data_2kzy_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 2kzy _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 ' 14' ' ' MET . . . . . . . . . . . . . 4.5 mmt . . . . . 0 CA--C 1.536 0.408 0 CA-C-O 120.916 0.389 . . . . 0.0 110.372 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -75.02 144.92 42.85 Favored 'General case' 0 CA--C 1.527 0.094 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 8.7 t -49.78 128.06 17.34 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 112.27 0.471 . . . . 0.0 112.27 -179.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 28.5 m -63.71 -30.21 71.34 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.822 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 80.5 p -73.61 -19.01 60.98 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.03 43.12 6.82 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 121.216 -0.516 . . . . 0.0 112.863 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.8 p -85.7 -22.35 27.87 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 117.286 0.543 . . . . 0.0 111.108 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.28 8.08 50.77 Favored Glycine 0 CA--C 1.537 1.433 0 CA-C-O 119.85 -0.417 . . . . 0.0 113.165 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -114.3 159.37 20.28 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 117.673 0.737 . . . . 0.0 110.425 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.7 t80 -67.57 146.66 53.68 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.98 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -118.43 -179.08 17.07 Favored Glycine 0 CA--C 1.53 0.975 0 N-CA-C 110.526 -1.029 . . . . 0.0 110.526 179.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.3 t30 -126.94 138.88 33.57 Favored Pre-proline 0 N--CA 1.47 0.568 0 CA-C-O 119.466 -0.302 . . . . 0.0 110.528 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -77.11 -22.65 11.12 Favored 'Trans proline' 0 N--CA 1.489 1.206 0 C-N-CA 121.922 1.748 . . . . 0.0 112.53 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 28.2 mtm180 -71.17 -34.14 70.65 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 67.2 p -74.55 -157.49 0.06 Allowed 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 107.594 -1.262 . . . . 0.0 107.594 177.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -90.94 25.41 2.42 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 118.333 0.515 . . . . 0.0 111.208 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 82.52 10.6 83.18 Favored Glycine 0 CA--C 1.541 1.676 0 N-CA-C 111.65 -0.58 . . . . 0.0 111.65 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 3.0 mpp? -115.24 156.42 25.41 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 117.195 0.498 . . . . 0.0 110.448 -179.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 22.9 p -69.98 -160.63 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.036 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.47 -48.3 28.18 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -178.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 8.3 t -68.81 -56.92 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 N-CA-C 111.727 0.269 . . . . 0.0 111.727 -177.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 81.2 m -57.82 -35.32 70.71 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -178.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -62.96 -31.09 72.12 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 121.347 -0.141 . . . . 0.0 111.295 -179.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.7 tttt -75.67 -48.61 21.33 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.72 0.295 . . . . 0.0 110.717 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -63.31 -42.34 99.02 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.138 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 63.9 t60 -63.95 -48.37 76.79 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.621 -179.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 tp -63.63 -30.4 71.51 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 111.627 0.232 . . . . 0.0 111.627 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -65.03 -40.95 95.58 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 120.85 0.357 . . . . 0.0 110.329 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.87 -31.46 64.74 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.117 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 . . . . . 0 N--CA 1.464 0.275 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.573 -179.626 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.323 0 N-CA-C 110.17 -0.307 . . . . 0.0 110.17 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.2 mp -75.05 146.58 41.42 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.193 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.2 t -46.7 137.08 7.29 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -179.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.5 m -65.95 -33.94 76.96 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.008 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 79.8 p -70.19 -13.43 62.18 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.309 -0.405 . . . . 0.0 112.084 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.26 25.61 63.4 Favored Glycine 0 CA--C 1.531 1.039 0 N-CA-C 112.133 -0.387 . . . . 0.0 112.133 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.7 p -65.91 -19.3 65.82 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 117.277 0.538 . . . . 0.0 111.832 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.45 8.06 58.8 Favored Glycine 0 CA--C 1.538 1.477 0 CA-C-O 119.863 -0.409 . . . . 0.0 112.967 179.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 44.4 m-85 -104.39 -173.07 2.22 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 117.506 0.653 . . . . 0.0 110.628 -179.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -97.05 142.33 29.12 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.78 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -113.89 176.13 16.9 Favored Glycine 0 CA--C 1.531 1.046 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -126.02 141.28 39.11 Favored Pre-proline 0 CA--C 1.54 0.586 0 CA-C-O 119.488 -0.291 . . . . 0.0 110.903 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -75.22 -24.16 12.74 Favored 'Trans proline' 0 N--CA 1.496 1.626 0 C-N-CA 122.234 1.956 . . . . 0.0 112.787 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 28.5 mtt-85 -72.59 -32.01 65.64 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 178.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.4 p -81.03 -152.98 0.09 Allowed 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 177.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -92.33 28.5 1.92 Allowed 'General case' 0 C--O 1.236 0.382 0 CA-C-N 118.166 0.439 . . . . 0.0 111.53 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 76.34 12.72 84.01 Favored Glycine 0 CA--C 1.537 1.452 0 C-N-CA 121.094 -0.574 . . . . 0.0 111.837 -179.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 14.7 mtt -118.33 168.31 10.74 Favored 'General case' 0 C--N 1.347 0.484 0 CA-C-N 117.568 0.684 . . . . 0.0 111.168 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 20.7 p -78.43 -164.1 0.52 Allowed 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.392 -178.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.27 -45.39 48.04 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -178.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 21.3 t -70.71 -57.19 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 83.5 m -58.99 -35.16 72.76 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -178.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -66.74 -29.88 69.96 Favored 'General case' 0 N--CA 1.467 0.417 0 O-C-N 123.074 0.234 . . . . 