 1.562 . . . . 0.0 111.972 175.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -79.11 174.26 12.34 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 123.324 2.683 . . . . 0.0 112.272 168.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 39.7 p90 -147.75 152.22 37.37 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.72 2.408 . . . . 0.0 109.876 172.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 -87.06 141.51 28.61 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.129 -0.982 . . . . 0.0 110.689 173.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -124.16 146.15 48.85 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.78 1.632 . . . . 0.0 111.52 -170.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 57.4 t-20 -97.94 113.73 64.14 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 124.066 0.947 . . . . 0.0 111.401 177.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -70.41 -30.37 19.36 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 123.159 2.573 . . . . 0.0 113.552 178.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.28 -51.25 10.42 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.231 0.923 . . . . 0.0 112.036 -176.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 23.2 m -117.55 125.63 51.15 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.584 1.554 . . . . 0.0 107.917 177.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 46.4 mtm105 -62.89 107.56 1.01 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.956 1.253 . . . . 0.0 109.873 177.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -174.06 162.77 3.86 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 129.304 3.042 . . . . 0.0 109.127 -173.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 30.9 p -128.51 175.66 8.36 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.781 1.233 . . . . 0.0 114.234 -179.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.55 145.24 25.0 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 127.298 2.239 . . . . 0.0 109.06 174.057 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 2.0 m-90 -111.7 -23.26 10.74 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 121.295 -0.878 . . . . 0.0 113.162 -155.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -157.77 167.41 14.55 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 131.545 3.938 . . . . 0.0 106.373 -175.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -62.12 120.09 7.51 Favored 'Trans proline' 0 CA--C 1.551 1.328 0 CA-C-N 121.954 1.734 . . . . 0.0 110.201 172.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -85.37 -167.99 0.46 Allowed 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 124.391 3.394 . . . . 0.0 112.486 -171.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -75.06 -47.0 31.03 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 121.282 -0.886 . . . . 0.0 113.35 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -63.65 -13.08 39.3 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.03 1.332 . . . . 0.0 114.315 -175.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -71.0 164.94 24.52 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 127.872 2.469 . . . . 0.0 112.646 -171.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -110.05 24.87 12.45 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.267 -0.895 . . . . 0.0 112.482 -154.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.606 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 51.6 mtt -5.35 -45.39 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.508 1 C-N-CA 132.103 4.161 . . . . 0.0 120.059 -176.122 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -55.65 -42.66 75.34 Favored 'General case' 0 CA--C 1.55 0.96 0 CA-C-N 122.657 2.48 . . . . 0.0 112.564 170.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.3 m -73.33 -7.9 53.58 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 127.876 2.47 . . . . 0.0 113.25 172.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.662 HD13 ' N ' ' A' ' 6' ' ' GLY . 11.4 tp -121.71 -24.16 5.36 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 120.994 -1.066 . . . . 0.0 111.734 -163.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -57.81 -42.95 85.33 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 120.163 1.347 . . . . 0.0 110.091 163.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 21.7 ptp -61.83 -9.48 6.8 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.518 1.527 . . . . 0.0 114.521 172.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.0 t80 -109.65 -44.03 3.94 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.456 1.503 . . . . 0.0 112.885 176.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 12.2 mmt -78.22 -36.42 47.17 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.369 1.868 . . . . 0.0 113.328 -175.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -95.4 161.8 13.93 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.458 1.103 . . . . 0.0 112.557 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 38.0 p . . . . . 0 N--CA 1.479 1.016 0 N-CA-C 115.482 1.66 . . . . 0.0 115.482 -174.353 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.8 m . . . . . 0 N--CA 1.478 0.958 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 56.0 m-80 -72.17 135.82 46.27 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.658 0.742 . . . . 0.0 111.887 173.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 77.1 p -124.02 148.41 47.04 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 126.751 2.02 . . . . 0.0 107.349 174.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.637 ' H ' HD13 ' A' ' 45' ' ' LEU . . . -76.62 2.47 58.54 Favored Glycine 0 CA--C 1.532 1.15 0 CA-C-O 118.681 -1.066 . . . . 0.0 114.545 157.257 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.434 ' HG ' HD11 ' A' ' 45' ' ' LEU . 14.7 mt -61.31 153.71 66.86 Favored Pre-proline 0 CA--C 1.541 0.611 0 CA-C-N 119.383 1.592 . . . . 0.0 110.012 -171.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -71.42 162.25 42.93 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 CA-C-N 120.009 1.039 . . . . 0.0 109.632 -176.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.77 -25.82 8.36 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 115.555 1.687 . . . . 0.0 115.555 -169.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -82.38 72.27 2.84 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 124.181 0.896 . . . . 0.0 111.119 166.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 2.1 p-90 -142.3 153.09 43.6 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.603 1.161 . . . . 0.0 114.113 169.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 174.72 124.96 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 130.589 3.556 . . . . 0.0 105.254 176.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 35.4 t -73.99 129.65 36.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 CA-C-N 121.329 1.877 . . . . 0.0 110.586 -174.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.0 mmt-85 -114.09 132.94 55.86 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 126.029 1.732 . . . . 0.0 111.349 171.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -102.85 25.45 9.27 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.564 1.546 . . . . 0.0 112.201 170.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.1 m -77.98 54.24 1.28 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.21 1.804 . . . . 0.0 114.151 -171.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -155.59 138.0 14.91 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 126.468 1.907 . . . . 0.0 108.452 -177.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 17.6 t -62.45 -32.88 73.82 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 125.715 1.606 . . . . 0.0 111.706 170.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -70.73 143.12 51.38 Favored 'General case' 0 CA--C 1.547 0.865 0 O-C-N 121.049 -1.032 . . . . 0.0 110.828 167.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -82.17 32.78 0.39 Allowed 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.366 1.466 . . . . 0.0 114.475 -165.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -107.6 157.88 34.71 Favored Pre-proline 0 N--CA 1.474 0.741 0 C-N-CA 125.821 1.648 . . . . 0.0 110.869 175.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -86.92 172.18 6.53 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 123.622 2.882 . . . . 0.0 110.329 164.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 49.0 p90 -142.21 165.54 27.15 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.027 1.331 . . . . 0.0 109.214 151.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -98.8 125.08 44.07 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 120.782 -1.199 . . . . 0.0 110.475 176.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -74.11 149.23 41.16 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 120.64 -1.288 . . . . 0.0 110.709 168.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -99.02 96.91 4.48 Favored Pre-proline 0 CA--C 1.545 0.765 0 C-N-CA 122.996 0.518 . . . . 0.0 110.365 173.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -66.49 -29.45 44.77 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.453 2.102 . . . . 0.0 112.519 171.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.54 -19.11 62.92 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 -174.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.5 m -174.27 130.31 0.37 Allowed 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 129.042 2.937 . . . . 0.0 106.476 177.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 55.5 mtt85 -61.33 108.55 0.95 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.946 0.898 . . . . 0.0 111.011 -170.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -170.98 -180.0 2.93 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 130.552 3.541 . . . . 0.0 106.752 -170.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 14.8 m -149.97 130.25 13.71 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 119.463 -2.023 . . . . 0.0 111.963 165.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 12.8 tpp180 -86.91 121.72 29.77 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 127.583 2.353 . . . . 0.0 110.557 -178.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -76.16 -32.99 59.35 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 127.105 2.162 . . . . 0.0 114.209 -168.339 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -166.21 168.9 7.09 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 127.304 2.241 . . . . 0.0 108.565 -172.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -55.66 124.75 17.06 Favored 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 122.69 2.26 . . . . 0.0 112.551 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -85.29 -168.86 0.54 Allowed 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 124.761 3.641 . . . . 0.0 111.644 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.0 -42.75 31.66 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.061 0.945 . . . . 0.0 113.461 177.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -78.87 5.64 11.0 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 -172.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.5 t -74.41 152.02 39.57 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.188 1.795 . . . . 0.0 112.241 177.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -105.14 48.3 0.84 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.384 1.074 . . . . 0.0 112.905 -155.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.427 ' O ' ' HE3' ' A' ' 46' ' ' LYS . 65.2 mtm -22.07 -47.2 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 118.792 2.886 . . . . 0.0 118.792 -169.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -51.65 -42.61 62.2 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 123.335 2.788 . . . . 0.0 113.328 175.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 55.9 m -75.07 -23.08 57.97 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.098 1.359 . . . . 0.0 112.023 173.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.637 HD13 ' H ' ' A' ' 6' ' ' GLY . 3.2 mm? -79.87 -19.84 47.33 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 116.781 -1.58 . . . . 0.0 113.139 171.128 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.427 ' HE3' ' O ' ' A' ' 42' ' ' MET . 8.0 mmpt? -69.01 -23.37 64.08 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 122.289 2.313 . . . . 0.0 111.751 -172.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.2 ptm -70.21 -17.89 63.16 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.485 1.514 . . . . 0.0 113.998 168.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.508 ' CD2' HD12 ' A' ' 45' ' ' LEU . 47.1 t80 -107.2 -61.75 1.51 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.967 2.507 . . . . 0.0 112.157 -171.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 27.9 mtp -66.74 -7.73 23.16 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.967 2.107 . . . . 0.0 114.489 -178.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -151.69 152.56 32.95 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.371 1.468 . . . . 0.0 109.997 163.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 6.4 t . . . . . 0 N--CA 1.474 0.741 0 CA-C-O 118.022 -0.989 . . . . 0.0 112.929 170.438 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.5 m . . . . . 0 N--CA 1.475 0.795 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -95.49 142.79 27.43 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 125.029 1.332 . . . . 0.0 109.514 159.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.577 ' HB ' ' H ' ' A' ' 7' ' ' LEU . 76.2 p -133.93 144.14 48.65 Favored 'General case' 0 CA--C 1.514 -0.416 0 C-N-CA 126.085 1.754 . . . . 0.0 108.814 174.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.41 ' H ' HD23 ' A' ' 45' ' ' LEU . . . -78.44 3.11 64.15 Favored Glycine 0 CA--C 1.534 1.249 0 CA-C-O 119.015 -0.88 . . . . 0.0 113.141 155.143 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.577 ' H ' ' HB ' ' A' ' 5' ' ' THR . 37.6 mt -61.91 153.78 71.13 Favored Pre-proline 0 CA--C 1.545 0.775 0 CA-C-N 119.881 1.841 . . . . 0.0 110.594 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -80.52 -149.5 0.04 OUTLIER 'Trans proline' 0 CA--C 1.544 1.0 0 C-N-CA 122.695 2.263 . . . . 0.0 110.419 -176.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.24 4.65 0.2 Allowed 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 115.825 1.787 . . . . 0.0 115.825 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -127.92 97.34 0.45 Allowed Glycine 0 C--N 1.338 0.648 0 C-N-CA 127.115 2.293 . . . . 0.0 109.501 171.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 61.8 p-90 -139.47 -23.84 0.87 Allowed 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 116.445 2.017 . . . . 0.0 116.445 -165.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -83.14 105.22 13.94 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 119.131 0.878 . . . . 0.0 109.366 -169.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 6.1 p -70.49 128.18 33.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 CA-C-N 119.219 0.918 . . . . 0.0 112.732 -169.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -128.46 165.09 21.34 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.767 2.027 . . . . 0.0 110.895 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 3.1 p80 -168.02 -179.52 4.17 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 126.121 1.769 . . . . 0.0 112.06 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.2 m -145.95 166.42 26.07 Favored 'General case' 0 N--CA 1.476 0.868 0 O-C-N 120.48 -1.387 . . . . 0.0 112.499 177.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -60.13 -44.22 95.07 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.844 1.257 . . . . 0.0 113.812 -174.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.5 m -87.16 -5.82 58.86 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.527 1.131 . . . . 0.0 112.751 174.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -133.8 67.75 1.51 Allowed 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.566 1.546 . . . . 0.0 110.642 -174.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -65.37 -24.81 67.34 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.407 1.483 . . . . 0.0 113.892 -174.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -74.14 119.41 76.19 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 123.819 0.847 . . . . 0.0 108.866 178.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -76.99 166.32 26.96 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 123.145 2.564 . . . . 0.0 113.98 -165.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 44.1 p90 -137.48 146.08 43.82 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 126.154 1.782 . . . . 0.0 110.959 171.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -93.65 118.46 31.41 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.157 -0.964 . . . . 0.0 110.578 178.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -81.33 138.67 35.65 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.719 1.208 . . . . 0.0 112.055 -175.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -92.69 117.83 67.73 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 124.424 1.089 . . . . 0.0 109.101 172.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -69.87 -46.1 1.3 Allowed 'Trans proline' 0 C--N 1.35 0.623 0 C-N-CA 121.907 1.738 . . . . 0.0 112.664 179.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -90.73 9.48 29.79 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 115.254 1.576 . . . . 0.0 115.254 -170.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 92.6 m -151.85 140.89 21.19 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.906 1.683 . . . . 0.0 109.715 -176.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 64.7 mtp85 -70.95 95.71 1.21 Allowed 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.593 0.757 . . . . 0.0 108.994 168.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -174.66 157.42 2.53 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.608 1.963 . . . . 0.0 110.452 -169.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.3 p -139.84 133.19 29.97 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 123.804 0.842 . . . . 0.0 110.394 159.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 4.3 tpp180 -81.87 117.31 22.04 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 122.231 1.015 . . . . 0.0 109.767 174.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -88.25 -22.25 24.05 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.573 1.549 . . . . 0.0 113.975 -170.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -160.55 156.28 22.13 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 127.608 2.363 . . . . 0.0 108.537 -164.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.32 119.46 6.46 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.058 2.505 . . . . 0.0 112.141 -170.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_endo -84.07 -168.04 0.51 Allowed 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 124.628 3.552 . . . . 0.0 111.92 -177.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -88.21 -31.43 19.08 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.062 1.345 . . . . 0.0 112.896 171.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -69.83 -3.13 14.32 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 125.302 1.441 . . . . 0.0 113.492 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.1 t -80.92 159.4 24.97 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.743 2.017 . . . . 0.0 112.112 176.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -123.68 59.7 1.11 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 127.151 2.18 . . . . 0.0 111.333 -162.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.2 mpp? -32.92 -38.15 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 116.922 2.193 . . . . 0.0 116.922 173.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.09 -40.5 67.29 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 121.269 1.85 . . . . 0.0 113.002 171.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 55.2 m -80.46 -26.31 38.39 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.918 1.687 . . . . 0.0 111.712 168.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.41 HD23 ' H ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -94.1 -24.57 17.52 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 -161.558 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.75 -13.79 62.46 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 121.744 2.066 . . . . 0.0 112.101 172.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 23.7 mmt -71.15 -12.17 61.34 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.171 0.988 . . . . 0.0 113.518 164.018 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -113.1 -50.82 2.86 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.213 1.805 . . . . 0.0 112.118 -179.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 82.8 mmm -77.09 -4.28 43.57 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.696 1.998 . . . . 0.0 114.174 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -148.28 172.66 14.01 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.325 1.85 . . . . 0.0 109.856 170.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 3.9 t . . . . . 0 N--CA 1.478 0.949 0 C-N-CA 124.935 1.294 . . . . 0.0 110.198 177.478 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 14.9 m . . . . . 0 N--CA 1.475 0.787 0 CA-C-O 120.734 0.302 . . . . 0.0 111.759 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -98.55 122.08 41.3 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.435 1.094 . . . . 0.0 109.525 168.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 32.6 p -117.02 124.15 48.61 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.343 1.457 . . . . 0.0 108.701 -175.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.464 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -69.78 41.45 0.43 Allowed Glycine 0 CA--C 1.532 1.128 0 CA-C-O 118.768 -1.018 . . . . 0.0 115.381 158.596 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.1 mt -85.67 168.18 21.07 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 125.858 1.663 . . . . 0.0 110.432 179.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -75.26 -157.29 0.06 OUTLIER 'Trans proline' 0 CA--C 1.548 1.196 0 C-N-CA 122.576 2.184 . . . . 0.0 111.197 176.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.02 -33.98 74.12 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.541 -1.35 . . . . 0.0 112.645 173.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -80.24 62.25 4.29 Favored Glycine 0 CA--C 1.526 0.772 0 C-N-CA 125.522 1.534 . . . . 0.0 112.398 171.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 36.0 p-90 -108.14 -17.65 13.97 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 115.445 1.646 . . . . 0.0 115.445 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -72.45 103.22 3.41 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 119.282 0.946 . . . . 0.0 110.113 -167.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.3 p -67.86 120.85 15.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-N 118.589 0.632 . . . . 0.0 110.708 -174.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -107.12 139.12 42.03 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.852 1.261 . . . . 0.0 108.812 166.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 3.6 p80 -157.19 -178.95 7.74 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.53 1.132 . . . . 0.0 111.523 -169.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.6 m -135.49 174.18 10.89 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.318 1.447 . . . . 0.0 111.608 177.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -112.21 -27.62 8.27 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.729 1.211 . . . . 0.0 111.747 166.058 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.8 m -82.2 -6.16 59.01 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.534 1.134 . . . . 0.0 113.538 171.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -133.75 165.26 25.37 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 128.231 2.613 . . . . 0.0 108.794 163.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 49.3 t-20 -136.94 65.79 1.49 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.142 0.977 . . . . 0.0 111.947 -179.17 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -156.17 123.99 2.82 Favored Pre-proline 0 CA--C 1.549 0.906 0 C-N-CA 125.015 1.326 . . . . 0.0 109.43 173.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -88.6 168.21 5.98 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.73 2.953 . . . . 0.0 112.634 -173.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 44.4 p90 -139.19 132.71 30.32 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.887 0.875 . . . . 0.0 110.759 156.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -86.73 116.51 24.87 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.943 0.897 . . . . 0.0 109.242 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -101.19 142.62 32.35 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.567 1.147 . . . . 0.0 112.61 -165.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 58.5 t-20 -98.53 114.78 65.68 Favored Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 124.975 1.31 . . . . 0.0 109.3 166.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -81.34 -23.13 5.31 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 123.371 2.714 . . . . 0.0 114.298 178.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.85 -33.11 46.16 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.384 0.993 . . . . 0.0 112.115 -176.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 70.9 m -134.56 110.74 9.54 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 126.201 1.8 . . . . 0.0 106.36 170.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.3 mtt85 -57.24 106.9 0.37 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.615 0.766 . . . . 0.0 111.025 -172.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -166.6 153.65 9.24 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.208 1.803 . . . . 0.0 109.896 -168.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 97.4 p -124.11 163.64 21.08 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 114.439 1.274 . . . . 0.0 114.439 178.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.37 152.05 48.07 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 128.632 2.773 . . . . 0.0 108.483 176.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -125.3 -26.88 3.56 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -153.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 -154.15 170.49 8.36 Favored Pre-proline 0 CA--C 1.552 1.033 0 C-N-CA 130.181 3.392 . . . . 0.0 106.316 177.286 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -54.11 122.05 10.74 Favored 'Trans proline' 0 CA--C 1.546 1.118 0 C-N-CA 122.803 2.335 . . . . 0.0 112.129 172.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -90.29 -162.1 0.11 Allowed 'Trans proline' 0 CA--C 1.546 1.082 0 C-N-CA 124.215 3.276 . . . . 0.0 110.658 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -102.1 -27.06 13.13 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -178.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -80.87 10.1 5.49 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 125.637 1.575 . . . . 0.0 113.19 177.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -77.08 -177.94 4.75 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 129.687 3.195 . . . . 0.0 112.924 -177.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -90.42 -54.27 4.08 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-O 122.975 1.369 . . . . 0.0 109.548 -175.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.464 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 8.7 ttp 86.6 -43.0 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 129.711 3.204 . . . . 0.0 114.078 170.504 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -64.8 -48.37 74.7 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 121.494 1.952 . . . . 0.0 111.904 178.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 16.0 m -60.72 -21.58 63.09 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 125.656 1.582 . . . . 0.0 111.463 167.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.464 ' HB3' ' HA ' ' A' ' 42' ' ' MET . 11.1 tp -93.69 -21.66 19.21 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 118.014 -0.993 . . . . 0.0 111.197 -170.576 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.488 ' HE2' ' HA ' ' A' ' 46' ' ' LYS . 7.9 mmpt? -60.97 -40.62 94.09 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 120.889 1.677 . . . . 0.0 111.229 171.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.7 ptt? -67.88 6.95 0.59 Allowed 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 172.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -124.11 -44.4 2.04 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.106 1.762 . . . . 0.0 112.572 172.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 92.4 mtp -66.25 -24.67 66.63 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.819 2.048 . . . . 0.0 112.496 177.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -128.61 158.44 38.48 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.588 1.555 . . . . 0.0 111.772 172.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 87.1 m . . . . . 0 N--CA 1.474 0.755 0 C-N-CA 125.167 1.387 . . . . 0.0 108.625 168.608 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.0 m . . . . . 0 N--CA 1.485 1.315 0 CA-C-O 120.371 0.129 . . . . 0.0 110.87 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -84.1 122.59 29.02 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 122.07 -0.393 . . . . 0.0 110.351 172.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.476 ' HB ' ' H ' ' A' ' 7' ' ' LEU . 73.7 p -126.5 146.68 50.02 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.268 1.427 . . . . 0.0 108.396 168.024 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.522 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -80.94 16.32 16.22 Favored Glycine 0 CA--C 1.532 1.148 0 N-CA-C 115.537 0.975 . . . . 0.0 115.537 150.433 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.476 ' H ' ' HB ' ' A' ' 5' ' ' THR . 13.4 mt -68.82 157.41 88.86 Favored Pre-proline 0 CA--C 1.548 0.894 0 CA-C-N 119.995 1.898 . . . . 0.0 110.292 -176.037 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -73.98 -170.48 0.71 Allowed 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 122.927 2.418 . . . . 0.0 109.494 177.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.43 -23.15 9.16 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -175.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -88.45 77.47 1.82 Allowed Glycine 0 CA--C 1.527 0.833 0 C-N-CA 126.173 1.844 . . . . 0.0 111.864 165.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 1.7 p90 -110.83 -8.69 14.51 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 -177.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -89.18 110.25 21.02 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 120.228 1.376 . . . . 0.0 111.338 -172.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.6 p -61.15 136.72 24.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 O-C-N 121.101 -1.0 . . . . 0.0 112.658 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -133.28 112.97 12.1 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.892 1.677 . . . . 0.0 109.848 174.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 31.1 p80 -103.77 155.2 18.78 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.415 1.086 . . . . 0.0 112.122 173.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 99.4 p -161.35 158.2 26.57 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 125.126 1.371 . . . . 0.0 110.707 -172.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.9 p30 -75.27 -18.91 59.96 Favored 'General case' 0 CA--C 1.548 0.878 0 O-C-N 120.416 -1.428 . . . . 0.0 113.538 177.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.7 m -75.86 -30.05 58.76 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.456 1.502 . . . . 0.0 112.811 -175.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -109.08 146.11 34.54 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.262 1.425 . . . . 0.0 111.239 -176.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -88.69 12.29 15.22 Favored 'General case' 0 CA--C 1.555 1.15 0 N-CA-C 114.313 1.227 . . . . 0.0 114.313 -178.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -166.33 159.26 12.16 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 127.335 2.254 . . . . 0.0 109.338 172.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -75.16 169.45 22.53 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.964 2.443 . . . . 0.0 111.576 -178.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 52.9 p90 -126.49 148.05 49.74 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.404 1.082 . . . . 0.0 111.125 168.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -103.73 107.25 18.03 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.582 0.753 . . . . 0.0 109.836 -175.341 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -95.3 149.75 21.0 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.929 1.692 . . . . 0.0 112.959 -165.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 61.0 t-20 -99.34 113.73 65.04 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 125.135 1.374 . . . . 0.0 110.018 171.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.2 -29.67 14.06 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.871 2.381 . . . . 0.0 113.533 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -80.91 -38.24 28.25 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -171.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 92.2 m -127.85 138.92 52.87 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.264 1.826 . . . . 0.0 107.898 169.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 84.8 mtm-85 -61.67 104.43 0.43 Allowed 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.127 0.876 . . . . 0.0 111.071 178.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -163.62 153.56 15.16 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.915 1.286 . . . . 0.0 111.983 178.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 31.4 t -133.69 152.75 51.96 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.369 1.467 . . . . 0.0 111.093 176.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.7 tpp180 -128.0 136.82 51.81 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.612 1.565 . . . . 0.0 110.486 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -126.11 0.88 7.19 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.587 1.555 . . . . 0.0 113.324 -157.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -169.17 156.28 6.69 Favored Pre-proline 0 CA--C 1.544 0.714 0 C-N-CA 128.772 2.829 . . . . 0.0 107.69 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -62.09 113.37 1.85 Allowed 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.282 2.655 . . . . 