0.0 111.602 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.5 tttt -76.0 -48.04 22.58 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.594 0.235 . . . . 0.0 110.641 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -62.46 -37.78 87.24 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.741 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 32.4 t60 -61.05 -49.02 79.07 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.281 -179.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.3 mp -59.45 -27.99 66.57 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.668 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 4.5 tp60 -60.02 -43.01 95.55 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 120.367 0.127 . . . . 0.0 111.336 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -69.24 -29.63 67.6 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.219 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 . . . . . 0 N--CA 1.467 0.415 0 CA-C-O 120.567 0.222 . . . . 0.0 111.233 179.886 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 14.9 mtt . . . . . 0 CA--C 1.535 0.401 0 CA-C-O 121.029 0.442 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -74.21 146.07 43.65 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.627 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.8 t -45.53 137.81 4.82 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -179.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 66.6 m -69.95 -24.53 63.36 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.811 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 75.0 p -80.48 -17.99 49.98 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.43 31.14 22.85 Favored Glycine 0 C--N 1.34 0.762 0 C-N-CA 121.117 -0.564 . . . . 0.0 112.401 179.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.5 p -72.96 -19.79 61.17 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.904 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 97.17 10.46 54.51 Favored Glycine 0 CA--C 1.538 1.491 0 CA-C-O 119.778 -0.457 . . . . 0.0 113.035 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -117.06 166.0 12.72 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 117.707 0.753 . . . . 0.0 111.335 -179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -67.48 145.74 54.66 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.303 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -110.58 163.72 12.3 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.7 t30 -113.06 126.45 28.21 Favored Pre-proline 0 CA--C 1.539 0.556 0 CA-C-O 119.379 -0.343 . . . . 0.0 110.236 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.08 -16.63 28.67 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 121.825 1.684 . . . . 0.0 113.073 179.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 50.0 mtt180 -76.89 -35.01 57.71 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 177.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.9 p -73.03 -154.77 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 178.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -90.83 27.52 1.77 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.17 0.441 . . . . 0.0 111.253 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 84.94 10.89 77.84 Favored Glycine 0 CA--C 1.537 1.418 0 N-CA-C 111.714 -0.554 . . . . 0.0 111.714 -179.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.92 163.49 19.18 Favored 'General case' 0 C--N 1.344 0.336 0 CA-C-N 117.039 0.419 . . . . 0.0 110.645 -179.296 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 23.9 p -72.16 -158.31 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.71 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.21 -51.49 11.99 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -178.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 10.8 t -66.2 -54.83 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 N-CA-C 111.56 0.208 . . . . 0.0 111.56 -178.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 75.9 m -58.35 -36.14 73.0 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -178.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -57.39 -41.36 80.12 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 111.512 0.19 . . . . 0.0 111.512 -179.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.6 ttpt -75.14 -45.45 40.78 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.918 0.39 . . . . 0.0 110.343 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 -54.75 -39.76 68.64 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.802 -0.635 . . . . 0.0 112.525 -179.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -84.6 -32.74 23.58 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.358 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.0 tp -61.69 -27.28 68.58 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.889 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -69.08 -38.94 79.27 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 26.5 mtt-85 -70.83 -30.71 67.21 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.82 179.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 . . . . . 0 C--O 1.232 0.168 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.803 179.89 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 29.7 mmm . . . . . 0 C--O 1.235 0.312 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.7 mp -79.31 145.43 33.48 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.717 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 8.8 t -45.34 131.54 8.1 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -178.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.0 m -62.59 -24.84 67.77 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.215 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 33.7 p -81.2 -10.62 59.59 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -178.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 78.12 25.48 61.76 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.53 179.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.6 p -67.45 -15.57 63.74 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-N 117.324 0.562 . . . . 0.0 111.279 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.15 8.87 68.18 Favored Glycine 0 CA--C 1.535 1.321 0 CA-C-O 119.997 -0.335 . . . . 0.0 113.206 179.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -106.15 -173.6 2.34 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 117.31 0.555 . . . . 0.0 110.303 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -93.14 141.71 28.12 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.865 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -112.75 169.32 12.94 Favored Glycine 0 CA--C 1.528 0.887 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 179.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -115.61 138.42 23.82 Favored Pre-proline 0 CA--C 1.541 0.632 0 CA-C-O 119.65 -0.214 . . . . 0.0 110.673 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -76.65 -25.92 8.9 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 122.49 2.126 . . . . 0.0 112.588 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 13.9 mtt-85 -73.84 -29.26 62.03 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.194 178.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 67.9 p -85.49 -150.43 0.13 Allowed 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 177.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -91.7 28.08 1.87 Allowed 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 118.791 0.723 . . . . 0.0 111.623 179.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 74.56 16.41 80.12 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 121.255 -0.498 . . . . 