0.0 110.483 175.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -85.56 159.28 10.8 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.773 2.315 . . . . 0.0 112.253 -171.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.48 -22.02 41.2 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 178.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -81.36 -15.32 55.63 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 126.279 1.832 . . . . 0.0 113.797 -179.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.62 179.01 4.97 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.597 1.559 . . . . 0.0 112.989 -170.283 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -130.12 51.33 2.11 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 122.105 0.955 . . . . 0.0 111.363 -160.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.503 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 32.6 mtt -27.3 -42.28 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 128.195 2.598 . . . . 0.0 116.113 169.62 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -48.24 -42.44 30.39 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 121.316 1.871 . . . . 0.0 113.751 173.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.3 m -82.87 -26.25 31.76 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 127.216 2.207 . . . . 0.0 112.399 173.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.522 HD13 ' N ' ' A' ' 6' ' ' GLY . 43.9 tp -109.9 -16.51 13.84 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 124.423 1.089 . . . . 0.0 112.244 -151.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.33 -34.17 66.32 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.673 -1.267 . . . . 0.0 111.336 159.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.7 mmt -60.9 -22.31 64.21 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.614 0.766 . . . . 0.0 112.751 173.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -103.51 -36.05 8.1 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.306 1.842 . . . . 0.0 112.801 -177.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 29.2 mtp -95.34 -1.37 51.38 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.046 1.738 . . . . 0.0 114.824 -178.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -151.11 67.24 0.91 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.188 1.795 . . . . 0.0 111.686 170.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 2.1 t . . . . . 0 N--CA 1.477 0.905 0 N-CA-C 115.139 1.533 . . . . 0.0 115.139 -172.095 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 3.4 m . . . . . 0 N--CA 1.476 0.844 0 N-CA-C 110.606 -0.146 . . . . 0.0 110.606 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 -69.61 123.46 21.39 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 121.777 -0.577 . . . . 0.0 110.386 175.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 73.9 p -127.99 149.69 50.24 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.666 1.586 . . . . 0.0 108.304 173.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -77.57 6.04 48.25 Favored Glycine 0 CA--C 1.529 0.938 0 CA-C-O 118.223 -1.321 . . . . 0.0 115.125 155.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 27.9 mt -62.13 150.2 84.58 Favored Pre-proline 0 CA--C 1.544 0.714 0 CA-C-N 120.141 1.971 . . . . 0.0 111.986 -168.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -70.47 159.95 51.15 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 122.17 1.913 . . . . 0.0 109.868 -176.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -52.31 -35.62 51.02 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 116.717 2.117 . . . . 0.0 116.717 -154.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -93.22 74.0 1.26 Allowed Glycine 0 CA--C 1.524 0.655 0 C-N-CA 125.894 1.711 . . . . 0.0 111.362 -177.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 11.4 p-90 -136.04 154.19 51.12 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.933 1.293 . . . . 0.0 113.556 178.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -169.76 128.07 0.93 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 129.575 3.15 . . . . 0.0 104.578 177.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.9 t -79.93 130.6 35.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 CA-C-N 120.044 1.293 . . . . 0.0 109.814 -171.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.1 mmt180 -138.07 156.95 47.27 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.808 1.243 . . . . 0.0 111.839 177.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 10.7 p-80 -168.59 152.29 5.63 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.243 1.017 . . . . 0.0 113.156 -169.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 82.6 p -171.37 163.68 6.96 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 125.772 1.629 . . . . 0.0 109.987 -170.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -65.25 -5.74 7.86 Favored 'General case' 0 CA--C 1.554 1.128 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 179.485 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.6 t -73.77 -19.96 60.62 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.131 1.772 . . . . 0.0 113.089 170.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.81 138.87 24.65 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 120.436 -1.415 . . . . 0.0 113.905 -178.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -76.11 -40.85 51.98 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.179 0.992 . . . . 0.0 112.854 -170.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 7.9 mp -100.92 155.21 36.58 Favored Pre-proline 0 CA--C 1.54 0.573 0 C-N-CA 125.157 1.383 . . . . 0.0 109.91 169.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -63.29 155.21 63.2 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 122.91 2.407 . . . . 0.0 111.113 175.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 34.0 p90 -116.04 140.87 48.83 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 125.832 1.653 . . . . 0.0 109.429 171.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -94.9 95.67 8.8 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.9 0.857 . . . . 0.0 108.745 -175.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -63.21 137.9 58.37 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.929 1.692 . . . . 0.0 110.171 177.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 56.3 t-20 -82.58 116.9 66.44 Favored Pre-proline 0 CA--C 1.553 1.079 0 O-C-N 121.531 -0.731 . . . . 0.0 110.044 173.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.9 -19.87 34.89 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 123.611 2.874 . . . . 0.0 114.358 -179.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -88.45 -97.71 0.09 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.708 0.803 . . . . 0.0 109.865 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.8 p -63.91 150.54 44.77 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.367 1.467 . . . . 0.0 110.696 171.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -79.74 95.25 5.92 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 121.602 -0.686 . . . . 0.0 109.243 -178.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -159.73 -177.65 6.51 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.223 1.409 . . . . 0.0 110.243 -179.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 80.3 p -158.09 146.15 18.64 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 120.422 -1.424 . . . . 0.0 112.595 177.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 15.8 tpp180 -101.26 131.69 47.15 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 127.071 2.148 . . . . 0.0 108.953 172.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 1.4 m-90 -86.05 -37.38 18.96 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 122.276 1.036 . . . . 0.0 113.476 -163.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -154.11 162.96 25.58 Favored Pre-proline 0 CA--C 1.54 0.577 0 C-N-CA 129.112 2.965 . . . . 0.0 106.709 -167.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -57.95 117.72 4.48 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 122.343 2.029 . . . . 0.0 110.547 176.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.463 ' O ' HG22 ' A' ' 40' ' ' THR . 91.9 Cg_endo -78.79 168.63 20.71 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 124.077 3.185 . . . . 0.0 111.165 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.27 -30.28 69.35 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.648 -0.657 . . . . 0.0 112.656 170.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -65.17 -9.44 23.17 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 127.092 2.157 . . . . 0.0 115.781 -176.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.463 HG22 ' O ' ' A' ' 37' ' ' PRO . 6.2 t -87.72 167.45 13.84 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 126.02 1.728 . . . . 0.0 112.748 -170.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -95.53 54.54 1.59 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 125.506 1.522 . . . . 0.0 110.687 -176.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.472 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 33.5 mtt -30.36 -39.0 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 127.416 2.286 . . . . 0.0 115.921 173.275 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -54.53 -39.19 67.41 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 121.505 1.957 . . . . 0.0 114.01 172.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 84.8 m -82.37 -16.02 50.66 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 127.616 2.366 . . . . 0.0 112.735 172.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.472 ' HB3' ' HA ' ' A' ' 42' ' ' MET . 3.0 tm? -123.48 -20.17 5.65 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.218 -0.926 . . . . 0.0 112.833 -151.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.63 -26.34 66.95 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 120.16 -1.588 . . . . 0.0 111.524 156.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 4.4 mmt -67.09 -19.55 65.66 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.758 0.823 . . . . 0.0 112.906 170.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -104.39 -54.02 2.61 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.31 1.444 . . . . 0.0 112.139 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 68.5 mmm -65.48 -17.43 64.55 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.598 1.959 . . . . 0.0 113.448 -179.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -139.14 178.93 6.82 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.337 1.855 . . . . 0.0 110.197 172.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 20.2 p . . . . . 0 N--CA 1.476 0.871 0 C-N-CA 124.369 1.067 . . . . 0.0 112.265 -172.604 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.477 0.923 0 CA-C-O 120.948 0.404 . . . . 0.0 111.94 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -82.94 93.78 7.6 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.283 1.033 . . . . 0.0 110.337 172.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.5 p -100.15 135.0 42.25 Favored 'General case' 0 CA--C 1.506 -0.731 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 176.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.52 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -76.29 26.39 1.55 Allowed Glycine 0 CA--C 1.532 1.127 0 CA-C-O 117.924 -1.487 . . . . 0.0 116.101 151.207 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 16.0 mt -71.58 160.36 82.81 Favored Pre-proline 0 CA--C 1.547 0.84 0 CA-C-N 121.135 2.468 . . . . 0.0 110.533 -178.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -72.94 168.98 23.28 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 120.992 1.128 . . . . 0.0 111.147 -175.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.35 -21.15 5.27 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 118.305 2.706 . . . . 0.0 118.305 -157.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -138.32 94.34 0.21 Allowed Glycine 0 N--CA 1.468 0.777 0 C-N-CA 124.87 1.224 . . . . 0.0 112.692 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 33.5 p-90 -135.06 159.59 41.02 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.095 1.358 . . . . 0.0 114.028 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -150.43 150.28 31.15 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 127.418 2.287 . . . . 0.0 107.829 166.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.3 p -87.85 146.75 5.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 CA-C-N 120.774 1.625 . . . . 0.0 110.852 172.342 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -127.98 113.17 15.49 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.73 1.612 . . . . 0.0 110.779 174.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 45.1 p-80 -78.7 149.61 32.73 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.659 0.784 . . . . 0.0 110.92 160.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.9 t -162.81 132.59 4.39 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 121.27 -0.894 . . . . 0.0 112.015 178.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 10.5 m-20 -68.28 -7.92 35.04 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.708 1.203 . . . . 0.0 113.337 176.37 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.8 t -75.59 -19.5 59.21 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.956 1.303 . . . . 0.0 112.833 167.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -116.78 161.02 19.92 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.67 1.588 . . . . 0.0 111.863 -170.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -89.69 -39.1 13.41 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.625 0.77 . . . . 0.0 112.247 173.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -104.69 176.43 1.75 Allowed Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 127.127 2.171 . . . . 0.0 110.102 176.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -69.58 157.91 59.06 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.456 2.104 . . . . 0.0 110.832 155.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 47.6 p90 -120.07 163.89 16.98 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.889 0.876 . . . . 0.0 109.963 157.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.9 m-85 -101.61 137.88 39.33 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 120.938 -1.102 . . . . 0.0 110.973 176.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -97.42 150.59 20.86 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.724 1.209 . . . . 0.0 109.977 169.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -115.2 99.13 51.95 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 124.486 1.114 . . . . 0.0 110.97 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -69.31 -22.75 33.7 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 122.419 2.079 . . . . 0.0 115.05 -173.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -75.81 -41.58 52.36 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 119.762 1.164 . . . . 0.0 113.517 -177.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 23.0 m -131.19 100.42 5.19 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 168.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -47.82 110.12 0.29 Allowed 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.533 1.533 . . . . 0.0 112.198 -171.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -174.23 177.14 2.34 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 127.834 2.453 . . . . 0.0 107.839 -169.08 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 69.5 p -117.69 171.53 7.97 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.898 -1.127 . . . . 0.0 112.846 170.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.5 139.69 40.69 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 127.13 2.172 . . . . 0.0 109.103 175.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -126.02 -46.57 1.67 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.155 -0.929 . . . . 0.0 112.444 -152.228 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -144.56 150.84 48.78 Favored Pre-proline 0 CA--C 1.542 0.657 0 C-N-CA 127.917 2.487 . . . . 0.0 107.478 -179.438 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -56.53 115.38 2.44 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 123.597 2.865 . . . . 0.0 112.956 -159.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -74.43 163.81 35.38 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 123.657 2.905 . . . . 0.0 112.147 -172.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.11 -21.85 65.84 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 -172.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -78.82 -21.38 47.79 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.127 1.371 . . . . 0.0 112.899 172.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -71.18 156.47 39.53 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.528 1.531 . . . . 0.0 112.926 -170.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -108.95 49.53 0.81 Allowed 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.544 1.538 . . . . 0.0 110.723 -164.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.479 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 72.3 mtm -25.29 -47.42 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 127.029 2.132 . . . . 0.0 115.296 173.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -50.19 -46.82 54.64 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 121.694 2.043 . . . . 0.0 114.5 174.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 99.2 m -68.39 -38.44 81.34 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.189 1.796 . . . . 0.0 111.665 169.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.52 HD13 ' N ' ' A' ' 6' ' ' GLY . 54.2 tp -94.27 -16.68 23.36 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 124.67 1.188 . . . . 0.0 110.964 -153.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.09 -28.78 66.82 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 120.512 -1.367 . . . . 0.0 112.093 161.23 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 20.3 mmt -65.46 -16.66 63.87 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 119.633 1.106 . . . . 0.0 112.509 172.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -105.61 -44.49 4.67 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.185 1.794 . . . . 0.0 112.701 177.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.6 mtp -78.61 -8.04 58.22 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.842 1.657 . . . . 0.0 113.607 -176.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -130.96 153.83 48.78 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.154 1.382 . . . . 0.0 112.044 175.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 9.7 t . . . . . 0 N--CA 1.476 0.842 0 C-N-CA 124.49 1.116 . . . . 0.0 111.766 179.175 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 15.9 m . . . . . 0 N--CA 1.476 0.84 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -81.45 136.06 35.65 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.983 0.913 . . . . 0.0 110.561 164.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 62.9 p -134.84 133.15 39.43 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.659 1.584 . . . . 0.0 108.43 178.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.568 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -66.58 16.41 0.27 Allowed Glycine 0 CA--C 1.531 1.038 0 N-CA-C 115.523 0.969 . . . . 0.0 115.523 157.291 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 28.3 mt -67.23 156.66 87.59 Favored Pre-proline 0 CA--C 1.549 0.92 0 CA-C-N 119.909 1.855 . . . . 0.0 110.648 -176.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -80.35 -133.08 0.01 OUTLIER 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 123.17 2.58 . . . . 0.0 110.017 -179.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.99 -26.12 67.4 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -102.22 86.65 0.58 Allowed Glycine 0 C--N 1.339 0.711 0 C-N-CA 126.275 1.893 . . . . 0.0 109.534 176.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 69.5 p-90 -127.06 -28.01 2.93 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 117.226 2.306 . . . . 0.0 117.226 -167.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -83.96 112.04 19.81 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.313 0.961 . . . . 0.0 110.489 -168.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 24.1 t -61.84 132.2 27.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 O-C-N 121.615 -0.678 . . . . 0.0 111.048 -177.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 60.7 mmt-85 -132.65 132.69 42.7 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.787 1.635 . . . . 0.0 110.567 174.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -130.7 2.51 4.47 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 115.065 1.506 . . . . 0.0 115.065 -172.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.6 t -72.71 82.11 1.14 Allowed 'General case' 0 N--CA 1.473 0.682 0 O-C-N 120.855 -1.153 . . . . 0.0 108.054 156.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -178.19 116.57 0.08 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 127.335 2.254 . . . . 0.0 109.381 -165.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.2 m -76.5 -2.18 30.94 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 115.901 1.815 . . . . 0.0 115.901 -170.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.489 ' HG3' ' H ' ' A' ' 20' ' ' ASN . 2.0 tppp? -71.42 179.64 2.87 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 119.522 1.056 . . . . 0.0 111.983 178.257 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.489 ' H ' ' HG3' ' A' ' 19' ' ' LYS . 10.6 m120 -61.99 -43.11 99.54 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.7 1.6 . . . . 0.0 113.729 -175.042 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 10.3 mp -122.96 162.68 37.74 Favored Pre-proline 0 CA--C 1.547 0.827 0 C-N-CA 126.415 1.886 . . . . 0.0 110.866 -177.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.86 159.96 50.93 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 123.184 2.589 . . . . 0.0 111.098 168.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 34.1 p90 -108.21 146.08 33.31 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.504 1.121 . . . . 0.0 111.627 177.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -92.25 101.16 13.66 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 121.452 0.644 . . . . 0.0 109.377 177.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -67.13 145.86 54.85 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.43 1.092 . . . . 0.0 111.8 -178.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -104.71 85.08 1.08 Allowed Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 125.944 1.697 . . . . 0.0 109.828 178.075 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -62.39 -24.61 75.76 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.601 2.201 . . . . 0.0 115.694 -170.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.33 -13.64 60.13 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.129 1.159 . . . . 0.0 114.129 -179.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.7 m -169.54 124.44 0.82 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 127.082 2.153 . . . . 0.0 108.375 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 24.8 mmt85 -52.15 98.08 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.825 0 CA-C-O 122.702 1.239 . . . . 0.0 112.838 -174.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -163.67 178.05 8.24 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 127.572 2.349 . . . . 0.0 109.825 -174.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.3 p -149.48 174.01 12.95 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 120.531 -1.355 . . . . 0.0 113.877 173.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 20.3 tpp180 -138.5 158.7 43.76 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 128.218 2.607 . . . . 0.0 107.948 171.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -140.48 -58.73 0.53 Allowed 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.777 -0.577 . . . . 0.0 111.305 -158.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -107.55 153.89 41.09 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 126.003 1.721 . . . . 0.0 109.446 166.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -69.17 121.95 8.78 Favored 'Trans proline' 0 CA--C 1.544 1.018 0 C-N-CA 123.337 2.691 . . . . 0.0 112.059 -167.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -83.88 166.27 13.24 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 124.47 3.447 . . . . 0.0 112.358 -172.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.32 -20.81 64.77 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 115.236 1.569 . . . . 0.0 115.236 -174.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -80.96 -7.54 59.55 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 125.177 1.391 . . . . 0.0 113.773 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -74.59 170.12 16.4 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.151 1.78 . . . . 0.0 114.726 -168.311 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -105.18 50.69 0.78 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.811 1.645 . . . . 0.0 110.965 -171.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.442 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 10.2 mtm -30.02 -35.54 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 127.164 2.186 . . . . 0.0 116.238 172.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.1 -27.35 69.04 Favored 'General case' 0 CA--C 1.553 1.092 0 CA-C-N 122.734 2.516 . . . . 0.0 114.183 175.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 69.4 m -94.52 -5.16 46.67 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 128.119 2.568 . . . . 0.0 112.297 171.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.568 HD13 ' N ' ' A' ' 6' ' ' GLY . 26.1 tp -131.07 -20.2 2.78 Favored 'General case' 0 C--O 1.219 -0.528 0 O-C-N 120.844 -1.16 . . . . 0.0 111.69 -155.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.01 -36.32 76.96 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 120.607 1.549 . . . . 0.0 111.308 157.092 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 15.2 ptt? -67.65 -9.68 45.47 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.347 1.059 . . . . 0.0 113.485 171.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -104.66 -46.32 4.37 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.037 1.335 . . . . 0.0 112.077 173.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 83.4 mmm -72.85 -8.61 56.37 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 127.493 2.317 . . . . 0.0 113.536 -175.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -161.42 146.98 13.89 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.734 2.014 . . . . 0.0 109.679 166.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 22.3 m . . . . . 0 N--CA 1.474 0.77 0 O-C-N 121.441 -0.787 . . . . 0.0 110.304 -178.0 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 15.7 t . . . . . 0 N--CA 1.472 0.653 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 27.4 m120 -59.39 120.95 10.29 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 122.925 0.49 . . . . 0.0 110.731 173.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 75.5 p -113.11 149.48 33.47 Favored 'General case' 0 CA--C 1.509 -0.623 0 C-N-CA 125.308 1.443 . . . . 0.0 108.1 171.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.686 ' H ' HD13 ' A' ' 45' ' ' LEU . . . -84.65 9.52 64.88 Favored Glycine 0 CA--C 1.534 1.266 0 CA-C-N 113.827 -1.533 . . . . 0.0 115.749 158.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.4 mt -65.59 150.56 95.93 Favored Pre-proline 0 CA--C 1.546 0.801 0 CA-C-N 118.946 1.373 . . . . 0.0 110.925 -168.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -77.45 177.58 8.67 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.896 1.731 . . . . 0.0 110.978 -175.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.93 -32.94 55.25 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 115.331 1.604 . . . . 0.0 115.331 -170.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -79.1 42.54 2.35 Favored Glycine 0 CA--C 1.533 1.175 0 CA-C-O 118.443 -1.198 . . . . 0.0 115.118 -177.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 1.3 p-90 -122.95 152.54 40.75 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 -176.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 179.51 119.91 0.05 Allowed 'General case' 0 CA--C 1.54 0.569 1 C-N-CA 131.753 4.021 . . . . 0.0 104.085 175.55 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 5.7 t -78.59 126.93 38.97 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 120.604 1.547 . . . . 0.0 110.979 -169.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -119.43 113.7 21.18 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.451 1.501 . . . . 0.0 110.319 172.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -88.03 163.68 16.16 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.244 1.017 . . . . 0.0 112.049 165.163 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.4 t -159.64 144.44 15.25 Favored 'General case' 0 N--CA 1.467 0.409 0 O-C-N 120.924 -1.11 . . . . 0.0 113.022 -168.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 60.5 m-20 -71.89 -7.74 50.26 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.694 0.798 . . . . 0.0 113.066 169.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.0 m -91.7 -14.64 29.67 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 120.787 -1.196 . . . . 0.0 113.511 175.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -123.71 146.79 48.0 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.637 1.108 . . . . 0.0 113.425 -162.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -81.6 -9.38 59.69 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 175.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 23.3 mt -140.98 167.9 15.96 Favored Pre-proline 0 CA--C 1.539 0.553 0 C-N-CA 126.936 2.095 . . . . 0.0 109.117 176.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -68.41 167.04 23.5 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 122.118 1.879 . . . . 0.0 110.207 163.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 39.8 p90 -126.84 157.85 38.19 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.889 1.275 . . . . 0.0 109.416 160.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -103.09 115.16 30.06 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.336 -0.852 . . . . 0.0 109.663 -177.226 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -76.03 134.29 40.14 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.569 1.148 . . . . 0.0 110.312 176.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 60.2 t-20 -87.54 114.23 57.89 Favored Pre-proline 0 CA--C 1.547 0.839 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 168.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -74.14 -34.64 4.75 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.072 1.848 . . . . 0.0 112.569 176.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -80.15 -19.23 47.69 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.023 1.12 . . . . 0.0 114.023 -171.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 26.3 m -147.63 143.83 27.97 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.847 1.659 . . . . 0.0 108.725 -174.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -70.52 44.07 0.07 Allowed 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 116.863 2.171 . . . . 0.0 116.863 -170.67 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.411 ' HG3' ' H ' ' A' ' 32' ' ' SER . 6.3 tp10 -129.07 -175.64 3.62 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.815 2.046 . . . . 0.0 111.312 -176.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.411 ' H ' ' HG3' ' A' ' 31' ' ' GLU . 78.1 p -145.68 164.96 30.15 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 126.068 1.747 . . . . 0.0 110.804 172.498 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.3 tpp180 -118.64 132.34 56.18 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.66 1.584 . . . . 0.0 109.307 177.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 1.8 m-90 -98.84 -47.54 5.25 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.472 0.709 . . . . 0.0 112.278 -156.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -128.56 173.31 5.73 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 127.259 2.224 . . . . 0.0 108.397 165.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -57.67 120.21 7.97 Favored 'Trans proline' 0 CA--C 1.55 1.313 0 C-N-CA 122.509 2.139 . . . . 0.0 111.872 172.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.421 ' O ' HG22 ' A' ' 40' ' ' THR . 71.5 Cg_endo -81.18 167.21 17.95 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 125.211 3.941 . . . . 0.0 113.025 -173.261 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -69.93 -4.65 21.54 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 177.314 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -93.66 -6.08 47.18 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 127.469 2.307 . . . . 0.0 113.025 177.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.421 HG22 ' O ' ' A' ' 37' ' ' PRO . 2.1 t -85.54 176.35 8.27 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.28 1.432 . . . . 0.0 113.171 -171.708 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -107.67 36.79 2.62 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.287 1.035 . . . . 0.0 111.8 -166.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 56.7 mtt -18.41 -43.33 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 130.29 3.436 . . . . 0.0 119.186 -173.297 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -52.28 -45.73 65.58 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-N 122.121 2.237 . . . . 0.0 112.222 170.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 23.6 m -74.65 -15.46 60.81 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 127.457 2.303 . . . . 0.0 112.894 173.221 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.686 HD13 ' H ' ' A' ' 6' ' ' GLY . 3.5 mm? -88.67 -17.17 30.56 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 120.127 1.33 . . . . 0.0 112.08 167.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.11 -17.74 62.56 Favored 'General case' 0 CA--C 1.553 1.062 0 CA-C-N 121.377 1.898 . . . . 0.0 111.931 -174.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 24.0 ptp -82.88 -7.52 59.65 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 127.864 2.466 . . . . 0.0 114.14 167.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.46 ' CD2' HD12 ' A' ' 45' ' ' LEU . 54.2 t80 -116.07 -55.07 2.44 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.65 1.98 . . . . 0.0 112.833 -173.19 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 93.5 mmm -68.85 5.77 1.04 Allowed 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 127.976 2.51 . . . . 0.0 113.439 173.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -158.66 151.06 21.69 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 128.346 2.659 . . . . 0.0 109.316 171.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 46.1 p . . . . . 0 N--CA 1.48 1.035 0 C-N-CA 125.828 1.651 . . . . 0.0 114.315 -166.489 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 25.9 m . . . . . 0 N--CA 1.48 1.031 0 CA-C-O 121.267 0.556 . . . . 0.0 111.854 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -81.64 136.51 35.52 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.291 1.036 . . . . 0.0 109.735 165.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 67.4 p -146.32 150.91 36.64 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-O 122.204 1.002 . . . . 0.0 110.434 170.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.67 ' H ' HD13 ' A' ' 45' ' ' LEU . . . -92.42 18.71 53.93 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-N 113.974 -1.466 . . . . 0.0 114.796 156.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.453 ' HG ' HD11 ' A' ' 45' ' ' LEU . 16.5 mt -70.38 148.93 95.73 Favored Pre-proline 0 CA--C 1.546 0.796 0 CA-C-N 119.61 1.705 . . . . 0.0 110.919 -170.401 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -74.61 158.0 44.0 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 121.978 1.785 . . . . 0.0 110.538 -175.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.75 -11.77 5.86 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 117.195 2.294 . . . . 0.0 117.195 -160.209 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -94.37 59.66 1.91 Allowed Glycine 0 CA--C 1.53 0.995 0 C-N-CA 125.148 1.356 . . . . 0.0 111.871 171.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 9.7 p-90 -133.24 165.07 25.65 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 115.534 1.679 . . . . 0.0 115.534 -177.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 176.09 172.97 0.36 Allowed 'General case' 0 CA--C 1.543 0.676 1 C-N-CA 132.564 4.345 . . . . 0.0 106.127 -177.026 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.5 t -123.99 142.99 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 125.371 1.468 . . . . 0.0 110.072 -178.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -138.68 149.09 44.76 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.935 1.694 . . . . 0.0 110.596 177.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -141.94 162.74 34.72 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -169.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.4 t -173.37 151.29 1.97 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.283 1.833 . . . . 0.0 111.714 -177.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -63.95 -15.98 60.45 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.541 1.136 . . . . 0.0 112.525 167.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.4 t -66.27 -13.99 61.28 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.752 1.621 . . . . 0.0 113.921 -177.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.3 ptmt -150.42 161.88 41.64 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.028 1.331 . . . . 0.0 112.87 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -71.9 -35.1 69.61 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 -170.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.3 mp -122.51 173.51 4.15 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 127.431 2.292 . . . . 0.0 111.151 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -75.86 171.27 18.49 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 123.269 2.646 . . . . 0.0 111.737 169.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 46.2 p90 -126.24 162.49 25.32 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.894 1.678 . . . . 0.0 110.731 166.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -105.23 150.13 25.37 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 121.388 -0.82 . . . . 0.0 112.359 -176.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 84.2 t80 -136.13 143.42 44.51 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.515 1.126 . . . . 0.0 112.969 -168.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 62.8 t-20 -95.18 118.0 66.59 Favored Pre-proline 0 CA--C 1.556 1.185 0 C-N-CA 123.198 0.599 . . . . 0.0 111.319 170.222 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -75.15 -19.61 17.37 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.205 2.604 . . . . 0.0 114.414 174.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -93.29 -15.6 25.64 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -172.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 88.5 m -154.02 142.63 20.82 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 128.113 2.565 . . . . 0.0 107.485 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 49.1 mmm-85 -68.17 100.63 1.04 Allowed 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.496 1.044 . . . . 0.0 110.666 177.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -165.73 149.59 8.08 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.099 1.759 . . . . 0.0 110.495 176.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 57.5 p -114.97 -179.47 3.64 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.302 1.041 . . . . 0.0 113.192 169.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 17.8 tpp180 -149.65 137.73 20.46 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.734 1.613 . . . . 0.0 109.801 178.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -129.81 -33.13 1.83 Allowed 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.069 0.948 . . . . 0.0 112.987 -154.253 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -145.43 160.09 46.25 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 129.198 2.999 . . . . 0.0 106.887 177.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -67.69 121.42 8.48 Favored 'Trans proline' 0 CA--C 1.546 1.113 0 C-N-CA 122.008 1.805 . . . . 0.0 112.43 -167.252 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -77.6 165.32 27.23 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 124.063 3.175 . . . . 0.0 111.799 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.63 -41.18 76.7 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 179.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -71.37 -0.99 11.46 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.27 1.428 . . . . 0.0 114.46 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -85.52 157.17 20.49 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.231 1.013 . . . . 0.0 111.404 177.582 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -88.46 -29.38 20.21 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-O 121.934 0.873 . . . . 0.0 113.085 -163.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.488 ' H ' HD23 ' A' ' 45' ' ' LEU . 43.6 mtt 69.57 -43.71 0.53 Allowed 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 129.792 3.237 . . . . 0.0 113.72 176.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -55.99 -52.29 64.72 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 120.009 1.277 . . . . 0.0 110.9 170.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.0 m -75.13 1.24 13.75 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 172.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.67 HD13 ' H ' ' A' ' 6' ' ' GLY . 2.7 mm? -104.12 -22.15 13.46 Favored 'General case' 0 CA--C 1.508 -0.655 0 O-C-N 120.257 -1.527 . . . . 0.0 113.963 169.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.29 -22.92 64.7 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 120.895 1.68 . . . . 0.0 111.082 -176.562 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 22.6 ptp -76.76 -6.12 50.93 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.484 2.314 . . . . 0.0 114.731 168.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . 0.468 ' HD2' HD12 ' A' ' 45' ' ' LEU . 56.6 t80 -122.69 -58.1 1.69 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.21 1.804 . . . . 0.0 113.342 -169.339 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 54.9 mtp -67.66 -47.74 68.66 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.891 1.277 . . . . 0.0 111.178 -175.058 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -88.74 143.64 26.78 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 148.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 2.0 t . . . . . 0 N--CA 1.474 0.771 0 CA-C-O 121.318 0.58 . . . . 0.0 112.431 -176.129 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.5 m . . . . . 0 N--CA 1.473 0.697 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -74.3 143.65 44.89 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.435 1.094 . . . . 0.0 111.765 166.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.8 p -147.27 143.49 28.15 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.524 1.53 . . . . 0.0 109.369 169.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.578 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -82.19 7.67 63.15 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 125.864 1.697 . . . . 0.0 116.231 160.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 15.5 mt -65.11 155.85 82.81 Favored Pre-proline 0 CA--C 1.553 1.088 0 CA-C-N 119.703 1.751 . . . . 0.0 111.228 -169.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -70.16 174.57 9.65 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.071 1.847 . . . . 0.0 111.67 -175.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.11 -9.48 0.4 Allowed 'General case' 0 CA--C 1.554 1.101 0 N-CA-C 117.992 2.59 . . . . 0.0 117.992 -166.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -105.07 63.95 0.31 Allowed Glycine 0 CA--C 1.531 1.092 0 C-N-CA 125.715 1.626 . . . . 0.0 112.143 170.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 66.5 p-90 -109.91 146.75 34.63 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 -171.009 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 169.2 174.14 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.749 1 C-N-CA 132.314 4.245 . . . . 0.0 106.71 173.544 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.6 p -141.36 143.06 28.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 CA-C-N 119.581 1.082 . . . . 0.0 112.289 175.014 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -137.72 162.91 32.63 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.958 1.703 . . . . 0.0 111.189 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -145.86 172.34 13.48 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.98 1.312 . . . . 0.0 112.245 178.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.2 p -157.4 172.74 18.05 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.871 -1.143 . . . . 0.0 113.152 -177.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -73.48 -14.38 61.22 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 121.304 -0.872 . . . . 0.0 112.497 170.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 26.6 m -79.55 -31.04 41.95 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 -171.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -143.6 146.47 33.31 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.308 1.843 . . . . 0.0 110.056 -173.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -79.26 -27.64 42.34 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.222 1.409 . . . . 0.0 112.864 179.14 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -75.62 149.42 83.59 Favored Pre-proline 0 CA--C 1.546 0.824 0 O-C-N 121.4 -0.813 . . . . 0.0 111.043 170.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -73.99 -179.55 4.75 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 123.891 3.061 . . . . 0.0 110.302 167.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 54.1 p90 -135.64 140.81 44.83 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.041 0.936 . . . . 0.0 110.85 159.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -84.58 119.66 25.46 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -90.54 127.96 36.41 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 124.097 0.959 . . . . 0.0 111.699 -169.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 59.7 t-20 -89.94 118.0 68.56 Favored Pre-proline 0 CA--C 1.549 0.931 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 170.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -79.32 -33.91 1.24 Allowed 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.609 2.206 . . . . 0.0 113.034 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -90.77 -18.2 25.35 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -168.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.7 m -138.31 137.56 37.52 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 126.989 2.116 . . . . 0.0 107.643 172.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.25 88.79 0.85 Allowed 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.778 0.831 . . . . 0.0 110.143 -175.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -161.04 170.82 19.75 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.391 1.477 . . . . 0.0 110.383 -172.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 18.4 p -151.01 137.14 18.34 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.296 1.039 . . . . 0.0 111.227 173.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 19.7 tpp180 -99.29 149.38 23.18 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.534 1.934 . . . . 0.0 109.641 -178.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -120.79 -30.0 4.54 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.666 1.186 . . . . 0.0 113.502 -165.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -149.49 153.27 36.79 Favored Pre-proline 0 CA--C 1.541 0.626 0 C-N-CA 126.477 1.911 . . . . 0.0 109.636 -172.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -64.47 117.08 4.16 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 123.932 3.088 . . . . 0.0 112.171 -169.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -78.78 170.76 17.63 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.856 3.037 . . . . 0.0 111.852 -179.446 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.57 -32.7 74.46 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -178.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -76.15 -10.79 59.69 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 -177.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -76.86 178.59 6.74 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 125.977 1.711 . . . . 0.0 114.491 -171.118 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -126.57 58.64 1.39 Allowed 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.408 1.483 . . . . 0.0 111.991 -168.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.473 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 1.8 mpp? -29.62 -40.62 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.075 1.75 . . . . 0.0 114.802 163.608 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 65.3 tt0 -45.51 -46.56 13.95 Favored 'General case' 0 CA--C 1.551 0.996 0 CA-C-N 120.479 1.49 . . . . 0.0 114.436 169.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 98.1 m -86.17 -13.21 47.71 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 127.556 2.342 . . . . 0.0 113.337 175.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.578 HD13 ' N ' ' A' ' 6' ' ' GLY . 37.1 tp -123.94 -17.36 6.31 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 121.3 -0.875 . . . . 0.0 112.211 -151.536 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.34 -39.17 72.39 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.371 -1.456 . . . . 0.0 109.749 153.227 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.8 mmt -63.36 8.13 0.08 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.062 1.745 . . . . 0.0 113.856 171.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -133.75 -44.28 0.81 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.233 1.813 . . . . 0.0 112.46 176.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.1 mtt -85.94 -21.82 27.72 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.719 2.008 . . . . 0.0 114.266 -177.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -165.37 66.29 0.12 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.281 1.832 . . . . 0.0 110.173 -177.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.8 m . . . . . 0 N--CA 1.473 0.696 0 C-N-CA 124.58 1.152 . . . . 0.0 113.768 -159.67 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.1 t . . . . . 0 N--CA 1.479 1.025 0 N-CA-C 109.96 -0.385 . . . . 0.0 109.96 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -70.44 148.55 48.2 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.544 -0.722 . . . . 0.0 111.08 165.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 77.9 p -141.55 150.56 42.26 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.016 1.726 . . . . 0.0 108.057 173.307 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . 0.563 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -87.35 28.8 5.53 Favored Glycine 0 CA--C 1.525 0.671 0 CA-C-O 117.548 -1.695 . . . . 0.0 114.359 154.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.7 mt -76.0 159.65 80.19 Favored Pre-proline 0 CA--C 1.547 0.828 0 CA-C-N 120.333 2.067 . . . . 0.0 110.75 -175.495 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -68.86 174.97 7.94 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 122.644 2.23 . . . . 0.0 111.575 -179.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.61 33.37 0.05 Allowed 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 116.28 1.956 . . . . 0.0 116.28 -167.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -166.08 99.25 0.16 Allowed Glycine 0 CA--C 1.532 1.153 0 C-N-CA 125.968 1.747 . . . . 0.0 111.872 170.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 19.4 p-90 -155.58 147.46 23.28 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 115.208 1.558 . . . . 0.0 115.208 -175.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -159.9 150.52 18.96 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 128.843 2.857 . . . . 0.0 106.809 168.364 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 18.9 t -102.85 120.2 52.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 CA-C-N 120.561 1.528 . . . . 0.0 110.862 -170.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.4 mmp_? -111.86 115.75 29.51 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.572 0.749 . . . . 0.0 111.623 176.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 4.0 p80 -155.74 158.94 39.03 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.775 2.03 . . . . 0.0 110.945 175.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 41.7 p -137.53 170.31 16.29 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.586 0.708 . . . . 0.0 112.815 -173.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -58.87 -24.71 62.52 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.13 0.972 . . . . 0.0 113.452 167.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 67.9 m -91.47 -6.42 52.68 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.205 1.402 . . . . 0.0 113.7 176.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -163.16 111.59 1.27 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.499 1.519 . . . . 0.0 111.034 173.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -64.06 -33.28 75.39 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.714 0.806 . . . . 0.0 112.888 175.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.44 114.3 20.93 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 123.186 0.595 . . . . 0.0 111.239 -167.613 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -77.37 139.61 18.68 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 123.208 2.605 . . . . 0.0 111.425 -172.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 55.9 p90 -105.19 135.34 46.74 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 153.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -90.15 100.4 13.23 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 121.67 -0.644 . . . . 0.0 110.212 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -63.5 129.4 40.03 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.049 1.34 . . . . 0.0 110.979 -179.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 58.4 t-20 -88.29 121.52 70.31 Favored Pre-proline 0 CA--C 1.556 1.193 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 174.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -79.27 -19.96 10.11 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 124.509 3.472 . . . . 0.0 113.559 178.124 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -91.67 -40.74 11.12 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.834 0.854 . . . . 0.0 111.969 -175.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.8 m -120.33 142.23 49.32 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.614 1.966 . . . . 0.0 109.104 175.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 -65.09 97.67 0.26 Allowed 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.277 1.031 . . . . 0.0 110.265 168.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -175.21 158.5 2.4 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.892 2.077 . . . . 0.0 109.542 -172.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 88.1 p -134.16 118.28 17.49 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 120.789 -1.194 . . . . 0.0 112.568 168.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 11.2 tpp180 -70.02 128.5 36.54 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.898 1.679 . . . . 0.0 109.576 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -90.57 -45.76 8.72 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.922 1.289 . . . . 0.0 111.743 -167.061 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -152.67 163.22 24.22 Favored Pre-proline 0 CA--C 1.549 0.919 0 C-N-CA 128.128 2.571 . . . . 0.0 107.898 -165.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -60.63 123.37 12.88 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 122.942 2.428 . . . . 0.0 113.578 -168.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -87.12 162.45 8.63 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 124.612 3.541 . . . . 0.0 113.413 178.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.51 -6.92 2.67 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 125.441 1.496 . . . . 0.0 114.917 172.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -104.89 9.08 34.82 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.344 1.858 . . . . 0.0 113.613 179.302 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -90.13 -179.91 5.77 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.551 1.94 . . . . 0.0 111.314 179.115 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -103.54 -34.12 8.78 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 120.149 -1.594 . . . . 0.0 112.663 -169.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.509 ' HA ' ' HB3' ' A' ' 45' ' ' LEU 0.252 90.3 mtp 60.76 -38.45 0.1 Allowed 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 129.118 2.967 . . . . 0.0 115.577 -170.994 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -64.07 -53.33 51.5 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 122.382 2.355 . . . . 0.0 111.498 -178.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.2 m -65.3 -7.15 12.0 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 125.563 1.545 . . . . 0.0 112.937 170.085 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.563 HD13 ' N ' ' A' ' 6' ' ' GLY . 10.8 tp -112.6 -27.18 8.3 Favored 'General case' 0 C--O 1.217 -0.613 0 O-C-N 120.894 -1.128 . . . . 0.0 112.256 -166.461 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.68 -40.13 96.12 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 120.853 1.661 . . . . 0.0 110.378 170.231 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 14.6 ptm -63.72 -6.96 6.34 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 126.052 1.741 . . . . 0.0 114.941 169.029 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -108.7 -50.47 3.01 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.356 1.463 . . . . 0.0 111.985 174.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 85.1 mtp -62.62 -36.89 84.24 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 127.167 2.187 . . . . 0.0 112.029 -178.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.56 88.08 7.02 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 156.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 15.0 t . . . . . 0 N--CA 1.475 0.818 0 C-N-CA 125.497 1.519 . . . . 0.0 114.591 -165.311 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 32.9 m . . . . . 0 N--CA 1.48 1.047 0 CA-C-O 121.494 0.664 . . . . 0.0 111.541 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -139.49 154.11 47.65 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.678 0.791 . . . . 0.0 109.836 160.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 62.2 p -133.78 126.71 31.2 Favored 'General case' 0 CA--C 1.51 -0.567 0 C-N-CA 124.811 1.244 . . . . 0.0 109.046 -174.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -66.83 5.93 2.24 Favored Glycine 0 CA--C 1.532 1.124 0 C-N-CA 125.229 1.395 . . . . 0.0 114.445 163.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 31.8 mt -63.19 155.98 70.99 Favored Pre-proline 0 CA--C 1.551 0.983 0 CA-C-N 118.917 1.358 . . . . 0.0 110.391 175.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -79.35 -135.62 0.02 OUTLIER 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 123.452 2.768 . . . . 0.0 110.495 -178.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.97 -26.21 66.7 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 120.806 -1.184 . . . . 0.0 114.144 177.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -93.04 83.53 1.09 Allowed Glycine 0 C--N 1.338 0.651 0 C-N-CA 125.609 1.576 . . . . 0.0 109.493 176.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -136.38 -13.18 1.8 Allowed 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 117.583 2.438 . . . . 0.0 117.583 -166.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -92.09 117.85 30.25 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.834 1.197 . . . . 0.0 109.809 -170.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 20.9 t -75.12 123.3 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 O-C-N 121.047 -1.033 . . . . 0.0 110.691 -164.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.6 mmt180 -130.75 153.27 49.19 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.05 1.34 . . . . 0.0 110.259 176.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 32.1 p-80 -144.02 169.77 17.19 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.375 1.07 . . . . 0.0 112.78 -173.1 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.2 t -162.62 149.85 13.47 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.1 1.36 . . . . 0.0 111.521 -176.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.2 m120 -67.23 -19.22 65.5 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.236 -0.915 . . . . 0.0 111.925 170.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.5 m -88.31 9.84 21.82 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 125.136 1.375 . . . . 0.0 113.368 177.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.8 tptm -147.84 125.15 11.55 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.912 1.285 . . . . 0.0 111.196 179.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 53.7 m-80 -66.61 -8.07 24.73 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 115.782 1.771 . . . . 0.0 115.782 -169.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -157.53 165.53 18.53 Favored Pre-proline 0 CA--C 1.549 0.918 0 C-N-CA 126.8 2.04 . . . . 0.0 109.999 -173.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -77.99 159.55 30.62 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 123.152 2.568 . . . . 0.0 111.995 -175.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 51.5 p90 -123.69 143.61 50.16 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 126.048 1.739 . . . . 0.0 110.225 171.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -97.55 100.37 11.78 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.537 -0.727 . . . . 0.0 109.98 -173.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -63.55 137.01 57.96 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.887 1.675 . . . . 0.0 112.233 -173.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 57.5 t-20 -95.97 122.41 58.45 Favored Pre-proline 0 CA--C 1.547 0.836 0 C-N-CA 124.061 0.944 . . . . 0.0 108.793 167.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -78.34 -36.69 0.89 Allowed 'Trans proline' 0 CA--C 1.534 0.514 0 C-N-CA 122.498 2.132 . . . . 0.0 113.093 176.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -85.25 -12.63 52.05 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -169.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 30.3 m -135.19 141.14 45.8 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.608 1.963 . . . . 0.0 108.282 173.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -66.73 89.15 0.15 Allowed 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.476 1.035 . . . . 0.0 109.651 170.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -171.92 179.13 2.8 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.664 1.585 . . . . 0.0 110.114 -172.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.2 p -160.5 173.77 15.06 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.851 1.66 . . . . 0.0 109.825 172.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.6 tpp180 -125.88 138.31 53.79 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.368 1.067 . . . . 0.0 110.608 -172.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -104.71 -32.06 9.06 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.34 1.456 . . . . 0.0 112.99 -163.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -143.72 162.06 43.35 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 128.476 2.71 . . . . 0.0 107.866 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.67 114.76 1.99 Allowed 'Trans proline' 0 CA--C 1.549 1.273 0 C-N-CA 123.306 2.671 . . . . 0.0 111.218 166.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -79.09 -166.9 0.44 Allowed 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 124.776 3.651 . . . . 0.0 111.974 -177.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -81.61 -18.44 44.71 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 177.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -95.01 7.58 45.64 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.118 1.767 . . . . 0.0 113.355 -174.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.2 t -96.73 162.02 13.61 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 126.58 1.952 . . . . 0.0 112.836 -174.188 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -89.25 -34.47 16.61 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 121.287 0.565 . . . . 0.0 112.129 -157.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . 0.26 28.6 mtt 61.55 -37.03 0.11 Allowed 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 130.148 3.379 . . . . 0.0 115.675 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -60.82 -29.07 69.25 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.838 1.255 . . . . 0.0 112.065 168.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.4 m -102.86 26.16 8.43 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.681 1.592 . . . . 0.0 112.109 168.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 76.4 mt -129.4 -20.09 3.36 Favored 'General case' 0 CA--C 1.507 -0.674 0 O-C-N 119.507 -1.995 . . . . 0.0 115.554 170.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.74 -27.1 67.34 Favored 'General case' 0 CA--C 1.556 1.178 0 CA-C-N 123.092 2.678 . . . . 0.0 111.743 177.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 26.3 ptm -59.24 -14.62 11.6 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 128.053 2.541 . . . . 0.0 115.21 164.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -127.36 -57.15 1.3 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.688 1.595 . . . . 0.0 113.122 -165.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 67.7 mmm -66.04 -10.87 44.1 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 127.361 2.265 . . . . 0.0 114.981 -175.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.02 110.62 5.13 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.003 1.321 . . . . 0.0 109.527 169.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 55.4 m . . . . . 0 N--CA 1.475 0.815 0 C-N-CA 124.936 1.294 . . . . 0.0 113.808 -162.845 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.2 t . . . . . 0 N--CA 1.476 0.854 0 N-CA-C 109.696 -0.483 . . . . 0.0 109.696 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 57.5 mtt -146.0 66.76 1.2 Allowed 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.521 1.128 . . . . 0.0 111.124 -161.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 22.8 m -123.96 158.46 30.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 125.532 1.533 . . . . 0.0 113.167 -171.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 22.0 m120 -94.37 133.83 37.53 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.312 1.045 . . . . 0.0 110.468 168.203 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.445 HG22 ' CD2' ' A' ' 48' ' ' TYR . 24.6 p -134.89 128.26 32.27 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 125.471 1.509 . . . . 0.0 108.635 174.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -73.25 47.65 1.37 Allowed Glycine 0 CA--C 1.525 0.69 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.871 158.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.8 mt -82.83 171.15 12.4 Favored Pre-proline 0 CA--C 1.545 0.765 0 O-C-N 121.586 -0.95 . . . . 0.0 109.711 171.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -66.39 153.0 79.68 Favored 'Trans proline' 0 CA--C 1.538 0.681 0 N-CA-C 108.656 -1.325 . . . . 0.0 108.656 171.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.28 -25.65 3.96 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 116.067 1.877 . . . . 0.0 116.067 -165.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -77.36 57.03 3.72 Favored Glycine 0 CA--C 1.532 1.149 0 C-N-CA 125.028 1.299 . . . . 0.0 112.612 166.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 2.4 p90 -96.33 149.84 21.23 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.368 1.067 . . . . 0.0 113.343 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 174.42 99.16 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 130.089 3.355 . . . . 0.0 107.27 168.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 39.4 t -69.46 115.53 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.171 0 CA-C-N 119.112 0.869 . . . . 0.0 111.066 178.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -106.05 176.61 5.11 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 126.223 1.809 . . . . 0.0 109.636 165.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 16.9 p80 -161.84 147.21 13.28 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.954 -1.092 . . . . 0.0 112.299 -178.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.2 m -70.14 156.59 38.98 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 112.801 0.667 . . . . 0.0 112.801 -177.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -62.3 -46.14 90.1 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.349 1.06 . . . . 0.0 112.762 -176.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.1 m -130.17 -28.11 2.17 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 124.933 1.293 . . . . 