0.0 111.972 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 35.0 mtt -117.45 163.81 15.83 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 117.339 0.57 . . . . 0.0 109.903 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 31.3 p -73.76 -163.82 0.19 Allowed 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.774 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.47 -41.97 62.5 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.315 0.857 . . . . 0.0 113.315 -178.23 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 10.1 t -72.52 -49.81 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-O 120.785 0.326 . . . . 0.0 110.869 -178.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 72.5 m -65.41 -36.2 83.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.538 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -65.76 -36.8 84.58 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.12 -44.62 46.03 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.266 -0.574 . . . . 0.0 109.716 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -65.35 -43.26 91.39 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 123.146 0.279 . . . . 0.0 111.24 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -59.52 -49.25 78.49 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -178.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.04 -25.94 65.73 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.005 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -64.41 -39.64 94.23 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 111.566 0.21 . . . . 0.0 111.566 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 10.4 mtt-85 -74.85 -30.51 61.37 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.15 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 . . . . . 0 N--CA 1.463 0.205 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.537 179.966 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 12.3 mmt . . . . . 0 CA--C 1.533 0.305 0 CA-C-O 120.988 0.423 . . . . 0.0 111.24 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mp -76.11 143.56 41.19 Favored 'General case' 0 C--O 1.232 0.144 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.5 t -40.05 131.48 1.99 Allowed 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 -178.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 47.7 m -65.36 -26.2 67.92 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.16 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 51.9 p -78.96 -12.91 60.05 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 121.186 -0.206 . . . . 0.0 111.377 179.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 78.38 37.13 28.57 Favored Glycine 0 C--N 1.349 1.292 0 CA-C-O 119.808 -0.44 . . . . 0.0 113.375 178.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 29.1 p -77.56 -7.98 57.14 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 117.258 0.529 . . . . 0.0 111.801 178.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 85.4 5.94 84.43 Favored Glycine 0 CA--C 1.538 1.507 0 CA-C-O 119.774 -0.459 . . . . 0.0 113.207 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -109.79 172.02 7.1 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 117.679 0.739 . . . . 0.0 109.995 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -78.49 145.7 34.81 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.155 -178.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -118.59 169.35 13.43 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -112.27 141.81 25.77 Favored Pre-proline 0 N--CA 1.471 0.597 0 CA-C-N 116.73 0.265 . . . . 0.0 110.774 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.0 -29.35 6.78 Favored 'Trans proline' 0 N--CA 1.495 1.565 0 C-N-CA 122.082 1.854 . . . . 0.0 112.307 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -71.72 -27.28 62.91 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 178.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 71.0 p -83.6 -152.74 0.13 Allowed 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -90.87 26.72 2.0 Allowed 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 118.236 0.471 . . . . 0.0 111.238 179.32 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 72.97 15.53 78.41 Favored Glycine 0 CA--C 1.536 1.4 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 -177.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.7 mtp -121.65 163.41 19.02 Favored 'General case' 0 C--N 1.347 0.491 0 CA-C-N 117.085 0.443 . . . . 0.0 109.94 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 29.9 p -74.57 -167.39 0.55 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.911 -178.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.15 -37.68 61.24 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 -177.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.0 t -72.13 -49.42 43.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-O 120.579 0.228 . . . . 0.0 111.247 -177.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 67.4 m -70.27 -34.45 72.81 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.73 -178.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -69.47 -27.51 65.28 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 119.447 -0.311 . . . . 0.0 111.293 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt -78.12 -45.99 21.87 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 117.992 0.36 . . . . 0.0 110.041 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -64.7 -38.87 92.48 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.587 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 54.3 t60 -66.12 -41.41 90.58 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.096 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.2 tp -71.61 -42.22 67.95 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.132 -178.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -65.09 -35.83 82.39 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.865 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 11.2 ttt180 -77.14 -28.48 54.28 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.722 178.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 . . . . . 0 CA--C 1.535 0.389 0 CA-C-N 116.749 -0.205 . . . . 0.0 111.067 179.557 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 4.2 mmt . . . . . 0 C--O 1.234 0.245 0 CA-C-O 121.102 0.477 . . . . 0.0 110.308 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.1 tp -74.83 144.75 43.32 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.294 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.2 t -44.1 132.38 5.59 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -178.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.0 m -65.44 -32.89 74.75 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.332 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 73.8 p -72.65 -13.4 61.35 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.23 43.48 25.61 Favored Glycine 0 C--N 1.345 1.054 0 N-CA-C 111.771 -0.532 . . . . 0.0 111.771 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 29.2 p -85.38 -14.38 46.51 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.59 4.38 60.68 Favored Glycine 0 CA--C 1.536 1.406 0 C-N-CA 121.306 -0.473 . . . . 0.0 113.296 179.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -114.09 163.62 14.93 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-N 117.674 0.737 . . . . 0.0 110.561 -179.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -68.05 144.77 54.96 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.749 -179.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -110.13 161.19 13.03 Favored Glycine 0 CA--C 1.528 0.848 0 N-CA-C 110.777 -0.929 . . . . 0.0 110.777 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.5 t30 -108.1 118.9 51.49 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-O 119.329 -0.367 . . . . 