0.0 112.936 -170.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.3 mttm -74.87 149.68 39.46 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 126.0 1.72 . . . . 0.0 111.476 172.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -96.07 -5.88 39.9 Favored 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 118.466 2.765 . . . . 0.0 118.466 -153.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -100.02 158.13 32.61 Favored Pre-proline 0 N--CA 1.481 1.114 0 CA-C-N 120.876 1.671 . . . . 0.0 112.374 177.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_endo -77.41 174.99 11.86 Favored 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 124.018 3.145 . . . . 0.0 110.934 169.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 16.8 p90 -142.17 137.23 30.71 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.912 0.885 . . . . 0.0 110.247 159.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -98.76 102.62 14.41 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.057 -1.027 . . . . 0.0 110.378 -171.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -75.54 131.3 39.95 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.428 1.091 . . . . 0.0 111.287 -177.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 60.5 t-20 -87.66 121.18 71.1 Favored Pre-proline 0 CA--C 1.546 0.807 0 CA-C-O 118.652 -0.689 . . . . 0.0 109.648 167.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -76.63 -35.09 2.2 Favored 'Trans proline' 0 CA--C 1.537 0.643 0 C-N-CA 122.595 2.196 . . . . 0.0 113.204 174.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -90.51 -15.88 29.91 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 -169.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 32.0 m -132.47 138.88 47.75 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 126.538 1.935 . . . . 0.0 107.207 171.454 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 35.7 mtp-105 -70.41 87.74 0.64 Allowed 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 118.554 0.616 . . . . 0.0 110.421 175.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -165.79 170.54 13.83 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.96 2.104 . . . . 0.0 111.7 -172.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 79.6 p -152.97 155.86 37.77 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.01 1.324 . . . . 0.0 112.043 177.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -124.85 147.23 48.88 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 126.741 2.016 . . . . 0.0 109.315 -177.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -113.57 -34.61 5.49 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 113.221 0.822 . . . . 0.0 113.221 -160.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -144.03 167.11 16.17 Favored Pre-proline 0 CA--C 1.554 1.126 0 C-N-CA 129.416 3.087 . . . . 0.0 106.878 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -65.12 116.99 4.16 Favored 'Trans proline' 0 CA--C 1.553 1.448 0 C-N-CA 123.06 2.507 . . . . 0.0 113.029 -175.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -87.4 179.94 2.91 Favored 'Trans proline' 0 C--N 1.357 1.003 1 C-N-CA 125.468 4.112 . . . . 0.0 114.036 -175.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.76 -29.72 70.27 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 114.452 1.278 . . . . 0.0 114.452 175.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -76.82 0.04 22.2 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.89 1.276 . . . . 0.0 114.105 177.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.4 169.88 14.13 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.521 1.529 . . . . 0.0 112.458 -173.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -125.72 56.53 1.39 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.283 1.833 . . . . 0.0 110.907 -171.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.437 ' HA ' ' HB2' ' A' ' 45' ' ' LEU . 62.5 mtm -25.97 -42.44 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.424 0 C-N-CA 127.771 2.428 . . . . 0.0 116.538 171.489 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -53.57 -53.83 46.13 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 121.787 2.085 . . . . 0.0 112.032 172.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 13.8 m -71.95 -6.73 44.14 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 126.51 1.924 . . . . 0.0 112.238 173.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.437 ' HB2' ' HA ' ' A' ' 42' ' ' MET . 71.7 mt -95.81 -20.9 18.47 Favored 'General case' 0 CA--C 1.507 -0.681 0 O-C-N 120.254 -1.529 . . . . 0.0 113.954 166.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -68.15 -38.17 81.85 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 121.812 2.096 . . . . 0.0 109.707 -172.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 23.7 ptm -60.16 -13.01 9.98 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 128.422 2.689 . . . . 0.0 115.342 165.37 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.445 ' CD2' HG22 ' A' ' 5' ' ' THR . 39.8 t80 -110.42 -65.44 1.16 Allowed 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.016 1.726 . . . . 0.0 112.348 -177.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 55.5 mtp -63.17 -17.19 62.11 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 128.102 2.561 . . . . 0.0 114.752 -172.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -128.23 148.48 50.63 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.071 1.348 . . . . 0.0 111.081 173.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 90.6 m -96.92 -56.81 2.45 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.947 1.299 . . . . 0.0 110.924 -176.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -85.15 147.35 26.66 Favored 'General case' 0 CA--C 1.54 0.564 0 CA-C-N 118.718 0.69 . . . . 0.0 110.28 160.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 32.9 m80 . . . . . 0 C--O 1.253 1.262 0 C-N-CA 124.137 0.975 . . . . 0.0 112.866 -173.857 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 23.3 t . . . . . 0 N--CA 1.477 0.877 0 N-CA-C 110.751 -0.092 . . . . 0.0 110.751 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.9 ppp? -68.22 166.31 16.57 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 126.016 1.726 . . . . 0.0 114.983 -173.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 17.7 m -142.82 146.61 21.69 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 124.513 1.125 . . . . 0.0 112.932 178.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 37.8 t-20 -95.0 154.58 17.11 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.121 1.368 . . . . 0.0 109.766 159.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.412 HG22 ' CD2' ' A' ' 48' ' ' TYR . 70.4 p -134.22 135.4 42.95 Favored 'General case' 0 CA--C 1.509 -0.626 0 C-N-CA 124.735 1.214 . . . . 0.0 109.129 170.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -81.01 45.24 3.15 Favored Glycine 0 CA--C 1.526 0.745 0 CA-C-N 114.528 -1.215 . . . . 0.0 111.966 155.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 10.9 mt -93.41 165.56 18.0 Favored Pre-proline 0 CA--C 1.553 1.093 0 CA-C-N 119.831 1.815 . . . . 0.0 110.256 173.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 15.8 Cg_endo -77.48 -153.86 0.05 OUTLIER 'Trans proline' 0 CA--C 1.548 1.188 0 C-N-CA 123.797 2.998 . . . . 0.0 111.457 -179.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.12 -15.93 38.65 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 125.246 1.418 . . . . 0.0 114.733 173.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -108.29 83.2 0.32 Allowed Glycine 0 C--N 1.337 0.603 0 C-N-CA 126.524 2.012 . . . . 0.0 110.568 173.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -124.22 0.42 8.39 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 115.157 1.539 . . . . 0.0 115.157 -179.778 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 14.5 tp10 -80.51 102.55 9.8 Favored 'General case' 0 CA--C 1.54 0.56 0 CA-C-N 118.786 0.721 . . . . 0.0 110.438 -172.474 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 75.8 t -66.3 131.06 32.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.023 0 O-C-N 121.572 -0.705 . . . . 0.0 111.422 -172.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.7 mmt-85 -131.11 120.66 23.69 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 126.339 1.856 . . . . 0.0 109.312 172.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.1 t60 -92.03 14.03 17.07 Favored 'General case' 0 CA--C 1.552 1.038 0 N-CA-C 114.578 1.325 . . . . 0.0 114.578 -176.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.6 m -73.07 107.29 5.34 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.539 -1.35 . . . . 0.0 111.049 -179.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 55.0 t-20 174.85 135.7 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 128.714 2.806 . . . . 0.0 107.133 -172.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 42.4 m -59.21 -24.92 63.54 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.09 1.356 . . . . 0.0 113.376 168.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.5 mmtt -103.01 141.06 36.44 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 125.14 1.376 . . . . 0.0 110.532 178.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -79.16 24.52 0.33 Allowed 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 -154.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -111.97 146.0 33.91 Favored Pre-proline 0 CA--C 1.544 0.726 0 C-N-CA 124.921 1.289 . . . . 0.0 110.509 171.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -76.87 166.71 26.48 Favored 'Trans proline' 0 N--CA 1.457 -0.67 0 C-N-CA 123.587 2.858 . . . . 0.0 112.208 176.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 46.0 p90 -107.43 159.24 16.55 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.306 153.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -100.93 125.4 47.5 Favored 'General case' 0 CA--C 1.539 0.519 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 171.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . 0.4 ' CE2' ' HA ' ' A' ' 27' ' ' PRO . 24.7 t80 -83.35 142.59 30.94 Favored 'General case' 0 CA--C 1.535 0.366 0 O-C-N 121.433 -0.792 . . . . 0.0 111.388 177.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -96.46 92.39 1.07 Allowed Pre-proline 0 CA--C 1.548 0.876 0 C-N-CA 126.041 1.736 . . . . 0.0 110.117 170.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.4 ' HA ' ' CE2' ' A' ' 25' ' ' PHE . 9.8 Cg_endo -54.7 -22.72 29.99 Favored 'Trans proline' 0 C--N 1.352 0.741 0 C-N-CA 123.691 2.928 . . . . 0.0 115.827 -176.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -94.57 -4.85 47.13 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 115.402 1.63 . . . . 0.0 115.402 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 10.6 m -143.68 149.05 36.65 Favored 'General case' 0 N--CA 1.484 1.234 0 CA-C-N 119.701 1.137 . . . . 0.0 111.11 -164.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 55.0 mtp180 -83.97 67.75 9.75 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 121.05 -1.031 . . . . 0.0 110.346 171.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -159.14 169.08 24.97 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 126.748 2.019 . . . . 0.0 109.777 -176.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 92.6 p -140.68 161.15 38.45 Favored 'General case' 0 N--CA 1.474 0.744 0 O-C-N 120.93 -1.106 . . . . 0.0 113.394 172.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -120.08 158.18 27.38 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 126.505 1.922 . . . . 0.0 110.221 178.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -144.5 -17.16 0.55 Allowed 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 114.368 1.248 . . . . 0.0 114.368 -160.101 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -154.7 161.4 29.47 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 128.159 2.584 . . . . 0.0 107.12 -173.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -70.64 117.52 5.18 Favored 'Trans proline' 0 CA--C 1.548 1.199 0 C-N-CA 123.05 2.5 . . . . 0.0 111.956 179.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -83.73 -161.07 0.13 Allowed 'Trans proline' 0 CA--C 1.545 1.064 0 C-N-CA 124.77 3.647 . . . . 0.0 112.476 -178.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -95.1 -21.82 18.29 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 120.51 -1.368 . . . . 0.0 114.02 -178.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -76.99 0.13 22.33 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.998 1.719 . . . . 0.0 112.862 169.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -82.63 172.75 12.61 Favored 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 126.968 2.107 . . . . 0.0 111.973 -178.904 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -129.94 65.72 1.49 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 126.103 1.761 . . . . 0.0 111.253 -173.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.433 ' HA ' ' HB2' ' A' ' 45' ' ' LEU . 41.1 mtm -37.83 -35.88 0.16 Allowed 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 116.582 2.067 . . . . 0.0 116.582 174.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.6 tp10 -68.28 -12.71 61.47 Favored 'General case' 0 CA--C 1.56 1.346 0 CA-C-N 121.481 1.946 . . . . 0.0 114.081 176.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 31.9 m -107.42 -2.41 20.54 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 128.019 2.528 . . . . 0.0 111.837 166.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.433 ' HB2' ' HA ' ' A' ' 42' ' ' MET . 79.4 mt -98.68 -18.43 18.05 Favored 'General case' 0 CA--C 1.507 -0.698 0 CA-C-O 115.871 -2.014 . . . . 0.0 114.48 171.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.417 ' HE2' ' HA ' ' A' ' 46' ' ' LYS . 7.4 mmpt? -68.85 -37.28 79.02 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 123.392 2.814 . . . . 0.0 110.601 -175.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 23.1 ptp -51.86 -22.43 3.75 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 126.469 1.908 . . . . 0.0 114.054 164.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.412 ' CD2' HG22 ' A' ' 5' ' ' THR . 43.1 t80 -104.11 -70.03 0.78 Allowed 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 126.497 1.919 . . . . 0.0 112.66 -178.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 12.9 mtt -66.05 -15.53 63.14 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 128.129 2.572 . . . . 0.0 115.265 -174.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -162.5 60.3 0.22 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.97 1.308 . . . . 0.0 111.351 -177.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 5.8 m -25.94 91.2 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 128.877 2.871 . . . . 0.0 115.187 -159.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -62.31 122.85 16.68 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 124.491 1.117 . . . . 0.0 111.907 178.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 5.9 t60 . . . . . 0 C--O 1.248 1.017 0 C-N-CA 123.986 0.914 . . . . 0.0 113.286 -164.976 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 58.6 m . . . . . 0 N--CA 1.476 0.849 0 N-CA-C 112.599 0.592 . . . . 0.0 112.599 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 59.7 mtt -93.79 150.03 20.73 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.997 0.919 . . . . 0.0 111.909 163.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -146.31 154.49 12.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 124.345 1.058 . . . . 0.0 111.791 -176.091 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -70.55 146.37 50.2 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.496 0.719 . . . . 0.0 111.713 169.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 63.6 p -136.83 142.55 42.87 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 125.857 1.663 . . . . 0.0 109.257 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.602 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -75.24 16.98 3.3 Favored Glycine 0 CA--C 1.535 1.29 0 CA-C-O 118.486 -1.175 . . . . 0.0 115.635 152.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 16.4 mt -71.88 156.12 91.34 Favored Pre-proline 0 CA--C 1.547 0.865 0 CA-C-N 120.391 2.095 . . . . 0.0 110.252 -177.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -78.67 -150.82 0.04 OUTLIER 'Trans proline' 0 CA--C 1.548 1.198 0 C-N-CA 122.872 2.382 . . . . 0.0 111.503 -172.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.73 -22.97 58.91 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 120.517 -1.364 . . . . 0.0 114.678 178.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -102.53 81.53 0.39 Allowed Glycine 0 C--N 1.34 0.761 0 C-N-CA 126.445 1.974 . . . . 0.0 110.542 174.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 10.2 p-90 -130.33 -6.96 4.26 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 114.73 1.381 . . . . 0.0 114.73 -175.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.2 tp10 -75.67 103.25 5.69 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 118.993 0.815 . . . . 0.0 109.191 -175.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.0 p -66.47 134.78 29.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 C-N-CA 123.179 0.591 . . . . 0.0 111.589 -174.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -130.5 125.83 35.33 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.667 1.587 . . . . 0.0 110.179 176.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 28.1 p-80 -88.04 -11.52 46.98 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.248 1.419 . . . . 0.0 114.668 -173.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 44.6 m -51.19 108.09 0.23 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.918 1.287 . . . . 0.0 112.997 -174.186 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.1 p30 152.26 140.78 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 131.619 3.967 . . . . 0.0 109.835 -179.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 38.0 m -70.07 -15.9 63.06 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.709 1.604 . . . . 0.0 112.897 168.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.4 ttmt -79.1 -166.17 0.88 Allowed 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.71 1.204 . . . . 0.0 112.463 -179.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.1 m120 -94.93 -30.32 14.21 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 -154.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -114.77 156.16 45.3 Favored Pre-proline 0 N--CA 1.475 0.782 0 C-N-CA 124.662 1.185 . . . . 0.0 111.776 -177.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -79.57 -173.68 1.97 Allowed 'Trans proline' 0 CA--C 1.539 0.761 0 C-N-CA 123.828 3.018 . . . . 0.0 110.562 171.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 45.7 p90 -133.39 149.87 51.82 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.281 1.432 . . . . 0.0 110.05 161.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 51.0 m-85 -93.34 132.13 37.85 Favored 'General case' 0 N--CA 1.469 0.483 0 O-C-N 121.313 -0.867 . . . . 0.0 110.312 174.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 44.2 t80 -100.42 147.92 25.31 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.514 1.125 . . . . 0.0 111.681 178.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 43.4 t-20 -102.47 110.02 61.96 Favored Pre-proline 0 CA--C 1.547 0.84 0 C-N-CA 123.914 0.885 . . . . 0.0 110.265 162.302 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_exo -63.97 -29.94 66.81 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 123.137 2.558 . . . . 0.0 114.613 177.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.4 -30.77 57.6 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 113.862 1.06 . . . . 0.0 113.862 -172.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 95.6 m -147.1 105.39 3.77 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 126.248 1.819 . . . . 0.0 107.616 177.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -47.18 104.56 0.05 Allowed 'General case' 0 C--O 1.237 0.419 0 C-N-CA 128.147 2.579 . . . . 0.0 111.927 -171.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -171.59 158.09 4.97 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.968 1.707 . . . . 0.0 109.799 -171.065 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 92.6 p -127.3 162.19 26.84 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.419 0.896 . . . . 0.0 113.419 174.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 8.1 tpp85 -134.31 150.21 50.94 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 126.725 2.01 . . . . 0.0 109.249 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -142.54 -18.28 0.7 Allowed 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 124.561 1.144 . . . . 0.0 112.863 -156.62 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -149.54 155.96 39.03 Favored Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 128.179 2.592 . . . . 0.0 107.504 -175.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -66.03 121.75 9.14 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 122.823 2.349 . . . . 0.0 110.87 178.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -80.07 167.91 19.4 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 123.545 2.83 . . . . 0.0 111.494 175.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -66.39 -28.17 68.42 Favored 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 113.636 0.976 . . . . 0.0 113.636 -176.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -71.48 -24.89 62.07 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.24 1.816 . . . . 0.0 113.859 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -69.41 164.38 23.14 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 127.034 2.134 . . . . 0.0 113.96 -163.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.7 m-20 -107.88 53.42 0.69 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 125.216 1.407 . . . . 0.0 111.24 -162.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.428 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 77.4 mtm -27.2 -40.38 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 129.045 2.938 . . . . 0.0 115.103 166.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -50.61 -47.58 58.21 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 121.555 1.979 . . . . 0.0 113.542 173.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 21.5 m -78.52 -21.04 49.45 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 128.04 2.536 . . . . 0.0 112.162 176.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.602 HD13 ' N ' ' A' ' 6' ' ' GLY . 38.3 tp -117.48 -21.4 8.64 Favored 'General case' 0 C--O 1.219 -0.516 0 C-N-CA 123.976 0.91 . . . . 0.0 111.3 -150.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.9 -35.48 69.03 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 120.598 1.544 . . . . 0.0 111.015 157.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 8.5 mmt -60.43 -24.96 65.61 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 172.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 32.6 t80 -97.36 -45.48 6.45 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.858 1.663 . . . . 0.0 112.78 -178.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 35.1 mtt -76.33 -17.25 59.51 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.268 1.827 . . . . 0.0 112.697 -177.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -104.3 165.01 11.33 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.044 1.338 . . . . 0.0 110.398 157.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -121.5 -2.75 9.41 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 125.078 1.351 . . . . 0.0 113.343 178.407 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -57.75 149.71 21.51 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.505 1.122 . . . . 0.0 112.249 157.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 78.7 t60 . . . . . 0 C--O 1.252 1.23 0 C-N-CA 125.17 1.388 . . . . 0.0 113.527 -176.174 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 80.8 p . . . . . 0 N--CA 1.476 0.85 0 CA-C-O 118.872 -0.585 . . . . 0.0 111.495 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 99.2 mmm -77.36 132.05 38.37 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 119.98 1.264 . . . . 0.0 110.612 178.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 18.5 t -107.83 158.43 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 C-N-CA 127.048 2.139 . . . . 0.0 108.664 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 24.8 m120 -53.26 131.02 36.63 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 122.093 -0.38 . . . . 0.0 111.29 168.29 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 44.7 p -129.39 146.59 51.23 Favored 'General case' 0 CA--C 1.508 -0.668 0 C-N-CA 125.508 1.523 . . . . 0.0 108.337 171.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.412 ' H ' HD23 ' A' ' 45' ' ' LEU . . . -94.47 52.92 2.08 Favored Glycine 0 CA--C 1.524 0.616 0 CA-C-N 113.795 -1.548 . . . . 0.0 111.5 154.562 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.447 ' HG ' HD21 ' A' ' 45' ' ' LEU . 15.0 mt -88.63 169.06 14.24 Favored Pre-proline 0 CA--C 1.551 1.013 0 CA-C-N 118.699 1.25 . . . . 0.0 110.311 175.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -75.8 -158.34 0.08 OUTLIER 'Trans proline' 0 CA--C 1.548 1.209 0 C-N-CA 121.726 1.618 . . . . 0.0 110.801 177.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.4 12.8 0.54 Allowed 'General case' 0 CA--C 1.551 1.002 0 N-CA-C 115.657 1.725 . . . . 0.0 115.657 -172.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -142.14 102.32 0.3 Allowed Glycine 0 C--N 1.334 0.472 0 C-N-CA 126.046 1.784 . . . . 0.0 109.276 173.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 52.7 p-90 -141.64 -2.47 1.21 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.411 1.484 . . . . 0.0 114.264 -171.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.09 161.25 11.21 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.576 0.751 . . . . 0.0 110.927 159.487 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.5 m -118.51 149.28 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.813 0 C-N-CA 124.37 1.068 . . . . 0.0 112.866 -173.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.406 ' HB2' ' CE1' ' A' ' 23' ' ' TYR . 22.9 mmt85 -141.44 118.89 11.53 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.473 1.909 . . . . 0.0 110.196 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 16.4 p-80 -74.52 166.16 23.99 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 113.631 0.974 . . . . 0.0 113.631 175.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 29.0 t -160.49 130.88 5.34 Favored 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 125.46 1.504 . . . . 0.0 110.176 176.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 42.3 t30 -58.9 -24.44 62.32 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.318 1.229 . . . . 0.0 114.318 -176.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 69.5 m -71.94 -15.79 62.09 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 124.944 1.298 . . . . 0.0 114.063 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -108.21 168.03 9.59 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.566 1.546 . . . . 0.0 113.045 -171.23 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -92.97 -9.94 38.15 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 113.871 1.063 . . . . 0.0 113.871 169.196 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -160.77 164.64 18.82 Favored Pre-proline 0 CA--C 1.55 0.947 0 C-N-CA 126.906 2.082 . . . . 0.0 109.598 -177.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.57 162.68 40.69 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 122.782 2.321 . . . . 0.0 113.125 -177.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.406 ' CE1' ' HB2' ' A' ' 14' ' ' ARG . 33.2 p90 -95.24 157.57 15.84 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.805 0.842 . . . . 0.0 110.953 160.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -83.0 143.42 30.65 Favored 'General case' 0 CA--C 1.542 0.645 0 O-C-N 121.683 -0.636 . . . . 0.0 110.388 171.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -116.83 145.2 43.7 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 124.301 1.04 . . . . 0.0 112.493 -174.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -101.13 98.15 8.31 Favored Pre-proline 0 CA--C 1.552 1.031 0 C-N-CA 124.702 1.201 . . . . 0.0 110.447 176.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -66.72 -29.67 42.55 Favored 'Trans proline' 0 C--N 1.351 0.702 0 C-N-CA 122.692 2.261 . . . . 0.0 115.137 -167.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.73 -24.38 41.66 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 114.868 1.432 . . . . 0.0 114.868 -176.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.8 m -146.47 126.68 13.85 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 125.274 1.43 . . . . 0.0 109.51 178.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -50.36 101.12 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 126.196 1.798 . . . . 0.0 112.736 -176.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -168.08 154.48 7.54 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 127.019 2.128 . . . . 0.0 110.749 179.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 82.4 p -129.53 151.55 50.02 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.878 1.271 . . . . 0.0 112.735 176.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 18.0 tpp180 -126.34 146.35 50.07 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 127.471 2.308 . . . . 0.0 109.831 -176.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -130.62 -36.33 1.43 Allowed 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -158.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -146.28 150.53 41.52 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 126.554 1.942 . . . . 0.0 107.861 -178.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -48.27 112.61 0.62 Allowed 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 124.817 3.678 . . . . 0.0 114.391 -174.534 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -80.14 163.45 22.66 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 123.488 2.792 . . . . 0.0 112.203 -177.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -62.84 -22.71 66.87 Favored 'General case' 0 CA--C 1.545 0.764 0 N-CA-C 114.058 1.132 . . . . 0.0 114.058 -178.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -90.75 -1.03 57.88 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 126.207 1.803 . . . . 0.0 113.998 -174.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.86 -173.6 1.93 Allowed 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 126.009 1.723 . . . . 0.0 113.794 -170.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -119.09 60.27 0.82 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 126.149 1.78 . . . . 0.0 110.229 177.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 59.6 mtt -31.96 -46.33 0.12 Allowed 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.901 1.68 . . . . 0.0 113.93 168.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -53.6 -36.58 62.11 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 120.351 1.432 . . . . 0.0 113.995 177.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 75.9 m -85.65 -28.19 24.91 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.28 1.432 . . . . 0.0 111.822 171.212 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.447 HD21 ' HG ' ' A' ' 7' ' ' LEU . 81.3 mt -72.31 -14.19 61.68 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 119.818 1.19 . . . . 0.0 112.536 174.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -68.24 -18.18 64.49 Favored 'General case' 0 CA--C 1.55 0.954 0 CA-C-N 120.624 1.556 . . . . 0.0 111.988 -175.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 93.3 mmm -79.84 -8.77 59.48 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 128.146 2.578 . . . . 0.0 113.688 168.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.406 ' HD2' HD22 ' A' ' 45' ' ' LEU . 67.9 t80 -121.27 -56.25 1.91 Allowed 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 126.786 2.034 . . . . 0.0 113.095 -166.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 88.3 mmm -67.16 -11.79 58.26 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.986 2.115 . . . . 0.0 113.267 178.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -143.3 151.0 40.0 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 126.636 1.974 . . . . 0.0 110.338 159.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 5.0 m -85.07 125.8 33.06 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.929 1.292 . . . . 0.0 110.229 -175.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -62.48 135.01 57.21 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 123.265 0.626 . . . . 0.0 111.903 176.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 21.0 t60 . . . . . 0 C--O 1.253 1.256 0 C-N-CA 124.375 1.07 . . . . 0.0 113.569 -167.028 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 57.1 m . . . . . 0 N--CA 1.478 0.937 0 CA-C-O 118.96 -0.543 . . . . 0.0 110.853 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 19.7 ptt? 166.04 145.49 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 128.636 2.775 . . . . 0.0 111.626 173.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 17.0 m -132.8 152.52 36.31 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 125.101 1.36 . . . . 0.0 111.475 177.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 34.7 m120 -111.24 128.66 56.0 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.113 0.965 . . . . 0.0 109.667 164.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 24.4 p -115.37 127.98 55.76 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 125.664 1.586 . . . . 0.0 108.217 179.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -76.33 55.0 3.23 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 110.797 -0.921 . . . . 0.0 110.797 158.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 12.8 mt -93.07 166.66 15.85 Favored Pre-proline 0 CA--C 1.55 0.964 0 CA-C-N 118.745 1.273 . . . . 0.0 110.905 176.264 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -77.24 -141.45 0.02 OUTLIER 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 123.526 2.817 . . . . 0.0 110.211 176.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.09 -21.43 64.97 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 120.451 -1.406 . . . . 0.0 113.675 177.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -98.52 81.33 0.6 Allowed Glycine 0 C--N 1.337 0.603 0 C-N-CA 126.974 2.226 . . . . 0.0 110.146 172.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 52.0 p-90 -119.46 -16.5 8.92 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 116.69 2.108 . . . . 0.0 116.69 -171.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -80.96 127.13 32.22 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 118.91 0.777 . . . . 0.0 110.759 -175.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.8 m -89.16 130.67 38.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 O-C-N 121.412 -0.805 . . . . 0.0 111.633 -166.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 80.8 mmt-85 -141.28 158.61 43.66 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.215 1.006 . . . . 0.0 112.254 -173.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 8.6 p80 -172.39 137.6 0.87 Allowed 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.73 2.012 . . . . 0.0 112.118 177.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.9 m -70.18 159.3 34.21 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 121.672 -0.642 . . . . 0.0 111.968 175.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -68.47 -20.23 64.6 Favored 'General case' 0 CA--C 1.547 0.83 0 O-C-N 120.664 -1.272 . . . . 0.0 114.389 -176.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.4 m -78.89 -0.95 32.84 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 125.415 1.486 . . . . 0.0 113.756 173.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 59.9 mmtt -135.41 169.87 16.82 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.619 1.968 . . . . 0.0 112.751 -171.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -131.52 -29.76 1.73 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.435 1.494 . . . . 0.0 113.111 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -77.99 128.2 79.53 Favored Pre-proline 0 CA--C 1.548 0.875 0 C-N-CA 126.369 1.868 . . . . 0.0 110.071 178.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -80.99 159.26 20.86 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 123.188 2.592 . . . . 0.0 114.829 -170.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 34.1 p90 -116.63 153.26 32.59 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.816 1.647 . . . . 0.0 109.824 154.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 33.3 m-85 -110.84 112.2 23.89 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.167 0.987 . . . . 0.0 110.192 -172.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -79.84 137.25 36.9 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 126.071 1.748 . . . . 0.0 112.928 -171.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -93.35 109.87 43.07 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 124.479 1.112 . . . . 0.0 110.048 171.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -69.43 -37.21 10.28 Favored 'Trans proline' 0 C--N 1.35 0.63 0 C-N-CA 121.771 1.647 . . . . 0.0 112.322 175.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.42 -21.81 62.78 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 116.028 1.862 . . . . 0.0 116.028 -170.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 31.6 m -153.67 146.46 24.33 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.256 1.823 . . . . 0.0 108.613 -173.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -70.86 87.08 0.71 Allowed 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 119.008 0.822 . . . . 0.0 111.844 -179.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -166.23 178.98 5.93 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 126.839 2.056 . . . . 0.0 109.766 176.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 26.1 p -156.96 149.85 23.7 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.297 1.439 . . . . 0.0 112.552 170.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.7 tpp180 -101.32 135.67 42.43 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 127.626 2.37 . . . . 0.0 109.664 -176.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -102.03 -30.77 11.0 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 121.114 -0.991 . . . . 0.0 113.513 -167.172 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -148.58 156.7 41.92 Favored Pre-proline 0 CA--C 1.539 0.55 0 C-N-CA 126.938 2.095 . . . . 0.0 108.087 -161.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -67.27 120.72 7.8 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 122.195 1.93 . . . . 0.0 110.69 -173.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -78.19 170.13 19.15 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 122.873 2.382 . . . . 0.0 110.776 173.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -72.65 -27.9 62.4 Favored 'General case' 0 CA--C 1.54 0.574 0 O-C-N 121.554 -0.716 . . . . 0.0 111.768 164.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -65.23 -0.18 1.64 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 127.716 2.407 . . . . 0.0 114.648 179.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -88.53 172.84 9.03 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 126.658 1.983 . . . . 0.0 113.547 -170.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -107.09 48.43 0.84 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 127.288 2.235 . . . . 0.0 111.178 -171.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.414 ' HA ' ' HB2' ' A' ' 45' ' ' LEU . 69.1 mtm -29.38 -43.19 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 118.099 2.629 . . . . 0.0 118.099 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.9 tt0 -49.29 -47.29 47.03 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 123.062 2.665 . . . . 0.0 111.912 174.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 36.6 m -77.66 -22.07 51.18 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 126.028 1.731 . . . . 0.0 111.713 178.26 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.414 ' HB2' ' HA ' ' A' ' 42' ' ' MET . 66.8 mt -82.19 -21.46 36.46 Favored 'General case' 0 CA--C 1.506 -0.741 0 CA-C-O 117.625 -1.179 . . . . 0.0 113.245 171.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.71 -10.13 57.1 Favored 'General case' 0 CA--C 1.554 1.134 0 CA-C-N 121.197 1.817 . . . . 0.0 111.38 176.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 7.2 mmm -89.33 5.64 44.1 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 127.922 2.489 . . . . 0.0 113.066 167.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 49.6 t80 -135.42 -58.35 0.78 Allowed 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 126.36 1.864 . . . . 0.0 113.031 -172.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 36.0 mtp -72.29 -4.68 31.09 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 127.829 2.452 . . . . 0.0 112.322 172.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -154.6 -165.99 2.21 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 129.168 2.987 . . . . 0.0 108.055 166.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 29.1 p -132.25 165.31 24.43 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.497 1.119 . . . . 0.0 111.23 170.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 68.7 t80 -127.58 131.76 49.93 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 126.363 1.865 . . . . 0.0 110.875 -178.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 . . . . . 0 C--O 1.255 1.353 0 C-N-CA 127.793 2.437 . . . . 0.0 108.812 -173.557 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 26.6 m . . . . . 0 N--CA 1.473 0.704 0 CA-C-O 120.585 0.231 . . . . 0.0 110.974 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 98.1 mmm -63.1 142.11 58.51 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 125.013 1.325 . . . . 0.0 112.176 -177.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.0 m -129.04 127.27 65.76 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 C-N-CA 123.866 0.866 . . . . 0.0 110.541 172.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 36.2 m120 -78.48 132.5 37.28 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.407 0.683 . . . . 0.0 109.503 166.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.517 ' HB ' ' H ' ' A' ' 7' ' ' LEU . 71.9 p -132.59 144.21 50.22 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 126.733 2.013 . . . . 0.0 108.588 179.143 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -81.22 8.69 57.32 Favored Glycine 0 CA--C 1.536 1.366 0 CA-C-N 115.093 -0.958 . . . . 0.0 113.622 156.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.517 ' H ' ' HB ' ' A' ' 5' ' ' THR . 30.4 mt -61.96 155.17 64.76 Favored Pre-proline 0 CA--C 1.542 0.669 0 CA-C-N 119.902 1.851 . . . . 0.0 110.696 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 92.2 Cg_endo -70.36 179.18 4.21 Favored 'Trans proline' 0 CA--C 1.539 0.739 0 C-N-CA 121.098 1.199 . . . . 0.0 112.308 -169.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.88 -39.74 69.01 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.453 1.101 . . . . 0.0 113.049 178.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -82.15 68.16 3.56 Favored Glycine 0 CA--C 1.526 0.747 0 C-N-CA 125.405 1.479 . . . . 0.0 111.649 174.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -143.25 163.8 31.95 Favored 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 114.078 1.14 . . . . 0.0 114.078 171.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 175.73 140.85 0.06 Allowed 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 131.22 3.808 . . . . 0.0 106.231 164.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 9.1 p -81.54 141.74 14.71 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 CA-C-N 120.195 1.361 . . . . 0.0 112.172 -174.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.8 mmm180 -142.74 102.54 4.06 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.704 1.202 . . . . 0.0 111.934 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 76.5 m-70 -72.41 112.45 8.48 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 123.938 0.895 . . . . 0.0 111.892 175.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 29.2 t -59.63 151.23 25.28 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.994 1.479 . . . . 0.0 114.994 -167.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -73.88 -36.95 64.86 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.053 1.341 . . . . 0.0 111.451 165.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.2 t -86.29 -25.13 25.64 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -175.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -133.67 153.45 51.67 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.299 1.039 . . . . 0.0 112.002 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -80.63 52.61 1.7 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 124.424 1.09 . . . . 0.0 111.471 176.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -154.16 135.29 8.69 Favored Pre-proline 0 CA--C 1.549 0.935 0 C-N-CA 125.245 1.418 . . . . 0.0 110.16 -158.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -82.04 131.37 6.88 Favored 'Trans proline' 0 C--N 1.349 0.595 0 C-N-CA 123.33 2.687 . . . . 0.0 112.635 174.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 53.8 p90 -96.36 165.48 12.17 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 122.892 0.477 . . . . 0.0 110.11 151.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 62.4 m-85 -105.19 129.84 53.48 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.321 -0.862 . . . . 0.0 110.65 170.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -87.86 139.41 30.55 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 124.579 1.151 . . . . 0.0 110.44 174.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -99.13 108.0 47.33 Favored Pre-proline 0 CA--C 1.551 1.015 0 O-C-N 121.855 -0.528 . . . . 0.0 109.858 179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -73.48 -36.62 3.78 Favored 'Trans proline' 0 C--N 1.354 0.853 0 C-N-CA 122.512 2.141 . . . . 0.0 112.581 174.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -69.26 -26.24 64.67 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -174.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 76.9 m -150.21 132.0 15.04 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 127.904 2.482 . . . . 0.0 106.861 -176.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 79.4 mtp180 -65.0 97.89 0.26 Allowed 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.604 1.093 . . . . 0.0 110.633 -177.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -171.63 172.65 4.91 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 126.472 1.909 . . . . 0.0 110.542 -167.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 36.6 p -140.02 143.96 36.68 Favored 'General case' 0 CA--C 1.545 0.77 0 O-C-N 120.823 -1.173 . . . . 0.0 111.862 166.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 20.2 tpp180 -107.33 143.49 35.53 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 126.788 2.035 . . . . 0.0 110.218 -178.354 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -127.3 -6.54 5.91 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 125.41 1.484 . . . . 0.0 114.528 -166.025 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -165.98 168.92 7.25 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 127.763 2.425 . . . . 0.0 107.941 -173.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -68.01 122.38 9.47 Favored 'Trans proline' 0 CA--C 1.546 1.093 0 C-N-CA 122.07 1.846 . . . . 0.0 111.239 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -82.12 174.77 9.77 Favored 'Trans proline' 0 C--N 1.352 0.739 0 C-N-CA 124.505 3.47 . . . . 0.0 111.465 176.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -58.37 -44.46 88.87 Favored 'General case' 0 CA--C 1.548 0.882 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 176.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -68.96 -11.48 60.74 Favored 'General case' 0 CA--C 1.553 1.066 0 N-CA-C 115.645 1.72 . . . . 0.0 115.645 -167.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.3 t -75.83 164.29 26.38 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 126.382 1.873 . . . . 0.0 114.872 -164.594 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -115.17 56.57 0.74 Allowed 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 126.749 2.02 . . . . 0.0 111.174 -163.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.405 ' HA ' ' HB2' ' A' ' 45' ' ' LEU . 27.0 mtt -30.86 -40.75 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.87 1.668 . . . . 0.0 114.805 169.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -39.65 -54.75 1.99 Allowed 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 126.412 1.885 . . . . 0.0 114.082 166.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 95.6 m -78.79 -31.06 45.85 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.961 2.104 . . . . 0.0 111.409 170.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.405 ' HB2' ' HA ' ' A' ' 42' ' ' MET . 0.3 OUTLIER -80.03 -19.99 46.38 Favored 'General case' 0 C--O 1.224 -0.251 0 O-C-N 121.171 -0.956 . . . . 0.0 112.58 -162.972 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.25 -27.41 67.93 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 120.707 1.594 . . . . 0.0 112.17 175.387 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 95.6 mmm -62.05 -8.03 4.79 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.714 1.205 . . . . 0.0 113.816 167.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 59.5 t80 -115.85 -59.55 1.98 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.615 1.966 . . . . 0.0 111.547 178.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.16 -7.45 41.81 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 126.247 1.819 . . . . 0.0 113.99 -178.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -138.45 53.58 1.79 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 125.469 1.508 . . . . 0.0 110.238 167.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 7.4 m -55.38 126.98 27.36 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.245 1.418 . . . . 0.0 110.647 -174.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -70.12 147.71 49.6 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.6 0.76 . . . . 0.0 112.729 -175.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 54.0 t60 . . . . . 0 C--O 1.25 1.118 0 C-N-CA 125.305 1.442 . . . . 0.0 110.832 -173.07 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 56.9 p . . . . . 0 N--CA 1.476 0.853 0 CA-C-O 118.682 -0.675 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.5 pmm? -168.67 162.68 11.91 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 120.048 1.295 . . . . 0.0 113.178 -167.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 3.4 t -117.21 140.94 37.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 125.651 1.58 . . . . 0.0 108.557 168.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 -70.32 128.72 37.19 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 122.09 -0.382 . . . . 0.0 111.188 175.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 24.5 p -133.03 132.49 41.9 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 127.206 2.202 . . . . 0.0 107.843 -176.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.537 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -68.86 34.12 0.29 Allowed Glycine 0 CA--C 1.532 1.142 0 CA-C-O 118.435 -1.203 . . . . 0.0 115.651 155.363 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.7 mt -83.77 165.04 41.84 Favored Pre-proline 0 CA--C 1.548 0.872 0 CA-C-N 119.633 1.716 . . . . 0.0 109.61 177.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -77.95 -147.15 0.03 OUTLIER 'Trans proline' 0 CA--C 1.545 1.036 0 C-N-CA 121.608 1.539 . . . . 0.0 109.128 174.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.28 -21.04 64.82 Favored 'General case' 0 CA--C 1.546 0.802 0 O-C-N 120.212 -1.555 . . . . 0.0 112.91 173.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -80.94 68.79 3.36 Favored Glycine 0 CA--C 1.527 0.805 0 C-N-CA 126.025 1.774 . . . . 0.0 111.545 170.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 12.1 p-90 -120.37 -12.43 8.99 Favored 'General case' 0 N--CA 1.473 0.712 0 N-CA-C 116.588 2.07 . . . . 0.0 116.588 -173.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -70.3 114.91 8.9 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 120.077 1.308 . . . . 0.0 110.448 -179.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 6.0 t -72.16 134.17 30.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 CA-C-N 119.168 0.895 . . . . 0.0 109.826 178.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.2 mmt85 -131.9 128.98 39.71 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 125.087 1.355 . . . . 0.0 111.331 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 38.0 p-80 -62.8 137.57 58.3 Favored 'General case' 0 CA--C 1.546 0.803 0 O-C-N 121.771 -0.58 . . . . 0.0 110.476 159.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 9.8 t -97.69 150.93 20.64 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.037 -1.04 . . . . 0.0 112.391 -174.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -69.03 -41.41 77.72 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 121.388 -0.82 . . . . 0.0 110.156 162.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 85.1 p -106.91 -3.73 19.9 Favored 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 115.691 1.738 . . . . 0.0 115.691 -158.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.5 ttmm -138.43 146.34 42.03 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-N 119.484 1.038 . . . . 0.0 113.564 -169.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -88.1 46.67 1.41 Allowed 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.74 1.616 . . . . 0.0 111.946 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 16.6 tp -170.63 151.9 3.67 Favored Pre-proline 0 CA--C 1.547 0.835 0 C-N-CA 128.258 2.623 . . . . 0.0 107.322 -171.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -71.18 166.37 29.42 Favored 'Trans proline' 0 N--CA 1.458 -0.567 0 C-N-CA 121.607 1.538 . . . . 0.0 110.645 169.039 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 17.2 p90 -127.86 160.93 30.27 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.725 1.21 . . . . 0.0 109.949 164.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -103.98 139.44 39.11 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.6 -0.688 . . . . 0.0 110.537 179.403 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -118.04 142.19 47.66 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 125.658 1.583 . . . . 0.0 111.581 -172.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 65.0 t-20 -98.15 109.41 51.84 Favored Pre-proline 0 CA--C 1.546 0.796 0 C-N-CA 124.576 1.15 . . . . 0.0 110.362 171.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -75.79 -26.22 9.92 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 123.087 2.525 . . . . 0.0 113.243 177.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -79.83 -29.4 40.17 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 118.948 0.795 . . . . 0.0 112.771 -175.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 11.9 m -143.27 88.99 2.06 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.144 1.378 . . . . 0.0 108.707 174.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -32.7 103.1 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 128.557 2.743 . . . . 0.0 114.005 -173.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -173.19 165.13 4.87 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.299 1.84 . . . . 0.0 109.821 -170.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 57.1 p -120.38 173.4 7.17 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.482 1.513 . . . . 0.0 113.352 175.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.05 141.28 17.48 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.837 2.055 . . . . 0.0 109.254 -178.268 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -134.5 -25.92 1.46 Allowed 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -151.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -142.91 152.75 59.64 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 127.976 2.51 . . . . 0.0 107.556 172.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -51.04 113.0 0.91 Allowed 'Trans proline' 0 CA--C 1.544 1.012 0 C-N-CA 124.19 3.26 . . . . 0.0 112.923 -178.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -79.15 169.39 19.17 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 123.34 2.693 . . . . 0.0 111.924 -176.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -59.94 -38.02 81.2 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 178.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -78.44 0.13 27.04 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 127.463 2.305 . . . . 0.0 114.5 -175.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.78 174.7 10.19 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 126.008 1.723 . . . . 0.0 111.063 178.214 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -103.6 -35.6 8.23 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 120.949 -1.095 . . . . 0.0 112.402 -166.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.521 ' HA ' ' HB3' ' A' ' 45' ' ' LEU 0.263 33.7 mtt 60.99 -40.05 0.11 Allowed 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 128.542 2.737 . . . . 0.0 115.741 -176.9 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -62.23 -51.99 65.53 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-N 122.343 2.338 . . . . 0.0 111.783 177.288 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 6.0 m -66.53 -11.16 51.34 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 125.91 1.684 . . . . 0.0 112.175 169.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.537 HD13 ' N ' ' A' ' 6' ' ' GLY . 8.6 tp -105.06 -23.76 12.89 Favored 'General case' 0 N--CA 1.447 -0.602 0 O-C-N 120.942 -1.099 . . . . 0.0 111.225 -170.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.24 -37.7 88.26 Favored 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 120.957 1.708 . . . . 0.0 110.213 169.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 25.1 ptp -69.87 18.31 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 126.101 1.761 . . . . 0.0 114.573 166.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -138.28 -32.38 0.72 Allowed 'General case' 0 CA--C 1.552 1.038 0 C-N-CA 126.691 1.997 . . . . 0.0 112.297 171.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 93.4 mmm -95.12 -8.95 34.99 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 127.287 2.235 . . . . 0.0 115.095 -179.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -141.23 165.6 27.07 Favored 'General case' 0 CA--C 1.548 0.896 0 CA-C-N 120.327 1.421 . . . . 0.0 113.179 -176.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 10.9 t -147.39 145.31 29.21 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 125.118 1.367 . . . . 0.0 113.288 -170.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 24.0 t80 -85.82 161.27 19.19 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.213 1.005 . . . . 0.0 112.729 172.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 27.8 p-80 . . . . . 0 C--O 1.252 1.213 0 C-N-CA 126.812 2.045 . . . . 0.0 113.246 -173.138 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.478 0.949 0 CA-C-O 119.788 -0.149 . . . . 0.0 110.888 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 24.1 ptt? -59.28 166.07 2.39 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 126.723 2.009 . . . . 0.0 115.13 -178.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 16.8 m -138.5 145.61 27.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 125.609 1.564 . . . . 0.0 111.459 175.312 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -83.39 140.65 32.27 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.201 0.6 . . . . 0.0 110.345 167.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.576 ' HB ' ' H ' ' A' ' 7' ' ' LEU . 63.1 p -139.98 141.76 36.36 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 122.727 1.251 . . . . 0.0 109.714 170.787 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.662 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -73.76 4.14 31.17 Favored Glycine 0 CA--C 1.529 0.932 0 CA-C-N 113.785 -1.552 . . . . 0.0 116.074 152.083 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.576 ' H ' ' HB ' ' A' ' 5' ' ' THR . 15.1 mt -71.02 153.9 94.43 Favored Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 120.708 2.254 . . . . 0.0 109.074 -173.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -77.3 -152.23 0.04 OUTLIER 'Trans proline' 0 CA--C 1.541 0.866 0 C-N-CA 122.253 1.969 . . . . 0.0 109.989 -178.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.09 -30.98 71.38 Favored 'General case' 0 CA--C 1.543 0.688 0 O-C-N 120.871 -1.143 . . . . 0.0 113.198 -178.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -91.74 74.26 1.54 Allowed Glycine 0 C--N 1.339 0.737 0 C-N-CA 126.799 2.142 . . . . 0.0 112.271 174.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 55.1 p-90 -109.71 -19.56 13.13 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 117.237 2.31 . . . . 0.0 117.237 -174.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -87.04 116.62 25.21 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 119.821 1.192 . . . . 0.0 111.198 -167.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.8 p -67.41 131.36 32.98 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 CA-C-N 119.449 1.022 . . . . 0.0 112.306 -177.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.3 mmt180 -139.36 162.01 36.06 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.109 1.763 . . . . 0.0 111.469 -173.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 2.1 t-80 -142.78 165.01 28.56 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.118 1.367 . . . . 0.0 111.74 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 68.4 m -136.08 173.9 11.21 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 125.27 1.428 . . . . 0.0 112.877 -169.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 10.4 p-10 -81.92 -11.51 58.86 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 115.581 1.697 . . . . 0.0 115.581 -171.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.3 t -127.27 -31.84 2.52 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 113.645 0.98 . . . . 0.0 113.645 -178.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 45.5 tttp -60.14 155.16 17.86 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.513 1.525 . . . . 0.0 112.208 170.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -106.63 -28.2 10.37 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.126 0.97 . . . . 0.0 113.502 175.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 8.5 mp -95.64 160.49 30.25 Favored Pre-proline 0 N--CA 1.476 0.843 0 C-N-CA 125.604 1.562 . . . . 0.0 111.972 175.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -79.11 174.26 12.34 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 123.324 2.683 . . . . 0.0 112.272 168.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 39.7 p90 -147.75 152.22 37.37 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 127.72 2.408 . . . . 0.0 109.876 172.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 -87.06 141.51 28.61 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.129 -0.982 . . . . 0.0 110.689 173.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -124.16 146.15 48.85 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 125.78 1.632 . . . . 0.0 111.52 -170.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 57.4 t-20 -97.94 113.73 64.14 Favored Pre-proline 0 CA--C 1.551 1.011 0 C-N-CA 124.066 0.947 . . . . 0.0 111.401 177.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -70.41 -30.37 19.36 Favored 'Trans proline' 0 C--N 1.354 0.821 0 C-N-CA 123.159 2.573 . . . . 0.0 113.552 178.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.28 -51.25 10.42 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-N 119.231 0.923 . . . . 0.0 112.036 -176.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 23.2 m -117.55 125.63 51.15 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.584 1.554 . . . . 0.0 107.917 177.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 46.4 mtm105 -62.89 107.56 1.01 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.956 1.253 . . . . 0.0 109.873 177.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -174.06 162.77 3.86 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 129.304 3.042 . . . . 0.0 109.127 -173.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 30.9 p -128.51 175.66 8.36 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.781 1.233 . . . . 0.0 114.234 -179.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.55 145.24 25.0 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 127.298 2.239 . . . . 0.0 109.06 174.057 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 2.0 m-90 -111.7 -23.26 10.74 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 121.295 -0.878 . . . . 0.0 113.162 -155.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -157.77 167.41 14.55 Favored Pre-proline 0 CA--C 1.55 0.959 0 C-N-CA 131.545 3.938 . . . . 0.0 106.373 -175.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -62.12 120.09 7.51 Favored 'Trans proline' 0 CA--C 1.551 1.328 0 CA-C-N 121.954 1.734 . . . . 0.0 110.201 172.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -85.37 -167.99 0.46 Allowed 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 124.391 3.394 . . . . 0.0 112.486 -171.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -75.06 -47.0 31.03 Favored 'General case' 0 CA--C 1.542 0.642 0 O-C-N 121.282 -0.886 . . . . 0.0 113.35 179.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -63.65 -13.08 39.3 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.03 1.332 . . . . 0.0 114.315 -175.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -71.0 164.94 24.52 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 127.872 2.469 . . . . 0.0 112.646 -171.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -110.05 24.87 12.45 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 121.267 -0.895 . . . . 0.0 112.482 -154.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.606 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 51.6 mtt -5.35 -45.39 0.0 OUTLIER 'General case' 0 CA--C 1.538 0.508 1 C-N-CA 132.103 4.161 . . . . 0.0 120.059 -176.122 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 18.6 tp10 -55.65 -42.66 75.34 Favored 'General case' 0 CA--C 1.55 0.96 0 CA-C-N 122.657 2.48 . . . . 0.0 112.564 170.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 18.3 m -73.33 -7.9 53.58 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 127.876 2.47 . . . . 0.0 113.25 172.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.662 HD13 ' N ' ' A' ' 6' ' ' GLY . 11.4 tp -121.71 -24.16 5.36 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 120.994 -1.066 . . . . 0.0 111.734 -163.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -57.81 -42.95 85.33 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 120.163 1.347 . . . . 0.0 110.091 163.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 21.7 ptp -61.83 -9.48 6.8 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.518 1.527 . . . . 0.0 114.521 172.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.0 t80 -109.65 -44.03 3.94 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.456 1.503 . . . . 0.0 112.885 176.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 12.2 mmt -78.22 -36.42 47.17 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 126.369 1.868 . . . . 0.0 113.328 -175.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -95.4 161.8 13.93 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 124.458 1.103 . . . . 0.0 112.557 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 38.0 p -89.89 -14.12 34.94 Favored 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 115.482 1.66 . . . . 0.0 115.482 -174.353 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -88.26 156.06 19.4 Favored 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 120.054 1.297 . . . . 0.0 113.558 -178.537 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 15.2 p-80 . . . . . 0 C--O 1.253 1.281 0 C-N-CA 125.343 1.457 . . . . 0.0 113.11 -178.473 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 18.1 m . . . . . 0 N--CA 1.474 0.732 0 N-CA-C 111.706 0.261 . . . . 0.0 111.706 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 96.3 mmm -82.05 117.86 22.57 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 108.249 -1.019 . . . . 0.0 108.249 162.204 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.8 m -159.44 138.19 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 125.988 1.715 . . . . 0.0 110.07 -172.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 56.0 m-80 -72.17 135.82 46.27 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.658 0.742 . . . . 0.0 111.887 173.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 77.1 p -124.02 148.41 47.04 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 126.751 2.02 . . . . 0.0 107.349 174.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.637 ' H ' HD13 ' A' ' 45' ' ' LEU . . . -76.62 2.47 58.54 Favored Glycine 0 CA--C 1.532 1.15 0 CA-C-O 118.681 -1.066 . . . . 0.0 114.545 157.257 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.434 ' HG ' HD11 ' A' ' 45' ' ' LEU . 14.7 mt -61.31 153.71 66.86 Favored Pre-proline 0 CA--C 1.541 0.611 0 CA-C-N 119.383 1.592 . . . . 0.0 110.012 -171.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -71.42 162.25 42.93 Favored 'Trans proline' 0 CA--C 1.54 0.788 0 CA-C-N 120.009 1.039 . . . . 0.0 109.632 -176.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.77 -25.82 8.36 Favored 'General case' 0 N--CA 1.476 0.843 0 N-CA-C 115.555 1.687 . . . . 0.0 115.555 -169.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -82.38 72.27 2.84 Favored Glycine 0 CA--C 1.529 0.964 0 C-N-CA 124.181 0.896 . . . . 0.0 111.119 166.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 2.1 p-90 -142.3 153.09 43.6 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.603 1.161 . . . . 