0.0 110.606 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -67.18 -18.91 51.13 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 C-N-CA 121.675 1.583 . . . . 0.0 112.154 179.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 60.9 mtp180 -75.36 -31.98 60.69 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 177.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 70.4 p -79.09 -153.44 0.07 Allowed 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -89.93 26.54 1.79 Allowed 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 118.204 0.456 . . . . 0.0 111.982 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.02 10.68 78.06 Favored Glycine 0 CA--C 1.536 1.391 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.75 161.8 21.96 Favored 'General case' 0 C--N 1.347 0.457 0 CA-C-N 117.249 0.524 . . . . 0.0 111.193 -178.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 31.1 p -72.25 -157.43 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.652 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.58 -49.26 19.11 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -178.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.4 t -69.68 -52.04 35.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -177.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 71.2 m -60.05 -36.15 76.7 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -178.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.42 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 14.5 t80 -58.87 -48.42 81.46 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 -178.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.1 pttt -72.32 -44.14 63.11 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -54.63 -39.61 68.13 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.179 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.42 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 0.8 OUTLIER -85.34 -33.33 22.08 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 120.425 -0.51 . . . . 0.0 111.753 -179.445 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 14.9 tp -62.47 -30.6 71.37 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.453 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -65.93 -39.29 90.38 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.379 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 70.0 mtt-85 -79.23 -30.86 43.41 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.572 -0.286 . . . . 0.0 111.229 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.9 tp60 . . . . . 0 CA--C 1.531 0.243 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.076 179.609 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 11.3 mmt . . . . . 0 C--O 1.237 0.444 0 CA-C-O 120.797 0.332 . . . . 0.0 110.313 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 18.2 mt -79.36 140.43 37.48 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.375 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.7 t -38.93 136.19 0.8 Allowed 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -177.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m -64.92 -29.33 70.26 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.534 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 44.0 p -82.23 -6.96 59.59 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 71.73 43.52 51.09 Favored Glycine 0 C--N 1.344 0.978 0 C-N-CA 121.24 -0.505 . . . . 0.0 112.085 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.4 p -82.29 -6.81 59.5 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.3 0.62 79.81 Favored Glycine 0 CA--C 1.54 1.614 0 CA-C-O 119.648 -0.529 . . . . 0.0 112.954 179.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -110.64 177.6 4.63 Favored 'General case' 0 C--N 1.344 0.363 0 CA-C-N 117.791 0.795 . . . . 0.0 111.151 -179.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -84.13 144.91 28.7 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.51 -178.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -114.25 159.59 13.63 Favored Glycine 0 CA--C 1.53 1.019 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 178.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -105.97 140.0 20.8 Favored Pre-proline 0 N--CA 1.468 0.428 0 CA-C-O 119.3 -0.381 . . . . 0.0 110.245 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -75.22 -23.15 13.72 Favored 'Trans proline' 0 N--CA 1.489 1.239 0 C-N-CA 121.746 1.63 . . . . 0.0 112.598 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 85.8 mtt-85 -75.33 -28.45 59.65 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 178.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 60.9 p -80.95 -151.29 0.08 Allowed 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 178.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -92.11 28.17 1.95 Allowed 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 117.984 0.356 . . . . 0.0 111.274 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 76.79 15.64 81.43 Favored Glycine 0 CA--C 1.536 1.349 0 N-CA-C 111.272 -0.731 . . . . 0.0 111.272 -178.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 40.2 mtt -123.65 169.76 11.15 Favored 'General case' 0 C--N 1.347 0.474 0 CA-C-N 117.389 0.594 . . . . 0.0 111.334 -179.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 22.4 p -79.08 -165.82 0.82 Allowed 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.781 -178.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.8 -41.98 51.29 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 13.9 t -68.27 -49.3 68.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -177.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 60.8 m -72.1 -34.64 68.79 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 -178.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -64.95 -27.03 68.56 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -178.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 55.2 tttt -75.94 -41.66 50.98 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -67.12 -45.8 76.05 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.458 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 42.3 t60 -57.56 -45.51 85.06 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 -178.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.0 mp -62.88 -29.12 70.52 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.958 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -66.79 -32.46 73.77 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 121.078 -0.249 . . . . 0.0 111.1 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -83.58 -33.59 25.35 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.672 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 . . . . . 0 CA--C 1.535 0.373 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.378 179.643 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 1.2 mpt? . . . . . 0 C--O 1.233 0.229 0 CA-C-O 120.539 0.209 . . . . 0.0 110.757 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -78.22 142.84 37.63 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.83 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.1 t -51.1 120.95 5.42 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 39.5 m -59.67 -25.36 64.67 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.429 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 66.7 p -72.04 -18.95 61.91 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.63 39.71 8.09 Favored Glycine 0 C--N 1.342 0.91 0 C-N-CA 121.194 -0.527 . . . . 0.0 111.988 178.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.5 p -89.28 -20.38 24.17 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 120.946 -0.301 . . . . 0.0 111.359 178.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 93.96 5.5 62.54 Favored Glycine 0 CA--C 1.538 1.514 0 CA-C-O 120.011 -0.327 . . . . 0.0 113.248 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -103.14 -177.57 3.41 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-N 117.444 0.622 . . . . 0.0 110.937 -179.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.7 t80 -89.01 134.03 34.13 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.299 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -107.95 165.38 12.9 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.876 -179.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -114.92 134.89 22.41 Favored Pre-proline 0 CA--C 1.541 0.631 0 CA-C-O 119.523 -0.275 . . . . 0.0 111.419 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -76.55 -26.39 8.57 Favored 'Trans proline' 0 N--CA 1.496 1.638 0 C-N-CA 122.386 2.057 . . . . 0.0 112.228 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 36.3 mtt-85 -71.14 -33.33 69.97 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 45.9 p -77.52 -154.0 0.06 Allowed 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -91.58 27.65 1.95 Allowed 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.322 0.51 . . . . 0.0 111.466 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.88 15.3 79.44 Favored Glycine 0 CA--C 1.534 1.244 0 N-CA-C 112.315 -0.314 . . . . 0.0 112.315 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -118.89 164.18 15.81 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 117.195 0.498 . . . . 0.0 110.706 -179.144 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 31.2 p -76.26 -157.57 0.08 Allowed 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.549 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.78 -50.4 20.75 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -179.114 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 21.3 t -67.36 -55.8 15.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -177.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 91.1 m -55.73 -36.62 67.44 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -178.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.441 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 35.3 t80 -59.62 -43.18 93.86 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.1 ttpt -73.32 -46.37 49.84 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.724 0.297 . . . . 0.0 110.385 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -54.85 -39.4 68.58 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.376 -178.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.441 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 0.8 OUTLIER -85.98 -33.28 21.14 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 120.309 -0.557 . . . . 0.0 112.212 -179.238 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 17.5 tp -63.98 -33.4 75.64 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.555 0.217 . . . . 0.0 111.057 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -69.12 -38.75 79.04 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.864 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 45.7 mtp180 -72.8 -32.35 65.49 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.179 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 . . . . . 0 N--CA 1.465 0.303 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.734 -179.725 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 3.6 mmt . . . . . 0 C--O 1.235 0.331 0 CA-C-O 120.888 0.375 . . . . 0.0 110.346 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.96 144.99 40.68 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.5 t -46.3 134.03 9.11 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -178.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.9 m -67.92 -24.56 65.21 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 114.869 -1.06 . . . . 0.0 112.153 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 76.9 p -81.53 -16.91 50.33 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -179.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.21 34.41 14.61 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 121.007 -0.616 . . . . 0.0 112.19 178.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 27.2 p -77.74 -18.54 56.41 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.841 178.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 91.62 9.8 62.47 Favored Glycine 0 CA--C 1.534 1.248 0 CA-C-O 119.982 -0.343 . . . . 0.0 112.759 179.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -105.8 -171.05 1.83 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 117.485 0.643 . . . . 0.0 110.602 -179.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -97.46 143.57 28.05 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.66 0.267 . . . . 0.0 111.106 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -113.36 170.85 13.54 Favored Glycine 0 CA--C 1.528 0.856 0 N-CA-C 110.297 -1.121 . . . . 0.0 110.297 179.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -122.82 140.57 33.49 Favored Pre-proline 0 CA--C 1.538 0.513 0 CA-C-O 119.467 -0.301 . . . . 0.0 110.561 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -75.63 -17.36 18.27 Favored 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 121.835 1.69 . . . . 0.0 112.677 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.1 mmt180 -78.26 -34.24 49.19 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 40.7 p -77.63 -151.31 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 178.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -88.94 29.36 1.05 Allowed 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 118.534 0.607 . . . . 0.0 111.2 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 74.39 15.39 80.3 Favored Glycine 0 CA--C 1.535 1.301 0 N-CA-C 111.993 -0.443 . . . . 0.0 111.993 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 10.9 mtt -129.04 176.57 7.78 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 117.416 0.608 . . . . 0.0 109.979 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 14.6 p -77.37 -169.31 1.37 Allowed 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.306 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -74.85 -47.21 31.5 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -177.62 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 20.2 t -68.27 -52.49 37.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 120.999 -0.281 . . . . 0.0 111.3 -178.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 79.2 m -60.73 -36.99 80.24 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.146 -179.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.428 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 29.2 t80 -57.82 -33.21 68.37 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.517 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.4 mtpt -77.02 -45.86 25.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.804 0.335 . . . . 0.0 110.101 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -58.68 -41.3 85.88 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.428 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.3 p-80 -82.11 -36.13 27.85 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 120.21 -0.596 . . . . 0.0 111.697 -178.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.9 tp -62.02 -28.81 69.85 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.576 0.227 . . . . 0.0 110.877 179.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -61.82 -38.69 89.09 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.643 179.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 60.2 mtt180 -77.11 -29.45 54.79 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.55 178.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 . . . . . 0 CA--C 1.533 0.289 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.689 179.497 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 19.1 mtt . . . . . 