0.0 114.113 169.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 174.72 124.96 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 130.589 3.556 . . . . 0.0 105.254 176.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 35.4 t -73.99 129.65 36.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 CA-C-N 121.329 1.877 . . . . 0.0 110.586 -174.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.0 mmt-85 -114.09 132.94 55.86 Favored 'General case' 0 C--O 1.227 -0.131 0 C-N-CA 126.029 1.732 . . . . 0.0 111.349 171.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 45.6 m80 -102.85 25.45 9.27 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.564 1.546 . . . . 0.0 112.201 170.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.1 m -77.98 54.24 1.28 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 126.21 1.804 . . . . 0.0 114.151 -171.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -155.59 138.0 14.91 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 126.468 1.907 . . . . 0.0 108.452 -177.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 17.6 t -62.45 -32.88 73.82 Favored 'General case' 0 C--N 1.32 -0.678 0 C-N-CA 125.715 1.606 . . . . 0.0 111.706 170.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -70.73 143.12 51.38 Favored 'General case' 0 CA--C 1.547 0.865 0 O-C-N 121.049 -1.032 . . . . 0.0 110.828 167.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 76.9 m-20 -82.17 32.78 0.39 Allowed 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 125.366 1.466 . . . . 0.0 114.475 -165.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -107.6 157.88 34.71 Favored Pre-proline 0 N--CA 1.474 0.741 0 C-N-CA 125.821 1.648 . . . . 0.0 110.869 175.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -86.92 172.18 6.53 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 123.622 2.882 . . . . 0.0 110.329 164.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 49.0 p90 -142.21 165.54 27.15 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.027 1.331 . . . . 0.0 109.214 151.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -98.8 125.08 44.07 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 120.782 -1.199 . . . . 0.0 110.475 176.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -74.11 149.23 41.16 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 120.64 -1.288 . . . . 0.0 110.709 168.02 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -99.02 96.91 4.48 Favored Pre-proline 0 CA--C 1.545 0.765 0 C-N-CA 122.996 0.518 . . . . 0.0 110.365 173.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -66.49 -29.45 44.77 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.453 2.102 . . . . 0.0 112.519 171.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -70.54 -19.11 62.92 Favored 'General case' 0 CA--C 1.546 0.804 0 N-CA-C 114.952 1.464 . . . . 0.0 114.952 -174.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 4.5 m -174.27 130.31 0.37 Allowed 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 129.042 2.937 . . . . 0.0 106.476 177.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 55.5 mtt85 -61.33 108.55 0.95 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.946 0.898 . . . . 0.0 111.011 -170.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -170.98 -180.0 2.93 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 130.552 3.541 . . . . 0.0 106.752 -170.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 14.8 m -149.97 130.25 13.71 Favored 'General case' 0 CA--C 1.544 0.75 0 O-C-N 119.463 -2.023 . . . . 0.0 111.963 165.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 12.8 tpp180 -86.91 121.72 29.77 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 127.583 2.353 . . . . 0.0 110.557 -178.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -76.16 -32.99 59.35 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 127.105 2.162 . . . . 0.0 114.209 -168.339 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -166.21 168.9 7.09 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 127.304 2.241 . . . . 0.0 108.565 -172.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_exo -55.66 124.75 17.06 Favored 'Trans proline' 0 CA--C 1.545 1.042 0 C-N-CA 122.69 2.26 . . . . 0.0 112.551 179.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -85.29 -168.86 0.54 Allowed 'Trans proline' 0 CA--C 1.539 0.744 0 C-N-CA 124.761 3.641 . . . . 0.0 111.644 178.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -78.0 -42.75 31.66 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.061 0.945 . . . . 0.0 113.461 177.203 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -78.87 5.64 11.0 Favored 'General case' 0 N--CA 1.48 1.055 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 -172.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.5 t -74.41 152.02 39.57 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 126.188 1.795 . . . . 0.0 112.241 177.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -105.14 48.3 0.84 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.384 1.074 . . . . 0.0 112.905 -155.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.427 ' O ' ' HE3' ' A' ' 46' ' ' LYS . 65.2 mtm -22.07 -47.2 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 118.792 2.886 . . . . 0.0 118.792 -169.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -51.65 -42.61 62.2 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-N 123.335 2.788 . . . . 0.0 113.328 175.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 55.9 m -75.07 -23.08 57.97 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.098 1.359 . . . . 0.0 112.023 173.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.637 HD13 ' H ' ' A' ' 6' ' ' GLY . 3.2 mm? -79.87 -19.84 47.33 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-O 116.781 -1.58 . . . . 0.0 113.139 171.128 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.427 ' HE3' ' O ' ' A' ' 42' ' ' MET . 8.0 mmpt? -69.01 -23.37 64.08 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 122.289 2.313 . . . . 0.0 111.751 -172.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.2 ptm -70.21 -17.89 63.16 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.485 1.514 . . . . 0.0 113.998 168.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.508 ' CD2' HD12 ' A' ' 45' ' ' LEU . 47.1 t80 -107.2 -61.75 1.51 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.967 2.507 . . . . 0.0 112.157 -171.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 27.9 mtp -66.74 -7.73 23.16 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 126.967 2.107 . . . . 0.0 114.489 -178.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -151.69 152.56 32.95 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.371 1.468 . . . . 0.0 109.997 163.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 6.4 t -139.12 -22.14 0.93 Allowed 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 118.022 -0.989 . . . . 0.0 112.929 170.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 34.5 t80 -55.51 144.02 27.49 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.384 1.474 . . . . 0.0 111.908 171.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.9 p80 . . . . . 0 C--O 1.251 1.174 0 CA-C-O 116.669 -1.634 . . . . 0.0 114.025 -167.604 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 14.2 m . . . . . 0 N--CA 1.473 0.722 0 CA-C-O 119.363 -0.351 . . . . 0.0 110.693 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 34.3 tpp -112.69 125.37 54.23 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.393 1.077 . . . . 0.0 111.294 174.03 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 27.5 m -71.95 140.1 18.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 175.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -95.49 142.79 27.43 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 125.029 1.332 . . . . 0.0 109.514 159.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.577 ' HB ' ' H ' ' A' ' 7' ' ' LEU . 76.2 p -133.93 144.14 48.65 Favored 'General case' 0 CA--C 1.514 -0.416 0 C-N-CA 126.085 1.754 . . . . 0.0 108.814 174.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.41 ' H ' HD23 ' A' ' 45' ' ' LEU . . . -78.44 3.11 64.15 Favored Glycine 0 CA--C 1.534 1.249 0 CA-C-O 119.015 -0.88 . . . . 0.0 113.141 155.143 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.577 ' H ' ' HB ' ' A' ' 5' ' ' THR . 37.6 mt -61.91 153.78 71.13 Favored Pre-proline 0 CA--C 1.545 0.775 0 CA-C-N 119.881 1.841 . . . . 0.0 110.594 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -80.52 -149.5 0.04 OUTLIER 'Trans proline' 0 CA--C 1.544 1.0 0 C-N-CA 122.695 2.263 . . . . 0.0 110.419 -176.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.24 4.65 0.2 Allowed 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 115.825 1.787 . . . . 0.0 115.825 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -127.92 97.34 0.45 Allowed Glycine 0 C--N 1.338 0.648 0 C-N-CA 127.115 2.293 . . . . 0.0 109.501 171.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 61.8 p-90 -139.47 -23.84 0.87 Allowed 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 116.445 2.017 . . . . 0.0 116.445 -165.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -83.14 105.22 13.94 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 119.131 0.878 . . . . 0.0 109.366 -169.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 6.1 p -70.49 128.18 33.42 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 CA-C-N 119.219 0.918 . . . . 0.0 112.732 -169.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.5 mmp_? -128.46 165.09 21.34 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.767 2.027 . . . . 0.0 110.895 179.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 3.1 p80 -168.02 -179.52 4.17 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 126.121 1.769 . . . . 0.0 112.06 179.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 13.2 m -145.95 166.42 26.07 Favored 'General case' 0 N--CA 1.476 0.868 0 O-C-N 120.48 -1.387 . . . . 0.0 112.499 177.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -60.13 -44.22 95.07 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.844 1.257 . . . . 0.0 113.812 -174.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 2.5 m -87.16 -5.82 58.86 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.527 1.131 . . . . 0.0 112.751 174.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -133.8 67.75 1.51 Allowed 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.566 1.546 . . . . 0.0 110.642 -174.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 23.0 m-80 -65.37 -24.81 67.34 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.407 1.483 . . . . 0.0 113.892 -174.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -74.14 119.41 76.19 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 123.819 0.847 . . . . 0.0 108.866 178.485 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -76.99 166.32 26.96 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 123.145 2.564 . . . . 0.0 113.98 -165.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 44.1 p90 -137.48 146.08 43.82 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 126.154 1.782 . . . . 0.0 110.959 171.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -93.65 118.46 31.41 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.157 -0.964 . . . . 0.0 110.578 178.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 68.7 t80 -81.33 138.67 35.65 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.719 1.208 . . . . 0.0 112.055 -175.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -92.69 117.83 67.73 Favored Pre-proline 0 CA--C 1.546 0.817 0 C-N-CA 124.424 1.089 . . . . 0.0 109.101 172.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -69.87 -46.1 1.3 Allowed 'Trans proline' 0 C--N 1.35 0.623 0 C-N-CA 121.907 1.738 . . . . 0.0 112.664 179.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -90.73 9.48 29.79 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 115.254 1.576 . . . . 0.0 115.254 -170.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 92.6 m -151.85 140.89 21.19 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.906 1.683 . . . . 0.0 109.715 -176.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 64.7 mtp85 -70.95 95.71 1.21 Allowed 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.593 0.757 . . . . 0.0 108.994 168.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -174.66 157.42 2.53 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.608 1.963 . . . . 0.0 110.452 -169.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.3 p -139.84 133.19 29.97 Favored 'General case' 0 C--N 1.326 -0.446 0 C-N-CA 123.804 0.842 . . . . 0.0 110.394 159.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 4.3 tpp180 -81.87 117.31 22.04 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-O 122.231 1.015 . . . . 0.0 109.767 174.336 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -88.25 -22.25 24.05 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.573 1.549 . . . . 0.0 113.975 -170.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -160.55 156.28 22.13 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 127.608 2.363 . . . . 0.0 108.537 -164.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -68.32 119.46 6.46 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 123.058 2.505 . . . . 0.0 112.141 -170.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 78.8 Cg_endo -84.07 -168.04 0.51 Allowed 'Trans proline' 0 CA--C 1.541 0.834 0 C-N-CA 124.628 3.552 . . . . 0.0 111.92 -177.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -88.21 -31.43 19.08 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.062 1.345 . . . . 0.0 112.896 171.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -69.83 -3.13 14.32 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 125.302 1.441 . . . . 0.0 113.492 -179.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.1 t -80.92 159.4 24.97 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 126.743 2.017 . . . . 0.0 112.112 176.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 47.1 t0 -123.68 59.7 1.11 Allowed 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 127.151 2.18 . . . . 0.0 111.333 -162.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 2.2 mpp? -32.92 -38.15 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 116.922 2.193 . . . . 0.0 116.922 173.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.09 -40.5 67.29 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 121.269 1.85 . . . . 0.0 113.002 171.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 55.2 m -80.46 -26.31 38.39 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 125.918 1.687 . . . . 0.0 111.712 168.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.41 HD23 ' H ' ' A' ' 6' ' ' GLY . 0.1 OUTLIER -94.1 -24.57 17.52 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 -161.558 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.75 -13.79 62.46 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 121.744 2.066 . . . . 0.0 112.101 172.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 23.7 mmt -71.15 -12.17 61.34 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.171 0.988 . . . . 0.0 113.518 164.018 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 75.2 t80 -113.1 -50.82 2.86 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 126.213 1.805 . . . . 0.0 112.118 -179.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 82.8 mmm -77.09 -4.28 43.57 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 126.696 1.998 . . . . 0.0 114.174 179.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -148.28 172.66 14.01 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.325 1.85 . . . . 0.0 109.856 170.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 3.9 t -137.07 158.63 44.01 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.935 1.294 . . . . 0.0 110.198 177.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -97.26 131.1 44.3 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.568 1.147 . . . . 0.0 111.981 177.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 14.5 t-80 . . . . . 0 C--O 1.254 1.295 0 C-N-CA 125.737 1.615 . . . . 0.0 113.681 -179.605 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 4.5 m . . . . . 0 N--CA 1.478 0.949 0 N-CA-C 111.525 0.194 . . . . 0.0 111.525 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -102.29 174.01 6.11 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 125.628 1.571 . . . . 0.0 111.296 177.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 14.9 m -132.21 137.85 53.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 125.117 1.367 . . . . 0.0 111.759 173.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -98.55 122.08 41.3 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.435 1.094 . . . . 0.0 109.525 168.734 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 32.6 p -117.02 124.15 48.61 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.343 1.457 . . . . 0.0 108.701 -175.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.464 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -69.78 41.45 0.43 Allowed Glycine 0 CA--C 1.532 1.128 0 CA-C-O 118.768 -1.018 . . . . 0.0 115.381 158.596 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.1 mt -85.67 168.18 21.07 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 125.858 1.663 . . . . 0.0 110.432 179.408 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -75.26 -157.29 0.06 OUTLIER 'Trans proline' 0 CA--C 1.548 1.196 0 C-N-CA 122.576 2.184 . . . . 0.0 111.197 176.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.02 -33.98 74.12 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.541 -1.35 . . . . 0.0 112.645 173.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -80.24 62.25 4.29 Favored Glycine 0 CA--C 1.526 0.772 0 C-N-CA 125.522 1.534 . . . . 0.0 112.398 171.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 36.0 p-90 -108.14 -17.65 13.97 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 115.445 1.646 . . . . 0.0 115.445 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -72.45 103.22 3.41 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 119.282 0.946 . . . . 0.0 110.113 -167.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.3 p -67.86 120.85 15.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 CA-C-N 118.589 0.632 . . . . 0.0 110.708 -174.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -107.12 139.12 42.03 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.852 1.261 . . . . 0.0 108.812 166.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 3.6 p80 -157.19 -178.95 7.74 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.53 1.132 . . . . 0.0 111.523 -169.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.6 m -135.49 174.18 10.89 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.318 1.447 . . . . 0.0 111.608 177.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 97.4 m-20 -112.21 -27.62 8.27 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.729 1.211 . . . . 0.0 111.747 166.058 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 49.8 m -82.2 -6.16 59.01 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.534 1.134 . . . . 0.0 113.538 171.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.2 mmmt -133.75 165.26 25.37 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 128.231 2.613 . . . . 0.0 108.794 163.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 49.3 t-20 -136.94 65.79 1.49 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.142 0.977 . . . . 0.0 111.947 -179.17 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -156.17 123.99 2.82 Favored Pre-proline 0 CA--C 1.549 0.906 0 C-N-CA 125.015 1.326 . . . . 0.0 109.43 173.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -88.6 168.21 5.98 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.73 2.953 . . . . 0.0 112.634 -173.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 44.4 p90 -139.19 132.71 30.32 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.887 0.875 . . . . 0.0 110.759 156.639 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -86.73 116.51 24.87 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.943 0.897 . . . . 0.0 109.242 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -101.19 142.62 32.35 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.567 1.147 . . . . 0.0 112.61 -165.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 58.5 t-20 -98.53 114.78 65.68 Favored Pre-proline 0 CA--C 1.551 0.985 0 C-N-CA 124.975 1.31 . . . . 0.0 109.3 166.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -81.34 -23.13 5.31 Favored 'Trans proline' 0 C--N 1.351 0.664 0 C-N-CA 123.371 2.714 . . . . 0.0 114.298 178.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -78.85 -33.11 46.16 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-N 119.384 0.993 . . . . 0.0 112.115 -176.124 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 70.9 m -134.56 110.74 9.54 Favored 'General case' 0 N--CA 1.467 0.39 0 C-N-CA 126.201 1.8 . . . . 0.0 106.36 170.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 76.3 mtt85 -57.24 106.9 0.37 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.615 0.766 . . . . 0.0 111.025 -172.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -166.6 153.65 9.24 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.208 1.803 . . . . 0.0 109.896 -168.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 97.4 p -124.11 163.64 21.08 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 114.439 1.274 . . . . 0.0 114.439 178.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.37 152.05 48.07 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 128.632 2.773 . . . . 0.0 108.483 176.382 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -125.3 -26.88 3.56 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 -153.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 75.2 mt-10 -154.15 170.49 8.36 Favored Pre-proline 0 CA--C 1.552 1.033 0 C-N-CA 130.181 3.392 . . . . 0.0 106.316 177.286 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -54.11 122.05 10.74 Favored 'Trans proline' 0 CA--C 1.546 1.118 0 C-N-CA 122.803 2.335 . . . . 0.0 112.129 172.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -90.29 -162.1 0.11 Allowed 'Trans proline' 0 CA--C 1.546 1.082 0 C-N-CA 124.215 3.276 . . . . 0.0 110.658 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -102.1 -27.06 13.13 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 -178.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -80.87 10.1 5.49 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 125.637 1.575 . . . . 0.0 113.19 177.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -77.08 -177.94 4.75 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 129.687 3.195 . . . . 0.0 112.924 -177.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -90.42 -54.27 4.08 Favored 'General case' 0 N--CA 1.48 1.053 0 CA-C-O 122.975 1.369 . . . . 0.0 109.548 -175.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.464 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 8.7 ttp 86.6 -43.0 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 129.711 3.204 . . . . 0.0 114.078 170.504 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -64.8 -48.37 74.7 Favored 'General case' 0 N--CA 1.481 1.106 0 CA-C-N 121.494 1.952 . . . . 0.0 111.904 178.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 16.0 m -60.72 -21.58 63.09 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 125.656 1.582 . . . . 0.0 111.463 167.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.464 ' HB3' ' HA ' ' A' ' 42' ' ' MET . 11.1 tp -93.69 -21.66 19.21 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 118.014 -0.993 . . . . 0.0 111.197 -170.576 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.488 ' HE2' ' HA ' ' A' ' 46' ' ' LYS . 7.9 mmpt? -60.97 -40.62 94.09 Favored 'General case' 0 N--CA 1.472 0.674 0 CA-C-N 120.889 1.677 . . . . 0.0 111.229 171.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 13.7 ptt? -67.88 6.95 0.59 Allowed 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 172.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -124.11 -44.4 2.04 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.106 1.762 . . . . 0.0 112.572 172.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 92.4 mtp -66.25 -24.67 66.63 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 126.819 2.048 . . . . 0.0 112.496 177.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -128.61 158.44 38.48 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.588 1.555 . . . . 0.0 111.772 172.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 87.1 m -82.17 137.69 34.88 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 125.167 1.387 . . . . 0.0 108.625 168.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 92.5 t80 -118.36 121.9 41.5 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.036 1.334 . . . . 0.0 110.952 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.6 p80 . . . . . 0 C--O 1.249 1.04 0 C-N-CA 125.328 1.451 . . . . 0.0 113.365 -173.052 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 77.6 p . . . . . 0 N--CA 1.476 0.841 0 CA-C-O 119.798 -0.144 . . . . 0.0 111.322 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 22.5 ptt? -151.75 20.74 0.7 Allowed 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 116.491 2.034 . . . . 0.0 116.491 -162.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 6.0 m -82.42 151.88 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.315 0 CA-C-N 120.238 1.381 . . . . 0.0 110.87 168.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -84.1 122.59 29.02 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 122.07 -0.393 . . . . 0.0 110.351 172.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.476 ' HB ' ' H ' ' A' ' 7' ' ' LEU . 73.7 p -126.5 146.68 50.02 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.268 1.427 . . . . 0.0 108.396 168.024 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.522 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -80.94 16.32 16.22 Favored Glycine 0 CA--C 1.532 1.148 0 N-CA-C 115.537 0.975 . . . . 0.0 115.537 150.433 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.476 ' H ' ' HB ' ' A' ' 5' ' ' THR . 13.4 mt -68.82 157.41 88.86 Favored Pre-proline 0 CA--C 1.548 0.894 0 CA-C-N 119.995 1.898 . . . . 0.0 110.292 -176.037 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -73.98 -170.48 0.71 Allowed 'Trans proline' 0 CA--C 1.539 0.729 0 C-N-CA 122.927 2.418 . . . . 0.0 109.494 177.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.43 -23.15 9.16 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 114.956 1.465 . . . . 0.0 114.956 -175.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -88.45 77.47 1.82 Allowed Glycine 0 CA--C 1.527 0.833 0 C-N-CA 126.173 1.844 . . . . 0.0 111.864 165.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 1.7 p90 -110.83 -8.69 14.51 Favored 'General case' 0 CA--C 1.547 0.865 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 -177.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -89.18 110.25 21.02 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 120.228 1.376 . . . . 0.0 111.338 -172.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.6 p -61.15 136.72 24.43 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 O-C-N 121.101 -1.0 . . . . 0.0 112.658 179.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.7 mmp_? -133.28 112.97 12.1 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.892 1.677 . . . . 0.0 109.848 174.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 31.1 p80 -103.77 155.2 18.78 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.415 1.086 . . . . 0.0 112.122 173.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 99.4 p -161.35 158.2 26.57 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 125.126 1.371 . . . . 0.0 110.707 -172.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.9 p30 -75.27 -18.91 59.96 Favored 'General case' 0 CA--C 1.548 0.878 0 O-C-N 120.416 -1.428 . . . . 0.0 113.538 177.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 1.7 m -75.86 -30.05 58.76 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.456 1.502 . . . . 0.0 112.811 -175.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -109.08 146.11 34.54 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.262 1.425 . . . . 0.0 111.239 -176.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -88.69 12.29 15.22 Favored 'General case' 0 CA--C 1.555 1.15 0 N-CA-C 114.313 1.227 . . . . 0.0 114.313 -178.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -166.33 159.26 12.16 Favored Pre-proline 0 CA--C 1.547 0.833 0 C-N-CA 127.335 2.254 . . . . 0.0 109.338 172.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_endo -75.16 169.45 22.53 Favored 'Trans proline' 0 N--CA 1.455 -0.755 0 C-N-CA 122.964 2.443 . . . . 0.0 111.576 -178.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 52.9 p90 -126.49 148.05 49.74 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.404 1.082 . . . . 0.0 111.125 168.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 56.8 m-85 -103.73 107.25 18.03 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.582 0.753 . . . . 0.0 109.836 -175.341 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 61.5 t80 -95.3 149.75 21.0 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 125.929 1.692 . . . . 0.0 112.959 -165.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 61.0 t-20 -99.34 113.73 65.04 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 125.135 1.374 . . . . 0.0 110.018 171.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.2 -29.67 14.06 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.871 2.381 . . . . 0.0 113.533 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -80.91 -38.24 28.25 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -171.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 92.2 m -127.85 138.92 52.87 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 126.264 1.826 . . . . 0.0 107.898 169.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 84.8 mtm-85 -61.67 104.43 0.43 Allowed 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 119.127 0.876 . . . . 0.0 111.071 178.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -163.62 153.56 15.16 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.915 1.286 . . . . 0.0 111.983 178.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 31.4 t -133.69 152.75 51.96 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 125.369 1.467 . . . . 0.0 111.093 176.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.7 tpp180 -128.0 136.82 51.81 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 125.612 1.565 . . . . 0.0 110.486 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -126.11 0.88 7.19 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.587 1.555 . . . . 0.0 113.324 -157.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -169.17 156.28 6.69 Favored Pre-proline 0 CA--C 1.544 0.714 0 C-N-CA 128.772 2.829 . . . . 0.0 107.69 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -62.09 113.37 1.85 Allowed 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.282 2.655 . . . . 0.0 110.483 175.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -85.56 159.28 10.8 Favored 'Trans proline' 0 C--N 1.346 0.445 0 C-N-CA 122.773 2.315 . . . . 0.0 112.253 -171.348 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -57.48 -22.02 41.2 Favored 'General case' 0 CA--C 1.547 0.842 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 178.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -81.36 -15.32 55.63 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 126.279 1.832 . . . . 0.0 113.797 -179.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -74.62 179.01 4.97 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 125.597 1.559 . . . . 0.0 112.989 -170.283 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 66.9 m-20 -130.12 51.33 2.11 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 122.105 0.955 . . . . 0.0 111.363 -160.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.503 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 32.6 mtt -27.3 -42.28 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 128.195 2.598 . . . . 0.0 116.113 169.62 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -48.24 -42.44 30.39 Favored 'General case' 0 N--CA 1.48 1.063 0 CA-C-N 121.316 1.871 . . . . 0.0 113.751 173.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 81.3 m -82.87 -26.25 31.76 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 127.216 2.207 . . . . 0.0 112.399 173.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.522 HD13 ' N ' ' A' ' 6' ' ' GLY . 43.9 tp -109.9 -16.51 13.84 Favored 'General case' 0 C--N 1.326 -0.442 0 C-N-CA 124.423 1.089 . . . . 0.0 112.244 -151.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.33 -34.17 66.32 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 120.673 -1.267 . . . . 0.0 111.336 159.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.7 mmt -60.9 -22.31 64.21 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 123.614 0.766 . . . . 0.0 112.751 173.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -103.51 -36.05 8.1 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.306 1.842 . . . . 0.0 112.801 -177.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 29.2 mtp -95.34 -1.37 51.38 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.046 1.738 . . . . 0.0 114.824 -178.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -151.11 67.24 0.91 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.188 1.795 . . . . 0.0 111.686 170.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 2.1 t -78.57 -10.68 59.82 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 115.139 1.533 . . . . 0.0 115.139 -172.095 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -65.47 137.1 57.22 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-N 119.699 1.136 . . . . 0.0 113.027 175.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 . . . . . 0 C--O 1.249 1.069 0 C-N-CA 125.058 1.343 . . . . 0.0 113.811 -176.286 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 43.3 m . . . . . 0 N--CA 1.473 0.709 0 N-CA-C 110.533 -0.173 . . . . 0.0 110.533 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -68.9 139.31 55.13 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.747 0.819 . . . . 0.0 111.196 179.055 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 3.4 m -150.55 127.82 2.35 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 C-N-CA 124.833 1.253 . . . . 0.0 110.606 -176.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 -69.61 123.46 21.39 Favored 'General case' 0 C--O 1.237 0.408 0 O-C-N 121.777 -0.577 . . . . 0.0 110.386 175.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 73.9 p -127.99 149.69 50.24 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 125.666 1.586 . . . . 0.0 108.304 173.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -77.57 6.04 48.25 Favored Glycine 0 CA--C 1.529 0.938 0 CA-C-O 118.223 -1.321 . . . . 0.0 115.125 155.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 27.9 mt -62.13 150.2 84.58 Favored Pre-proline 0 CA--C 1.544 0.714 0 CA-C-N 120.141 1.971 . . . . 0.0 111.986 -168.