0 N--CA 1.465 0.292 0 CA-C-O 120.521 0.201 . . . . 0.0 111.42 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.77 140.97 46.27 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.255 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.2 t -39.67 137.06 0.92 Allowed 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -178.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 57.8 m -61.65 -25.41 67.36 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.197 -179.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 68.1 p -90.76 -5.58 55.49 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -178.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.35 41.38 85.69 Favored Glycine 0 C--N 1.341 0.841 0 N-CA-C 111.482 -0.647 . . . . 0.0 111.482 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 15.2 p -86.58 -13.23 46.37 Favored 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.2 -7.48 54.51 Favored Glycine 0 CA--C 1.542 1.765 0 CA-C-O 119.746 -0.474 . . . . 0.0 113.539 178.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 -91.41 178.91 5.82 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 117.627 0.714 . . . . 0.0 110.895 -178.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -89.71 135.62 33.51 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.336 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -100.78 140.18 14.76 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 111.069 -0.813 . . . . 0.0 111.069 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -99.89 135.47 20.45 Favored Pre-proline 0 CA--C 1.538 0.491 0 CA-C-O 119.446 -0.312 . . . . 0.0 110.253 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -74.79 -21.78 16.0 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 121.791 1.66 . . . . 0.0 112.863 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -75.3 -31.75 60.77 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 178.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 54.0 p -79.59 -153.27 0.08 Allowed 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 178.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -91.45 27.34 2.0 Allowed 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 118.331 0.514 . . . . 0.0 111.046 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.35 17.25 76.57 Favored Glycine 0 CA--C 1.539 1.593 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -178.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 28.5 mtt -120.58 160.5 23.1 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-O 121.097 0.475 . . . . 0.0 111.571 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 22.4 p -73.88 -161.62 0.12 Allowed 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.888 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.42 -43.21 51.09 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.6 t -69.97 -45.89 75.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.9 m -73.53 -36.22 65.66 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -177.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -63.38 -37.3 86.72 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -178.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.76 -43.0 48.78 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.28 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 62.2 mm-40 -62.79 -47.76 82.09 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.541 179.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -58.49 -46.25 87.06 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.986 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.1 mp -60.96 -26.65 67.69 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.881 -179.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -55.24 -36.26 65.84 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-O 120.752 0.31 . . . . 0.0 111.354 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 11.1 mtm105 -83.87 -29.08 27.51 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.083 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 . . . . . 0 CA--C 1.535 0.366 0 CA-C-N 116.767 -0.197 . . . . 0.0 110.988 179.67 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 13.4 mtt . . . . . 0 CA--C 1.535 0.396 0 CA-C-O 120.825 0.345 . . . . 0.0 111.394 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.3 mt -74.49 148.7 40.77 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.509 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 10.0 t -44.82 132.95 6.4 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -178.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m -61.61 -29.07 69.8 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.796 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 71.2 p -78.89 -9.75 59.59 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 71.94 33.23 62.86 Favored Glycine 0 C--N 1.342 0.888 0 N-CA-C 111.26 -0.736 . . . . 0.0 111.26 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.5 p -71.83 -19.14 62.02 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.37 4.28 53.19 Favored Glycine 0 CA--C 1.539 1.557 0 CA-C-O 119.569 -0.573 . . . . 0.0 113.481 178.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -115.53 164.09 14.81 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 117.944 0.872 . . . . 0.0 111.038 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -69.21 146.55 52.29 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.571 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -109.68 166.89 12.63 Favored Glycine 0 CA--C 1.527 0.794 0 N-CA-C 110.216 -1.153 . . . . 0.0 110.216 178.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -114.93 135.96 22.51 Favored Pre-proline 0 N--CA 1.467 0.416 0 N-CA-C 109.948 -0.389 . . . . 0.0 109.948 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -74.82 -23.46 14.19 Favored 'Trans proline' 0 N--CA 1.495 1.58 0 C-N-CA 122.022 1.814 . . . . 0.0 112.928 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -75.67 -36.81 60.0 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.2 p -70.87 -154.93 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -89.76 29.21 1.2 Allowed 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.681 0.673 . . . . 0.0 111.031 179.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.44 16.27 78.33 Favored Glycine 0 CA--C 1.534 1.24 0 CA-C-O 119.872 -0.404 . . . . 0.0 112.465 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 9.4 mtt -131.2 176.56 8.17 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 117.616 0.708 . . . . 0.0 111.213 -178.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 18.9 p -77.22 -167.15 0.84 Allowed 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.677 -179.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.51 -48.83 30.11 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -177.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.1 t -65.68 -57.74 9.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -177.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 73.2 m -57.51 -35.38 70.18 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 111.641 0.237 . . . . 0.0 111.641 -178.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.439 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 41.1 t80 -57.42 -41.45 80.42 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.216 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -74.29 -45.09 49.8 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -56.69 -39.76 74.37 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -179.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.439 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.6 p-80 -84.46 -33.24 23.68 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 120.006 -0.677 . . . . 0.0 111.675 -179.131 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 15.7 tp -62.33 -30.39 71.13 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.254 179.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -65.11 -39.47 93.16 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.662 0.268 . . . . 0.0 111.0 -179.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 61.9 mtm180 -76.11 -30.53 58.29 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.344 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.236 0.358 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.792 -179.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 18.7 mmt . . . . . 0 C--O 1.235 0.297 0 CA-C-O 120.526 0.203 . . . . 0.0 110.954 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -79.83 139.65 37.12 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.0 t -42.22 121.5 1.9 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 -178.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.1 m -55.94 -22.58 26.99 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.318 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 60.9 p -81.18 -9.64 59.76 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 179.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 74.49 40.24 39.84 Favored Glycine 0 C--N 1.344 1.023 0 C-N-CA 121.457 -0.401 . . . . 0.0 112.357 179.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 24.2 p -86.62 -9.16 56.65 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 117.012 0.406 . . . . 0.0 112.066 179.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.21 -2.74 85.44 Favored Glycine 0 CA--C 1.537 1.441 0 CA-C-O 119.777 -0.457 . . . . 0.0 113.394 178.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -100.79 171.95 7.36 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 117.788 0.794 . . . . 0.0 110.533 -179.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -80.31 139.06 36.78 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.568 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -111.78 155.24 16.3 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 109.874 -1.291 . . . . 0.0 109.874 178.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -101.38 137.46 19.65 Favored Pre-proline 0 CA--C 1.537 0.47 0 CA-C-O 119.499 -0.286 . . . . 0.0 110.822 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -73.13 -27.28 14.01 Favored 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 121.848 1.699 . . . . 0.0 112.294 179.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.4 mmt180 -74.08 -26.9 60.63 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 123.041 0.213 . . . . 0.0 110.526 178.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 68.8 p -82.11 -150.49 0.09 Allowed 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 178.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 54.1 m-20 -91.21 28.3 1.67 Allowed 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 118.375 0.534 . . . . 0.0 110.891 178.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 76.01 17.51 80.0 Favored Glycine 0 CA--C 1.537 1.444 0 N-CA-C 111.702 -0.559 . . . . 0.0 111.702 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 48.6 mtt -123.16 170.34 10.33 Favored 'General case' 0 C--N 1.347 0.491 0 CA-C-N 117.291 0.546 . . . . 0.0 111.419 -179.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 31.2 p -77.62 -167.79 1.04 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.639 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.24 -44.41 59.54 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 18.1 t -62.78 -51.22 74.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -178.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 68.5 m -70.62 -34.55 72.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.944 -178.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -64.83 -32.92 74.84 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -77.87 -43.05 31.39 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.906 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -63.64 -45.21 91.24 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 120.869 0.366 . . . . 0.0 110.106 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 39.6 t60 -59.94 -44.86 94.12 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.701 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.33 -29.33 70.05 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.634 -178.798 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -71.99 -31.48 66.28 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 120.934 -0.307 . . . . 0.0 110.315 179.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 39.2 ttt-85 -75.21 -31.44 60.89 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.172 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 . . . . . 0 CA--C 1.531 0.234 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.235 179.534 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 14.8 mmt . . . . . 0 C--O 1.233 0.213 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mp -76.65 144.28 39.57 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.5 t -48.79 123.71 7.37 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.9 m -65.32 -30.57 71.43 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.015 -179.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 51.0 p -64.81 -23.03 67.11 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -178.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 91.05 36.93 6.47 Favored Glycine 0 CA--C 1.526 0.76 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.132 179.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.9 p -84.81 -16.44 41.4 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 117.034 0.417 . . . . 0.0 110.91 178.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.49 12.68 66.72 Favored Glycine 0 C--N 1.349 1.298 0 CA-C-O 119.747 -0.474 . . . . 0.0 113.097 178.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -114.37 176.71 4.93 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 117.633 0.717 . . . . 0.0 111.833 -179.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 8.1 t80 -81.21 140.82 34.7 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.101 -0.954 . . . . 0.0 111.025 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -124.7 -176.51 14.62 Favored Glycine 0 CA--C 1.53 1.008 0 N-CA-C 111.054 -0.819 . . . . 0.0 111.054 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -130.13 139.25 35.08 Favored Pre-proline 0 N--CA 1.47 0.536 0 CA-C-O 119.548 -0.263 . . . . 0.0 111.389 -179.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -77.07 -14.89 16.64 Favored 'Trans proline' 0 N--CA 1.49 1.273 0 C-N-CA 121.994 1.796 . . . . 0.0 112.949 178.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -77.6 -35.87 52.41 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 178.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 66.6 p -72.52 -154.77 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 177.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -90.77 26.02 2.19 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.574 0.624 . . . . 0.0 111.622 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 84.31 8.27 83.75 Favored Glycine 0 CA--C 1.538 1.484 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.8 163.31 16.35 Favored 'General case' 0 C--N 1.346 0.413 0 CA-C-N 117.146 0.473 . . . . 0.0 110.987 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 30.8 p -76.04 -157.71 0.08 Allowed 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -74.77 -48.3 26.28 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -179.061 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.2 t -69.03 -55.69 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 -178.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 77.7 m -57.19 -35.47 69.65 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -178.