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_endo -70.47 159.95 51.15 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 122.17 1.913 . . . . 0.0 109.868 -176.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -52.31 -35.62 51.02 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 116.717 2.117 . . . . 0.0 116.717 -154.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -93.22 74.0 1.26 Allowed Glycine 0 CA--C 1.524 0.655 0 C-N-CA 125.894 1.711 . . . . 0.0 111.362 -177.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 11.4 p-90 -136.04 154.19 51.12 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.933 1.293 . . . . 0.0 113.556 178.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.3 tp10 -169.76 128.07 0.93 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 129.575 3.15 . . . . 0.0 104.578 177.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.9 t -79.93 130.6 35.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 CA-C-N 120.044 1.293 . . . . 0.0 109.814 -171.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.1 mmt180 -138.07 156.95 47.27 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 124.808 1.243 . . . . 0.0 111.839 177.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 10.7 p-80 -168.59 152.29 5.63 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.243 1.017 . . . . 0.0 113.156 -169.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 82.6 p -171.37 163.68 6.96 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 125.772 1.629 . . . . 0.0 109.987 -170.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -65.25 -5.74 7.86 Favored 'General case' 0 CA--C 1.554 1.128 0 N-CA-C 113.61 0.967 . . . . 0.0 113.61 179.485 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.6 t -73.77 -19.96 60.62 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.131 1.772 . . . . 0.0 113.089 170.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -146.81 138.87 24.65 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 120.436 -1.415 . . . . 0.0 113.905 -178.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -76.11 -40.85 51.98 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.179 0.992 . . . . 0.0 112.854 -170.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 7.9 mp -100.92 155.21 36.58 Favored Pre-proline 0 CA--C 1.54 0.573 0 C-N-CA 125.157 1.383 . . . . 0.0 109.91 169.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -63.29 155.21 63.2 Favored 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 122.91 2.407 . . . . 0.0 111.113 175.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 34.0 p90 -116.04 140.87 48.83 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 125.832 1.653 . . . . 0.0 109.429 171.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 22.7 m-85 -94.9 95.67 8.8 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-O 121.9 0.857 . . . . 0.0 108.745 -175.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -63.21 137.9 58.37 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.929 1.692 . . . . 0.0 110.171 177.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 56.3 t-20 -82.58 116.9 66.44 Favored Pre-proline 0 CA--C 1.553 1.079 0 O-C-N 121.531 -0.731 . . . . 0.0 110.044 173.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.9 -19.87 34.89 Favored 'Trans proline' 0 C--N 1.353 0.778 0 C-N-CA 123.611 2.874 . . . . 0.0 114.358 -179.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -88.45 -97.71 0.09 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.708 0.803 . . . . 0.0 109.865 179.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.8 p -63.91 150.54 44.77 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.367 1.467 . . . . 0.0 110.696 171.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 1.3 mpp_? -79.74 95.25 5.92 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 121.602 -0.686 . . . . 0.0 109.243 -178.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -159.73 -177.65 6.51 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.223 1.409 . . . . 0.0 110.243 -179.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 80.3 p -158.09 146.15 18.64 Favored 'General case' 0 N--CA 1.47 0.528 0 O-C-N 120.422 -1.424 . . . . 0.0 112.595 177.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 15.8 tpp180 -101.26 131.69 47.15 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 127.071 2.148 . . . . 0.0 108.953 172.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 1.4 m-90 -86.05 -37.38 18.96 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 122.276 1.036 . . . . 0.0 113.476 -163.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -154.11 162.96 25.58 Favored Pre-proline 0 CA--C 1.54 0.577 0 C-N-CA 129.112 2.965 . . . . 0.0 106.709 -167.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -57.95 117.72 4.48 Favored 'Trans proline' 0 CA--C 1.543 0.942 0 C-N-CA 122.343 2.029 . . . . 0.0 110.547 176.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.463 ' O ' HG22 ' A' ' 40' ' ' THR . 91.9 Cg_endo -78.79 168.63 20.71 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 124.077 3.185 . . . . 0.0 111.165 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -60.27 -30.28 69.35 Favored 'General case' 0 CA--C 1.547 0.856 0 O-C-N 121.648 -0.657 . . . . 0.0 112.656 170.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -65.17 -9.44 23.17 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 127.092 2.157 . . . . 0.0 115.781 -176.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.463 HG22 ' O ' ' A' ' 37' ' ' PRO . 6.2 t -87.72 167.45 13.84 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 126.02 1.728 . . . . 0.0 112.748 -170.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -95.53 54.54 1.59 Allowed 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 125.506 1.522 . . . . 0.0 110.687 -176.457 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.472 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 33.5 mtt -30.36 -39.0 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 127.416 2.286 . . . . 0.0 115.921 173.275 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -54.53 -39.19 67.41 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 121.505 1.957 . . . . 0.0 114.01 172.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 84.8 m -82.37 -16.02 50.66 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 127.616 2.366 . . . . 0.0 112.735 172.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.472 ' HB3' ' HA ' ' A' ' 42' ' ' MET . 3.0 tm? -123.48 -20.17 5.65 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.218 -0.926 . . . . 0.0 112.833 -151.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.63 -26.34 66.95 Favored 'General case' 0 N--CA 1.475 0.779 0 O-C-N 120.16 -1.588 . . . . 0.0 111.524 156.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 4.4 mmt -67.09 -19.55 65.66 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.758 0.823 . . . . 0.0 112.906 170.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -104.39 -54.02 2.61 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 125.31 1.444 . . . . 0.0 112.139 -177.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 68.5 mmm -65.48 -17.43 64.55 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 126.598 1.959 . . . . 0.0 113.448 -179.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -139.14 178.93 6.82 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.337 1.855 . . . . 0.0 110.197 172.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 20.2 p -108.21 98.88 8.36 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.369 1.067 . . . . 0.0 112.265 -172.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 51.1 t80 -81.29 171.57 14.66 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 127.528 2.331 . . . . 0.0 112.077 173.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 51.3 t-80 . . . . . 0 C--O 1.255 1.348 0 C-N-CA 124.719 1.207 . . . . 0.0 112.722 -173.457 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 75.2 m . . . . . 0 N--CA 1.474 0.755 0 CA-C-O 119.162 -0.447 . . . . 0.0 110.177 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 27.2 ttt -147.43 94.77 2.43 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.536 0.734 . . . . 0.0 111.403 176.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -161.7 148.7 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 125.737 1.615 . . . . 0.0 111.94 -166.235 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -82.94 93.78 7.6 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.283 1.033 . . . . 0.0 110.337 172.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.5 p -100.15 135.0 42.25 Favored 'General case' 0 CA--C 1.506 -0.731 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 176.105 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.52 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -76.29 26.39 1.55 Allowed Glycine 0 CA--C 1.532 1.127 0 CA-C-O 117.924 -1.487 . . . . 0.0 116.101 151.207 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 16.0 mt -71.58 160.36 82.81 Favored Pre-proline 0 CA--C 1.547 0.84 0 CA-C-N 121.135 2.468 . . . . 0.0 110.533 -178.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 81.2 Cg_endo -72.94 168.98 23.28 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 120.992 1.128 . . . . 0.0 111.147 -175.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.35 -21.15 5.27 Favored 'General case' 0 CA--C 1.547 0.862 0 N-CA-C 118.305 2.706 . . . . 0.0 118.305 -157.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -138.32 94.34 0.21 Allowed Glycine 0 N--CA 1.468 0.777 0 C-N-CA 124.87 1.224 . . . . 0.0 112.692 -179.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 33.5 p-90 -135.06 159.59 41.02 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.095 1.358 . . . . 0.0 114.028 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -150.43 150.28 31.15 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 127.418 2.287 . . . . 0.0 107.829 166.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 2.3 p -87.85 146.75 5.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 CA-C-N 120.774 1.625 . . . . 0.0 110.852 172.342 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -127.98 113.17 15.49 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.73 1.612 . . . . 0.0 110.779 174.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 45.1 p-80 -78.7 149.61 32.73 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 123.659 0.784 . . . . 0.0 110.92 160.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.9 t -162.81 132.59 4.39 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 121.27 -0.894 . . . . 0.0 112.015 178.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 10.5 m-20 -68.28 -7.92 35.04 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 124.708 1.203 . . . . 0.0 113.337 176.37 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 7.8 t -75.59 -19.5 59.21 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.956 1.303 . . . . 0.0 112.833 167.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -116.78 161.02 19.92 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.67 1.588 . . . . 0.0 111.863 -170.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 94.4 m-20 -89.69 -39.1 13.41 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.625 0.77 . . . . 0.0 112.247 173.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -104.69 176.43 1.75 Allowed Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 127.127 2.171 . . . . 0.0 110.102 176.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -69.58 157.91 59.06 Favored 'Trans proline' 0 N--CA 1.459 -0.555 0 C-N-CA 122.456 2.104 . . . . 0.0 110.832 155.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 47.6 p90 -120.07 163.89 16.98 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.889 0.876 . . . . 0.0 109.963 157.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 93.9 m-85 -101.61 137.88 39.33 Favored 'General case' 0 N--CA 1.471 0.607 0 O-C-N 120.938 -1.102 . . . . 0.0 110.973 176.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -97.42 150.59 20.86 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 124.724 1.209 . . . . 0.0 109.977 169.669 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 26.7 m120 -115.2 99.13 51.95 Favored Pre-proline 0 CA--C 1.541 0.627 0 C-N-CA 124.486 1.114 . . . . 0.0 110.97 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -69.31 -22.75 33.7 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 122.419 2.079 . . . . 0.0 115.05 -173.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -75.81 -41.58 52.36 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 119.762 1.164 . . . . 0.0 113.517 -177.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 23.0 m -131.19 100.42 5.19 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 107.207 -1.405 . . . . 0.0 107.207 168.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -47.82 110.12 0.29 Allowed 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 125.533 1.533 . . . . 0.0 112.198 -171.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -174.23 177.14 2.34 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 127.834 2.453 . . . . 0.0 107.839 -169.08 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 69.5 p -117.69 171.53 7.97 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 120.898 -1.127 . . . . 0.0 112.846 170.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -137.5 139.69 40.69 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 127.13 2.172 . . . . 0.0 109.103 175.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -126.02 -46.57 1.67 Allowed 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.155 -0.929 . . . . 0.0 112.444 -152.228 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 31.9 mt-10 -144.56 150.84 48.78 Favored Pre-proline 0 CA--C 1.542 0.657 0 C-N-CA 127.917 2.487 . . . . 0.0 107.478 -179.438 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_endo -56.53 115.38 2.44 Favored 'Trans proline' 0 CA--C 1.545 1.03 0 C-N-CA 123.597 2.865 . . . . 0.0 112.956 -159.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -74.43 163.81 35.38 Favored 'Trans proline' 0 C--N 1.353 0.811 0 C-N-CA 123.657 2.905 . . . . 0.0 112.147 -172.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -67.11 -21.85 65.84 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 -172.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -78.82 -21.38 47.79 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.127 1.371 . . . . 0.0 112.899 172.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -71.18 156.47 39.53 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.528 1.531 . . . . 0.0 112.926 -170.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -108.95 49.53 0.81 Allowed 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 125.544 1.538 . . . . 0.0 110.723 -164.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.479 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 72.3 mtm -25.29 -47.42 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 127.029 2.132 . . . . 0.0 115.296 173.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -50.19 -46.82 54.64 Favored 'General case' 0 CA--C 1.55 0.946 0 CA-C-N 121.694 2.043 . . . . 0.0 114.5 174.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 99.2 m -68.39 -38.44 81.34 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.189 1.796 . . . . 0.0 111.665 169.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.52 HD13 ' N ' ' A' ' 6' ' ' GLY . 54.2 tp -94.27 -16.68 23.36 Favored 'General case' 0 C--N 1.324 -0.529 0 C-N-CA 124.67 1.188 . . . . 0.0 110.964 -153.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.09 -28.78 66.82 Favored 'General case' 0 CA--C 1.543 0.692 0 O-C-N 120.512 -1.367 . . . . 0.0 112.093 161.23 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 20.3 mmt -65.46 -16.66 63.87 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 119.633 1.106 . . . . 0.0 112.509 172.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -105.61 -44.49 4.67 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 126.185 1.794 . . . . 0.0 112.701 177.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.6 mtp -78.61 -8.04 58.22 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.842 1.657 . . . . 0.0 113.607 -176.415 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -130.96 153.83 48.78 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.154 1.382 . . . . 0.0 112.044 175.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 9.7 t -81.59 -54.73 5.17 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.49 1.116 . . . . 0.0 111.766 179.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 62.3 t80 -76.0 127.83 33.77 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.494 1.118 . . . . 0.0 112.996 -172.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 35.6 m80 . . . . . 0 C--O 1.249 1.026 0 C-N-CA 125.794 1.638 . . . . 0.0 111.881 176.469 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 65.4 m . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 119.579 -0.248 . . . . 0.0 110.82 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 19.1 mmt -78.0 165.13 24.42 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.726 0.811 . . . . 0.0 110.248 164.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 15.9 m -142.4 135.44 27.39 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.84 1.256 . . . . 0.0 112.173 176.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 -81.45 136.06 35.65 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.983 0.913 . . . . 0.0 110.561 164.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 62.9 p -134.84 133.15 39.43 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.659 1.584 . . . . 0.0 108.43 178.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.568 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -66.58 16.41 0.27 Allowed Glycine 0 CA--C 1.531 1.038 0 N-CA-C 115.523 0.969 . . . . 0.0 115.523 157.291 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 28.3 mt -67.23 156.66 87.59 Favored Pre-proline 0 CA--C 1.549 0.92 0 CA-C-N 119.909 1.855 . . . . 0.0 110.648 -176.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -80.35 -133.08 0.01 OUTLIER 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 123.17 2.58 . . . . 0.0 110.017 -179.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.99 -26.12 67.4 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 179.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -102.22 86.65 0.58 Allowed Glycine 0 C--N 1.339 0.711 0 C-N-CA 126.275 1.893 . . . . 0.0 109.534 176.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 69.5 p-90 -127.06 -28.01 2.93 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 117.226 2.306 . . . . 0.0 117.226 -167.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.9 tp10 -83.96 112.04 19.81 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 119.313 0.961 . . . . 0.0 110.489 -168.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 24.1 t -61.84 132.2 27.38 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.973 0 O-C-N 121.615 -0.678 . . . . 0.0 111.048 -177.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 60.7 mmt-85 -132.65 132.69 42.7 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.787 1.635 . . . . 0.0 110.567 174.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -130.7 2.51 4.47 Favored 'General case' 0 CA--C 1.551 1.01 0 N-CA-C 115.065 1.506 . . . . 0.0 115.065 -172.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 24.6 t -72.71 82.11 1.14 Allowed 'General case' 0 N--CA 1.473 0.682 0 O-C-N 120.855 -1.153 . . . . 0.0 108.054 156.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -178.19 116.57 0.08 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 127.335 2.254 . . . . 0.0 109.381 -165.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 50.2 m -76.5 -2.18 30.94 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 115.901 1.815 . . . . 0.0 115.901 -170.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.489 ' HG3' ' H ' ' A' ' 20' ' ' ASN . 2.0 tppp? -71.42 179.64 2.87 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 119.522 1.056 . . . . 0.0 111.983 178.257 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.489 ' H ' ' HG3' ' A' ' 19' ' ' LYS . 10.6 m120 -61.99 -43.11 99.54 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.7 1.6 . . . . 0.0 113.729 -175.042 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 10.3 mp -122.96 162.68 37.74 Favored Pre-proline 0 CA--C 1.547 0.827 0 C-N-CA 126.415 1.886 . . . . 0.0 110.866 -177.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.86 159.96 50.93 Favored 'Trans proline' 0 C--N 1.351 0.661 0 C-N-CA 123.184 2.589 . . . . 0.0 111.098 168.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 34.1 p90 -108.21 146.08 33.31 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.504 1.121 . . . . 0.0 111.627 177.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -92.25 101.16 13.66 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 121.452 0.644 . . . . 0.0 109.377 177.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -67.13 145.86 54.85 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.43 1.092 . . . . 0.0 111.8 -178.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.6 t30 -104.71 85.08 1.08 Allowed Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 125.944 1.697 . . . . 0.0 109.828 178.075 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -62.39 -24.61 75.76 Favored 'Trans proline' 0 C--N 1.351 0.684 0 C-N-CA 122.601 2.201 . . . . 0.0 115.694 -170.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.33 -13.64 60.13 Favored 'General case' 0 CA--C 1.545 0.779 0 N-CA-C 114.129 1.159 . . . . 0.0 114.129 -179.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.7 m -169.54 124.44 0.82 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 127.082 2.153 . . . . 0.0 108.375 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 24.8 mmt85 -52.15 98.08 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.825 0 CA-C-O 122.702 1.239 . . . . 0.0 112.838 -174.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 -163.67 178.05 8.24 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 127.572 2.349 . . . . 0.0 109.825 -174.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.3 p -149.48 174.01 12.95 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 120.531 -1.355 . . . . 0.0 113.877 173.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 20.3 tpp180 -138.5 158.7 43.76 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 128.218 2.607 . . . . 0.0 107.948 171.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -140.48 -58.73 0.53 Allowed 'General case' 0 N--CA 1.471 0.601 0 O-C-N 121.777 -0.577 . . . . 0.0 111.305 -158.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -107.55 153.89 41.09 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 126.003 1.721 . . . . 0.0 109.446 166.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -69.17 121.95 8.78 Favored 'Trans proline' 0 CA--C 1.544 1.018 0 C-N-CA 123.337 2.691 . . . . 0.0 112.059 -167.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -83.88 166.27 13.24 Favored 'Trans proline' 0 C--N 1.35 0.636 0 C-N-CA 124.47 3.447 . . . . 0.0 112.358 -172.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -68.32 -20.81 64.77 Favored 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 115.236 1.569 . . . . 0.0 115.236 -174.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -80.96 -7.54 59.55 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 125.177 1.391 . . . . 0.0 113.773 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -74.59 170.12 16.4 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.151 1.78 . . . . 0.0 114.726 -168.311 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 16.9 t0 -105.18 50.69 0.78 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.811 1.645 . . . . 0.0 110.965 -171.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.442 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 10.2 mtm -30.02 -35.54 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 127.164 2.186 . . . . 0.0 116.238 172.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -64.1 -27.35 69.04 Favored 'General case' 0 CA--C 1.553 1.092 0 CA-C-N 122.734 2.516 . . . . 0.0 114.183 175.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 69.4 m -94.52 -5.16 46.67 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 128.119 2.568 . . . . 0.0 112.297 171.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.568 HD13 ' N ' ' A' ' 6' ' ' GLY . 26.1 tp -131.07 -20.2 2.78 Favored 'General case' 0 C--O 1.219 -0.528 0 O-C-N 120.844 -1.16 . . . . 0.0 111.69 -155.445 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.01 -36.32 76.96 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-N 120.607 1.549 . . . . 0.0 111.308 157.092 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 15.2 ptt? -67.65 -9.68 45.47 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.347 1.059 . . . . 0.0 113.485 171.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -104.66 -46.32 4.37 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.037 1.335 . . . . 0.0 112.077 173.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 83.4 mmm -72.85 -8.61 56.37 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 127.493 2.317 . . . . 0.0 113.536 -175.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -161.42 146.98 13.89 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.734 2.014 . . . . 0.0 109.679 166.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 22.3 m -78.82 147.13 33.36 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 121.441 -0.787 . . . . 0.0 110.304 -178.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -70.09 146.13 51.14 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.929 0.891 . . . . 0.0 113.226 -176.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 68.2 m80 . . . . . 0 C--O 1.247 0.963 0 C-N-CA 127.559 2.344 . . . . 0.0 114.4 179.588 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.7 t . . . . . 0 N--CA 1.476 0.843 0 N-CA-C 109.846 -0.427 . . . . 0.0 109.846 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 22.3 mmt -71.13 151.13 44.75 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.855 0.862 . . . . 0.0 110.782 167.519 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 15.7 t -121.58 147.47 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 C-N-CA 125.321 1.448 . . . . 0.0 109.258 178.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 27.4 m120 -59.39 120.95 10.29 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 122.925 0.49 . . . . 0.0 110.731 173.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 75.5 p -113.11 149.48 33.47 Favored 'General case' 0 CA--C 1.509 -0.623 0 C-N-CA 125.308 1.443 . . . . 0.0 108.1 171.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.686 ' H ' HD13 ' A' ' 45' ' ' LEU . . . -84.65 9.52 64.88 Favored Glycine 0 CA--C 1.534 1.266 0 CA-C-N 113.827 -1.533 . . . . 0.0 115.749 158.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.4 mt -65.59 150.56 95.93 Favored Pre-proline 0 CA--C 1.546 0.801 0 CA-C-N 118.946 1.373 . . . . 0.0 110.925 -168.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -77.45 177.58 8.67 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 121.896 1.731 . . . . 0.0 110.978 -175.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.93 -32.94 55.25 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 115.331 1.604 . . . . 0.0 115.331 -170.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -79.1 42.54 2.35 Favored Glycine 0 CA--C 1.533 1.175 0 CA-C-O 118.443 -1.198 . . . . 0.0 115.118 -177.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 1.3 p-90 -122.95 152.54 40.75 Favored 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 115.547 1.684 . . . . 0.0 115.547 -176.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.0 tp10 179.51 119.91 0.05 Allowed 'General case' 0 CA--C 1.54 0.569 1 C-N-CA 131.753 4.021 . . . . 0.0 104.085 175.55 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 5.7 t -78.59 126.93 38.97 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 CA-C-N 120.604 1.547 . . . . 0.0 110.979 -169.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -119.43 113.7 21.18 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.451 1.501 . . . . 0.0 110.319 172.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -88.03 163.68 16.16 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.244 1.017 . . . . 0.0 112.049 165.163 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.4 t -159.64 144.44 15.25 Favored 'General case' 0 N--CA 1.467 0.409 0 O-C-N 120.924 -1.11 . . . . 0.0 113.022 -168.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 60.5 m-20 -71.89 -7.74 50.26 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.694 0.798 . . . . 0.0 113.066 169.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 23.0 m -91.7 -14.64 29.67 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 120.787 -1.196 . . . . 0.0 113.511 175.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -123.71 146.79 48.0 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 119.637 1.108 . . . . 0.0 113.425 -162.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -81.6 -9.38 59.69 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 114.137 1.162 . . . . 0.0 114.137 175.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 23.3 mt -140.98 167.9 15.96 Favored Pre-proline 0 CA--C 1.539 0.553 0 C-N-CA 126.936 2.095 . . . . 0.0 109.117 176.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -68.41 167.04 23.5 Favored 'Trans proline' 0 N--CA 1.455 -0.769 0 C-N-CA 122.118 1.879 . . . . 0.0 110.207 163.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 39.8 p90 -126.84 157.85 38.19 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.889 1.275 . . . . 0.0 109.416 160.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 -103.09 115.16 30.06 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.336 -0.852 . . . . 0.0 109.663 -177.226 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -76.03 134.29 40.14 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.569 1.148 . . . . 0.0 110.312 176.715 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 60.2 t-20 -87.54 114.23 57.89 Favored Pre-proline 0 CA--C 1.547 0.839 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 168.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -74.14 -34.64 4.75 Favored 'Trans proline' 0 C--N 1.349 0.598 0 C-N-CA 122.072 1.848 . . . . 0.0 112.569 176.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -80.15 -19.23 47.69 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 114.023 1.12 . . . . 0.0 114.023 -171.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 26.3 m -147.63 143.83 27.97 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 125.847 1.659 . . . . 0.0 108.725 -174.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -70.52 44.07 0.07 Allowed 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 116.863 2.171 . . . . 0.0 116.863 -170.67 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.411 ' HG3' ' H ' ' A' ' 32' ' ' SER . 6.3 tp10 -129.07 -175.64 3.62 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.815 2.046 . . . . 0.0 111.312 -176.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.411 ' H ' ' HG3' ' A' ' 31' ' ' GLU . 78.1 p -145.68 164.96 30.15 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 126.068 1.747 . . . . 0.0 110.804 172.498 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.3 tpp180 -118.64 132.34 56.18 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.66 1.584 . . . . 0.0 109.307 177.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 1.8 m-90 -98.84 -47.54 5.25 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.472 0.709 . . . . 0.0 112.278 -156.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -128.56 173.31 5.73 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 127.259 2.224 . . . . 0.0 108.397 165.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -57.67 120.21 7.97 Favored 'Trans proline' 0 CA--C 1.55 1.313 0 C-N-CA 122.509 2.139 . . . . 0.0 111.872 172.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.421 ' O ' HG22 ' A' ' 40' ' ' THR . 71.5 Cg_endo -81.18 167.21 17.95 Favored 'Trans proline' 0 C--N 1.352 0.763 0 C-N-CA 125.211 3.941 . . . . 0.0 113.025 -173.261 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -69.93 -4.65 21.54 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 177.314 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -93.66 -6.08 47.18 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 127.469 2.307 . . . . 0.0 113.025 177.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.421 HG22 ' O ' ' A' ' 37' ' ' PRO . 2.1 t -85.54 176.35 8.27 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.28 1.432 . . . . 0.0 113.171 -171.708 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -107.67 36.79 2.62 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.287 1.035 . . . . 0.0 111.8 -166.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 56.7 mtt -18.41 -43.33 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 130.29 3.436 . . . . 0.0 119.186 -173.297 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -52.28 -45.73 65.58 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-N 122.121 2.237 . . . . 0.0 112.222 170.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 23.6 m -74.65 -15.46 60.81 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 127.457 2.303 . . . . 0.0 112.894 173.221 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.686 HD13 ' H ' ' A' ' 6' ' ' GLY . 3.5 mm? -88.67 -17.17 30.56 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-N 120.127 1.33 . . . . 0.0 112.08 167.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.11 -17.74 62.56 Favored 'General case' 0 CA--C 1.553 1.062 0 CA-C-N 121.377 1.898 . . . . 0.0 111.931 -174.343 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 24.0 ptp -82.88 -7.52 59.65 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 127.864 2.466 . . . . 0.0 114.14 167.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.46 ' CD2' HD12 ' A' ' 45' ' ' LEU . 54.2 t80 -116.07 -55.07 2.44 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 126.65 1.98 . . . . 0.0 112.833 -173.19 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 93.5 mmm -68.85 5.77 1.04 Allowed 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 127.976 2.51 . . . . 0.0 113.439 173.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -158.66 151.06 21.69 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 128.346 2.659 . . . . 0.0 109.316 171.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 46.1 p -108.56 163.0 13.62 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 125.828 1.651 . . . . 0.0 114.315 -166.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -77.65 145.31 36.77 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 125.705 1.602 . . . . 0.0 112.163 173.342 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 . . . . . 0 C--O 1.252 1.188 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -168.68 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 65.3 m . . . . . 0 N--CA 1.479 0.984 0 CA-C-O 121.271 0.557 . . . . 0.0 111.607 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -140.25 159.4 42.26 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 126.096 1.758 . . . . 0.0 111.044 -177.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 25.9 m -111.51 144.18 19.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 123.347 0.659 . . . . 0.0 111.854 174.451 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 21.3 m120 -81.64 136.51 35.52 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.291 1.036 . . . . 0.0 109.735 165.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 67.4 p -146.32 150.91 36.64 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-O 122.204 1.002 . . . . 0.0 110.434 170.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.67 ' H ' HD13 ' A' ' 45' ' ' LEU . . . -92.42 18.71 53.93 Favored Glycine 0 CA--C 1.533 1.18 0 CA-C-N 113.974 -1.466 . . . . 0.0 114.796 156.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.453 ' HG ' HD11 ' A' ' 45' ' ' LEU . 16.5 mt -70.38 148.93 95.73 Favored Pre-proline 0 CA--C 1.546 0.796 0 CA-C-N 119.61 1.705 . . . . 0.0 110.919 -170.401 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -74.61 158.0 44.0 Favored 'Trans proline' 0 C--N 1.353 0.793 0 C-N-CA 121.978 1.785 . . . . 0.0 110.538 -175.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.75 -11.77 5.86 Favored 'General case' 0 CA--C 1.548 0.871 0 N-CA-C 117.195 2.294 . . . . 0.0 117.195 -160.209 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -94.37 59.66 1.91 Allowed Glycine 0 CA--C 1.53 0.995 0 C-N-CA 125.148 1.356 . . . . 0.0 111.871 171.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 9.7 p-90 -133.24 165.07 25.65 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 115.534 1.679 . . . . 0.0 115.534 -177.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 176.09 172.97 0.36 Allowed 'General case' 0 CA--C 1.543 0.676 1 C-N-CA 132.564 4.345 . . . . 0.0 106.127 -177.026 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.5 t -123.99 142.99 38.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 125.371 1.468 . . . . 0.0 110.072 -178.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.6 mmp_? -138.68 149.09 44.76 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.935 1.694 . . . . 0.0 110.596 177.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -141.94 162.74 34.72 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.945 1.091 . . . . 0.0 113.945 -169.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 37.4 t -173.37 151.29 1.97 Allowed 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.283 1.833 . . . . 0.0 111.714 -177.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -63.95 -15.98 60.45 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.541 1.136 . . . . 0.0 112.525 167.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 9.4 t -66.27 -13.99 61.28 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.752 1.621 . . . . 0.0 113.921 -177.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 8.3 ptmt -150.42 161.88 41.64 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.028 1.331 . . . . 0.0 112.87 -179.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -71.9 -35.1 69.61 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 114.904 1.446 . . . . 0.0 114.904 -170.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.3 mp -122.51 173.51 4.15 Favored Pre-proline 0 CA--C 1.551 1.003 0 C-N-CA 127.431 2.292 . . . . 0.0 111.151 -179.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -75.86 171.27 18.49 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 123.269 2.646 . . . . 0.0 111.737 169.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 46.2 p90 -126.24 162.49 25.32 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 125.894 1.678 . . . . 0.0 110.731 166.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 9.5 m-85 -105.23 150.13 25.37 Favored 'General case' 0 CA--C 1.543 0.701 0 O-C-N 121.388 -0.82 . . . . 0.0 112.359 -176.234 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 84.2 t80 -136.13 143.42 44.51 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.515 1.126 . . . . 0.0 112.969 -168.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 62.8 t-20 -95.18 118.0 66.59 Favored Pre-proline 0 CA--C 1.556 1.185 0 C-N-CA 123.198 0.599 . . . . 0.0 111.319 170.222 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -75.15 -19.61 17.37 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 123.205 2.604 . . . . 0.0 114.414 174.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -93.29 -15.6 25.64 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -172.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 88.5 m -154.02 142.63 20.82 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 128.113 2.565 . . . . 0.0 107.485 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 49.1 mmm-85 -68.17 100.63 1.04 Allowed 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 119.496 1.044 . . . . 0.0 110.666 177.399 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -165.73 149.59 8.08 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.099 1.759 . . . . 0.0 110.495 176.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 57.5 p -114.97 -179.47 3.64 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 124.302 1.041 . . . . 0.0 113.192 169.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 17.8 tpp180 -149.65 137.73 20.46 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.734 1.613 . . . . 0.0 109.801 178.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -129.81 -33.13 1.83 Allowed 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.069 0.948 . . . . 0.0 112.987 -154.253 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -145.43 160.09 46.25 Favored Pre-proline 0 CA--C 1.548 0.885 0 C-N-CA 129.198 2.999 . . . . 0.0 106.887 177.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -67.69 121.42 8.48 Favored 'Trans proline' 0 CA--C 1.546 1.113 0 C-N-CA 122.008 1.805 . . . . 0.0 112.43 -167.252 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_endo -77.6 165.32 27.23 Favored 'Trans proline' 0 C--N 1.351 0.703 0 C-N-CA 124.063 3.175 . . . . 0.0 111.799 179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -56.63 -41.18 76.7 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 113.469 0.915 . . . . 0.0 113.469 179.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -71.37 -0.99 11.46 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 125.27 1.428 . . . . 0.0 114.46 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -85.52 157.17 20.49 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.231 1.013 . . . . 0.0 111.404 177.582 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -88.46 -29.38 20.21 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-O 121.934 0.873 . . . . 0.0 113.085 -163.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.488 ' H ' HD23 ' A' ' 45' ' ' LEU . 43.6 mtt 69.57 -43.71 0.53 Allowed 'General case' 0 N--CA 1.466 0.348 0 C-N-CA 129.792 3.237 . . . . 0.0 113.72 176.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -55.99 -52.29 64.72 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 120.009 1.277 . . . . 0.0 110.9 170.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 3.0 m -75.13 1.24 13.75 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 172.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.67 HD13 ' H ' ' A' ' 6' ' ' GLY . 2.7 mm? -104.12 -22.15 13.46 Favored 'General case' 0 CA--C 1.508 -0.655 0 O-C-N 120.257 -1.527 . . . . 0.0 113.963 169.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -68.29 -22.92 64.7 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 120.895 1.68 . . . . 0.0 111.082 -176.562 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 22.6 ptp -76.76 -6.12 50.93 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.484 2.314 . . . . 0.0 114.731 168.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . 0.468 ' HD2' HD12 ' A' ' 45' ' ' LEU . 56.6 t80 -122.69 -58.1 1.69 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.21 1.804 . . . . 0.0 113.342 -169.339 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 54.9 mtp -67.66 -47.74 68.66 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.891 1.277 . . . . 0.0 111.178 -175.058 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -88.74 143.64 26.78 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 148.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 2.0 t -76.78 175.43 9.43 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-O 121.318 0.58 . . . . 0.0 112.431 -176.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 84.7 t80 -114.79 145.15 42.44 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 126.916 2.087 . . . . 0.0 110.684 170.089 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 21.8 m170 . . . . . 0 C--O 1.25 1.13 0 CA-C-O 117.011 -1.471 . . . . 0.0 112.489 -179.339 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 64.5 p . . . . . 0 N--CA 1.474 0.745 0 N-CA-C 111.608 0.225 . . . . 0.0 111.608 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.6 6.29 0.87 Allowed 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 117.676 2.473 . . . . 0.0 117.676 -158.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.5 m -93.82 148.61 4.75 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.697 0 C-N-CA 127.142 2.177 . . . . 0.0 112.652 -169.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 6.4 p-10 -74.3 143.65 44.89 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.435 1.094 . . . . 0.0 111.765 166.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 72.8 p -147.27 143.49 28.15 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 125.524 1.53 . . . . 0.0 109.369 169.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.578 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -82.19 7.67 63.15 Favored Glycine 0 CA--C 1.528 0.851 0 C-N-CA 125.864 1.697 . . . . 0.0 116.231 160.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 15.5 mt -65.11 155.85 82.81 Favored Pre-proline 0 CA--C 1.553 1.088 0 CA-C-N 119.703 1.751 . . . . 0.0 111.228 -169.118 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -70.16 174.57 9.65 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 122.071 1.847 . . . . 0.0 111.67 -175.663 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.11 -9.48 0.4 Allowed 'General case' 0 CA--C 1.554 1.101 0 N-CA-C 117.992 2.59 . . . . 0.0 117.992 -166.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -105.07 63.95 0.31 Allowed Glycine 0 CA--C 1.531 1.092 0 C-N-CA 125.715 1.626 . . . . 0.0 112.143 170.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 66.5 p-90 -109.91 146.75 34.63 Favored 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 -171.009 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 169.2 174.14 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.749 1 C-N-CA 132.314 4.245 . . . . 0.0 106.71 173.544 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.6 p -141.36 143.06 28.31 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 CA-C-N 119.581 1.082 . . . . 0.0 112.289 175.014 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.8 mmp_? -137.72 162.91 32.63 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.958 1.703 . . . . 0.0 111.189 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -145.86 172.34 13.48 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 124.98 1.312 . . . . 0.0 112.245 178.199 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.2 p -157.4 172.74 18.05 Favored 'General case' 0 N--CA 1.472 0.67 0 O-C-N 120.871 -1.143 . . . . 0.0 113.152 -177.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 -73.48 -14.38 61.22 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 121.304 -0.872 . . . . 0.0 112.497 170.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 26.6 m -79.55 -31.04 41.95 Favored 'General case' 0 N--CA 1.47 0.542 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 -171.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -143.6 146.47 33.31 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.308 1.843 . . . . 0.0 110.056 -173.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -79.26 -27.64 42.34 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.222 1.409 . . . . 0.0 112.864 179.14 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -75.62 149.42 83.59 Favored Pre-proline 0 CA--C 1.546 0.824 0 O-C-N 121.4 -0.813 . . . . 0.0 111.043 170.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -73.99 -179.55 4.75 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 123.891 3.061 . . . . 0.0 110.302 167.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 54.1 p90 -135.64 140.81 44.83 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.041 0.936 . . . . 0.0 110.85 159.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 23.7 m-85 -84.58 119.66 25.46 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 88.3 t80 -90.54 127.96 36.41 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 124.097 0.959 . . . . 0.0 111.699 -169.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 59.7 t-20 -89.94 118.0 68.56 Favored Pre-proline 0 CA--C 1.549 0.931 0 N-CA-C 109.791 -0.448 . . . . 0.0 109.791 170.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -79.32 -33.91 1.24 Allowed 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.609 2.206 . . . . 0.0 113.034 -179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -90.77 -18.2 25.35 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -168.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.7 m -138.31 137.56 37.52 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 126.989 2.116 . . . . 0.0 107.643 172.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.25 88.79 0.85 Allowed 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.778 0.831 . . . . 0.0 110.143 -175.938 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -161.04 170.82 19.75 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.391 1.477 . . . . 0.0 110.383 -172.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 18.4 p -151.01 137.14 18.34 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 124.296 1.039 . . . . 0.0 111.227 173.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 19.7 tpp180 -99.29 149.38 23.18 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 126.534 1.934 . . . . 0.0 109.641 -178.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -120.79 -30.0 4.54 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.666 1.186 . . . . 0.0 113.502 -165.657 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -149.49 153.27 36.79 Favored Pre-proline 0 CA--C 1.541 0.626 0 C-N-CA 126.477 1.911 . . . . 0.0 109.636 -172.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_endo -64.47 117.08 4.16 Favored 'Trans proline' 0 CA--C 1.543 0.959 0 C-N-CA 123.932 3.088 . . . . 0.0 112.171 -169.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -78.78 170.76 17.63 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.856 3.037 . . . . 0.0 111.852 -179.446 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.57 -32.7 74.46 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -178.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -76.15 -10.79 59.69 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 114.522 1.304 . . . . 0.0 114.522 -177.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -76.86 178.59 6.74 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 125.977 1.711 . . . . 0.0 114.491 -171.118 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -126.57 58.64 1.39 Allowed 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 125.408 1.483 . . . . 0.0 111.991 -168.172 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.473 ' HA ' ' HB3' ' A' ' 45' ' ' LEU . 1.8 mpp? -29.62 -40.62 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.075 1.75 . . . . 0.0 114.802 163.608 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 65.3 tt0 -45.51 -46.56 13.95 Favored 'General case' 0 CA--C 1.551 0.996 0 CA-C-N 120.479 1.49 . . . . 0.0 114.436 169.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 98.1 m -86.17 -13.21 47.71 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 127.556 2.342 . . . . 0.0 113.337 175.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.578 HD13 ' N ' ' A' ' 6' ' ' GLY . 37.1 tp -123.94 -17.36 6.31 Favored 'General case' 0 C--N 1.328 -0.356 0 O-C-N 121.3 -0.875 . . . . 0.0 112.211 -151.536 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.34 -39.17 72.39 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 120.371 -1.456 . . . . 0.0 109.749 153.227 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 11.8 mmt -63.36 8.13 0.08 Allowed 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.062 1.745 . . . . 0.0 113.856 171.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 53.1 t80 -133.75 -44.28 0.81 Allowed 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.233 1.813 . . . . 0.0 112.46 176.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.1 mtt -85.94 -21.82 27.72 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 126.719 2.008 . . . . 0.0 114.266 -177.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -165.37 66.29 0.12 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.281 1.832 . . . . 0.0 110.173 -177.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.8 m -63.35 124.64 21.8 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.58 1.152 . . . . 0.0 113.768 -159.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 56.4 t80 -82.4 150.42 27.13 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.322 1.849 . . . . 0.0 111.876 168.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 32.6 m170 . . . . . 0 C--O 1.257 1.488 0 C-N-CA 126.76 2.024 . . . . 0.0 111.527 175.766 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 75.4 p . . . . . 0 N--CA 1.476 0.844 0 CA-C-O 116.836 -1.554 . . . . 0.0 109.625 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 83.4 mtp -62.7 150.05 42.1 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 121.85 2.114 . . . . 0.0 112.581 173.206 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 2.1 t -125.15 154.13 33.05 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.025 0 C-N-CA 126.311 1.844 . . . . 0.0 109.96 179.442 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -70.44 148.55 48.2 Favored 'General case' 0 CA--C 1.54 0.568 0 O-C-N 121.544 -0.722 . . . . 0.0 111.08 165.615 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 77.9 p -141.55 150.56 42.26 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.016 1.726 . . . . 0.0 108.057 173.307 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . 0.563 ' N ' HD13 ' A' ' 45' ' ' LEU . . . -87.35 28.8 5.53 Favored Glycine 0 CA--C 1.525 0.671 0 CA-C-O 117.548 -1.695 . . . . 0.0 114.359 154.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 14.7 mt -76.0 159.65 80.19 Favored Pre-proline 0 CA--C 1.547 0.828 0 CA-C-N 120.333 2.067 . . . . 0.0 110.75 -175.495 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -68.86 174.97 7.94 Favored 'Trans proline' 0 CA--C 1.539 0.758 0 C-N-CA 122.644 2.23 . . . . 0.0 111.575 -179.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.61 33.37 0.05 Allowed 'General case' 0 CA--C 1.551 0.983 0 N-CA-C 116.28 1.956 . . . . 0.0 116.28 -167.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -166.08 99.25 0.16 Allowed Glycine 0 CA--C 1.532 1.153 0 C-N-CA 125.968 1.747 . . . . 0.0 111.872 170.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 19.4 p-90 -155.58 147.46 23.28 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 115.208 1.558 . . . . 0.0 115.208 -175.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -159.9 150.52 18.96 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 128.843 2.857 . . . . 0.0 106.809 168.364 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 18.9 t -102.85 120.2 52.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 CA-C-N 120.561 1.528 . . . . 0.0 110.862 -170.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.4 mmp_? -111.86 115.75 29.51 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.572 0.749 . . . . 0.0 111.623 176.649 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 4.0 p80 -155.74 158.94 39.03 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.775 2.03 . . . . 0.0 110.945 175.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 41.7 p -137.53 170.31 16.29 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.586 0.708 . . . . 0.0 112.815 -173.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -58.87 -24.71 62.52 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.13 0.972 . . . . 0.0 113.452 167.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 67.9 m -91.47 -6.42 52.68 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.205 1.402 . . . . 0.0 113.7 176.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 33.6 ttmt -163.16 111.59 1.27 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 125.499 1.519 . . . . 0.0 111.034 173.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -64.06 -33.28 75.39 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.714 0.806 . . . . 0.0 112.888 175.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.44 114.3 20.93 Favored Pre-proline 0 CA--C 1.548 0.88 0 C-N-CA 123.186 0.595 . . . . 0.0 111.239 -167.613 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -77.37 139.61 18.68 Favored 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 123.208 2.605 . . . . 0.0 111.425 -172.556 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 55.9 p90 -105.19 135.34 46.74 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 153.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 21.5 m-85 -90.15 100.4 13.23 Favored 'General case' 0 CA--C 1.538 0.499 0 O-C-N 121.67 -0.644 . . . . 0.0 110.212 -179.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -63.5 129.4 40.03 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.049 1.34 . . . . 0.0 110.979 -179.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 58.4 t-20 -88.29 121.52 70.31 Favored Pre-proline 0 CA--C 1.556 1.193 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 174.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -79.27 -19.96 10.11 Favored 'Trans proline' 0 C--N 1.353 0.772 0 C-N-CA 124.509 3.472 . . . . 0.0 113.559 178.124 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -91.67 -40.74 11.12 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.834 0.854 . . . . 0.0 111.969 -175.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 22.8 m -120.33 142.23 49.32 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.614 1.966 . . . . 0.0 109.104 175.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 75.0 mtp180 -65.09 97.67 0.26 Allowed 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.277 1.031 . . . . 0.0 110.265 168.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -175.21 158.5 2.4 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 126.892 2.077 . . . . 0.0 109.542 -172.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 88.1 p -134.16 118.28 17.49 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 120.789 -1.194 . . . . 0.0 112.568 168.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 11.2 tpp180 -70.02 128.5 36.54 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.898 1.679 . . . . 0.0 109.576 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -90.57 -45.76 8.72 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.922 1.289 . . . . 0.0 111.743 -167.061 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -152.67 163.22 24.22 Favored Pre-proline 0 CA--C 1.549 0.919 0 C-N-CA 128.128 2.571 . . . . 0.0 107.898 -165.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -60.63 123.37 12.88 Favored 'Trans proline' 0 CA--C 1.546 1.099 0 C-N-CA 122.942 2.428 . . . . 0.0 113.578 -168.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -87.12 162.45 8.63 Favored 'Trans proline' 0 C--N 1.353 0.789 0 C-N-CA 124.612 3.541 . . . . 0.0 113.413 178.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.51 -6.92 2.67 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 125.441 1.496 . . . . 0.0 114.917 172.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.8 t0 -104.89 9.08 34.82 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.344 1.858 . . . . 0.0 113.613 179.302 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -90.13 -179.91 5.77 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.551 1.94 . . . . 0.0 111.314 179.115 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -103.54 -34.12 8.78 Favored 'General case' 0 N--CA 1.486 1.372 0 O-C-N 120.149 -1.594 . . . . 0.0 112.663 -169.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.509 ' HA ' ' HB3' ' A' ' 45' ' ' LEU 0.252 90.3 mtp 60.76 -38.45 0.1 Allowed 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 129.118 2.967 . . . . 0.0 115.577 -170.994 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -64.07 -53.33 51.5 Favored 'General case' 0 N--CA 1.473 0.725 0 CA-C-N 122.382 2.355 . . . . 0.0 111.498 -178.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.2 m -65.3 -7.15 12.0 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 125.563 1.545 . . . . 0.0 112.937 170.085 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.563 HD13 ' N ' ' A' ' 6' ' ' GLY . 10.8 tp -112.6 -27.18 8.3 Favored 'General case' 0 C--O 1.217 -0.613 0 O-C-N 120.894 -1.128 . . . . 0.0 112.256 -166.461 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -62.68 -40.13 96.12 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 120.853 1.661 . . . . 0.0 110.378 170.231 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 14.6 ptm -63.72 -6.96 6.34 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 126.052 1.741 . . . . 0.0 114.941 169.029 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -108.7 -50.47 3.01 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.356 1.463 . . . . 0.0 111.985 174.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 85.1 mtp -62.62 -36.89 84.24 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 127.167 2.187 . . . . 0.0 112.029 -178.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.56 88.08 7.02 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 156.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 15.0 t -84.6 -9.78 57.97 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.497 1.519 . . . . 0.0 114.591 -165.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 10.3 t80 -87.54 126.27 34.82 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 118.881 0.764 . . . . 0.0 112.122 175.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 12.7 m80 . . . . . 0 C--O 1.252 1.185 0 C-N-CA 126.602 1.961 . . . . 0.0 112.145 -172.319 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 10.2 m . . . . . 0 N--CA 1.472 0.668 0 N-CA-C 110.098 -0.334 . . . . 0.0 110.098 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 92.6 mtp -98.84 152.68 19.46 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.64 1.176 . . . . 0.0 112.931 -168.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 32.9 m -84.26 165.28 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 C-N-CA 123.847 0.859 . . . . 0.0 111.541 173.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -139.49 154.11 47.65 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.678 0.791 . . . . 0.0 109.836 160.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 62.2 p -133.78 126.71 31.2 Favored 'General case' 0 CA--C 1.51 -0.567 0 C-N-CA 124.811 1.244 . . . . 0.0 109.046 -174.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -66.83 5.93 2.24 Favored Glycine 0 CA--C 1.532 1.124 0 C-N-CA 125.229 1.395 . . . . 0.0 114.445 163.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 31.8 mt -63.19 155.98 70.99 Favored Pre-proline 0 CA--C 1.551 0.983 0 CA-C-N 118.917 1.358 . . . . 0.0 110.391 175.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_endo -79.35 -135.62 0.02 OUTLIER 'Trans proline' 0 CA--C 1.543 0.93 0 C-N-CA 123.452 2.768 . . . . 0.0 110.495 -178.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.97 -26.21 66.7 Favored 'General case' 0 CA--C 1.548 0.868 0 O-C-N 120.806 -1.184 . . . . 0.0 114.144 177.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -93.04 83.53 1.09 Allowed Glycine 0 C--N 1.338 0.651 0 C-N-CA 125.609 1.576 . . . . 0.0 109.493 176.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -136.38 -13.18 1.8 Allowed 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 117.583 2.438 . . . . 0.0 117.583 -166.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.5 tm-20 -92.09 117.85 30.25 Favored 'General case' 0 N--CA 1.473 0.688 0 CA-C-N 119.834 1.197 . . . . 0.0 109.809 -170.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 20.9 t -75.12 123.3 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 O-C-N 121.047 -1.033 . . . . 0.0 110.691 -164.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.6 mmt180 -130.75 153.27 49.19 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.05 1.34 . . . . 0.0 110.259 176.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 32.1 p-80 -144.02 169.77 17.19 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.375 1.07 . . . . 0.0 112.78 -173.1 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.2 t -162.62 149.85 13.47 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 125.1 1.36 . . . . 0.0 111.521 -176.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.2 m120 -67.23 -19.22 65.5 Favored 'General case' 0 CA--C 1.543 0.703 0 O-C-N 121.236 -0.915 . . . . 0.0 111.925 170.549 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 19.5 m -88.31 9.84 21.82 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 125.136 1.375 . . . . 0.0 113.368 177.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 20.8 tptm -147.84 125.15 11.55 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.912 1.285 . . . . 0.0 111.196 179.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 53.7 m-80 -66.61 -8.07 24.73 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 115.782 1.771 . . . . 0.0 115.782 -169.472 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -157.53 165.53 18.53 Favored Pre-proline 0 CA--C 1.549 0.918 0 C-N-CA 126.8 2.04 . . . . 0.0 109.999 -173.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -77.99 159.55 30.62 Favored 'Trans proline' 0 C--N 1.349 0.569 0 C-N-CA 123.152 2.568 . . . . 0.0 111.995 -175.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 51.5 p90 -123.69 143.61 50.16 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 126.048 1.739 . . . . 0.0 110.225 171.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -97.55 100.37 11.78 Favored 'General case' 0 CA--C 1.538 0.485 0 O-C-N 121.537 -0.727 . . . . 0.0 109.98 -173.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -63.55 137.01 57.96 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.887 1.675 . . . . 0.0 112.233 -173.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 57.5 t-20 -95.97 122.41 58.45 Favored Pre-proline 0 CA--C 1.547 0.836 0 C-N-CA 124.061 0.944 . . . . 0.0 108.793 167.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -78.34 -36.69 0.89 Allowed 'Trans proline' 0 CA--C 1.534 0.514 0 C-N-CA 122.498 2.132 . . . . 0.0 113.093 176.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -85.25 -12.63 52.05 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -169.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 30.3 m -135.19 141.14 45.8 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.608 1.963 . . . . 0.0 108.282 173.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -66.73 89.15 0.15 Allowed 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 119.476 1.035 . . . . 0.0 109.651 170.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.6 tp10 -171.92 179.13 2.8 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 125.664 1.585 . . . . 0.0 110.114 -172.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 28.2 p -160.5 173.77 15.06 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.851 1.66 . . . . 0.0 109.825 172.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.6 tpp180 -125.88 138.31 53.79 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.368 1.067 . . . . 0.0 110.608 -172.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -104.71 -32.06 9.06 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.34 1.456 . . . . 0.0 112.99 -163.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -143.72 162.06 43.35 Favored Pre-proline 0 CA--C 1.539 0.522 0 C-N-CA 128.476 2.71 . . . . 0.0 107.866 179.767 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -54.67 114.76 1.99 Allowed 'Trans proline' 0 CA--C 1.549 1.273 0 C-N-CA 123.306 2.671 . . . . 0.0 111.218 166.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -79.09 -166.9 0.44 Allowed 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 124.776 3.651 . . . . 0.0 111.974 -177.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -81.61 -18.44 44.71 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 177.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -95.01 7.58 45.64 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.118 1.767 . . . . 0.0 113.355 -174.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 6.2 t -96.73 162.02 13.61 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 126.58 1.952 . . . . 0.0 112.836 -174.188 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -89.25 -34.47 16.61 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 121.287 0.565 . . . . 0.0 112.129 -157.79 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . 0.26 28.6 mtt 61.55 -37.03 0.11 Allowed 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 130.148 3.379 . . . . 0.0 115.675 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -60.82 -29.07 69.25 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.838 1.255 . . . . 0.0 112.065 168.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 2.4 m -102.86 26.16 8.43 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.681 1.592 . . . . 0.0 112.109 168.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 76.4 mt -129.4 -20.09 3.36 Favored 'General case' 0 CA--C 1.507 -0.674 0 O-C-N 119.507 -1.995 . . . . 0.0 115.554 170.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.74 -27.1 67.34 Favored 'General case' 0 CA--C 1.556 1.178 0 CA-C-N 123.092 2.678 . . . . 0.0 111.743 177.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 26.3 ptm -59.24 -14.62 11.6 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 128.053 2.541 . . . . 0.0 115.21 164.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -127.36 -57.15 1.3 Allowed 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.688 1.595 . . . . 0.0 113.122 -165.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 67.7 mmm -66.04 -10.87 44.1 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 127.361 2.265 . . . . 0.0 114.981 -175.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -146.02 110.62 5.13 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.003 1.321 . . . . 0.0 109.527 169.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 55.4 m -69.97 -51.75 29.98 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.936 1.294 . . . . 0.0 113.808 -162.845 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -98.86 -13.82 19.9 Favored 'General case' 0 CA--C 1.544 0.739 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 -166.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 54.1 t-80 . . . . . 0 C--O 1.253 1.243 0 C-N-CA 126.447 1.899 . . . . 0.0 111.436 174.175 . . . . . . . . 0 0 . 1 stop_ save_