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.411 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 30.5 t80 -59.03 -40.44 85.04 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 111.833 0.309 . . . . 0.0 111.833 -179.127 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.6 tttm -74.37 -45.39 47.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.825 0.345 . . . . 0.0 110.347 -179.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -56.25 -38.51 71.23 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -178.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.411 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.6 p-80 -86.4 -33.4 20.49 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 120.191 -0.603 . . . . 0.0 112.155 -178.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.0 tt -65.91 -30.63 71.25 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.804 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -58.77 -40.53 84.18 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.393 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -84.79 -29.56 25.33 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.894 179.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 . . . . . 0 N--CA 1.464 0.228 0 CA-C-O 120.96 0.409 . . . . 0.0 110.089 179.282 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 1.5 mtt . . . . . 0 CA--C 1.536 0.417 0 CA-C-O 121.068 0.461 . . . . 0.0 112.173 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -71.27 148.36 47.24 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.139 179.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 11.2 t -41.34 140.66 0.82 Allowed 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -179.035 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 68.7 m -63.81 -29.19 70.42 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.824 -179.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.5 p -88.17 -5.19 58.55 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -179.174 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 71.03 38.71 63.81 Favored Glycine 0 C--N 1.343 0.972 0 CA-C-O 119.931 -0.372 . . . . 0.0 113.099 178.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 32.0 p -78.68 -17.78 55.41 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 117.179 0.489 . . . . 0.0 111.887 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 105.03 1.26 41.9 Favored Glycine 0 CA--C 1.54 1.621 0 CA-C-O 119.711 -0.494 . . . . 0.0 113.243 179.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 67.1 m-85 -109.01 156.74 19.39 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 117.767 0.783 . . . . 0.0 110.685 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 26.4 t80 -65.25 146.17 55.29 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.289 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -109.04 163.43 12.59 Favored Glycine 0 CA--C 1.529 0.932 0 N-CA-C 110.257 -1.137 . . . . 0.0 110.257 179.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -113.21 136.22 21.8 Favored Pre-proline 0 CA--C 1.541 0.608 0 CA-C-O 119.276 -0.392 . . . . 0.0 110.098 -179.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -76.59 -22.73 11.88 Favored 'Trans proline' 0 N--CA 1.494 1.525 0 C-N-CA 122.052 1.835 . . . . 0.0 112.313 179.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 61.7 mtp180 -74.53 -33.57 62.8 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 178.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.8 p -82.12 -155.42 0.14 Allowed 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 178.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -89.56 24.94 2.12 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 118.623 0.647 . . . . 0.0 111.825 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.42 17.75 75.31 Favored Glycine 0 CA--C 1.54 1.604 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 -179.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 16.9 mtt -120.33 155.38 33.46 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-N 117.152 0.476 . . . . 0.0 110.772 -179.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 29.3 p -66.38 -162.72 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.105 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -74.12 -48.36 30.0 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -178.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 17.5 t -62.61 -56.63 16.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 116.301 -0.409 . . . . 0.0 112.053 -178.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.6 m -60.39 -33.49 72.56 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -178.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 30.2 t80 -65.25 -34.87 79.38 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -178.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 39.3 tttt -77.26 -47.86 19.02 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.159 -179.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -66.1 -42.98 88.52 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.421 -179.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -59.39 -49.27 78.44 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.877 -178.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.76 -29.27 70.5 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 -178.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -57.96 -40.65 81.09 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.47 0.176 . . . . 0.0 111.195 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.6 ptp180 -82.17 -30.84 30.77 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.952 179.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 . . . . . 0 N--CA 1.463 0.183 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.475 -179.303 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.389 0 CA-C-O 120.801 0.334 . . . . 0.0 110.427 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.19 145.21 33.78 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.7 t -51.29 124.26 11.38 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -178.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.8 m -64.6 -22.03 66.87 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.525 -0.761 . . . . 0.0 112.11 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 58.0 p -76.7 -19.54 57.59 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.65 43.19 6.56 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 121.168 -0.539 . . . . 0.0 112.081 179.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.9 p -88.37 -22.6 23.71 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 116.958 0.379 . . . . 0.0 111.706 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 98.65 6.94 56.13 Favored Glycine 0 CA--C 1.539 1.531 0 CA-C-O 119.707 -0.496 . . . . 0.0 113.6 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -108.36 -170.34 1.66 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 117.819 0.809 . . . . 0.0 111.13 -179.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -96.7 141.21 30.2 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.201 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -111.08 172.59 15.22 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 111.049 -0.821 . . . . 0.0 111.049 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -124.92 138.11 30.85 Favored Pre-proline 0 CA--C 1.54 0.571 0 CA-C-O 119.501 -0.285 . . . . 0.0 110.821 -179.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -75.79 -19.16 16.49 Favored 'Trans proline' 0 N--CA 1.498 1.748 0 C-N-CA 122.269 1.979 . . . . 0.0 112.488 178.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.0 mtt180 -75.96 -34.95 59.83 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 70.1 p -77.77 -154.41 0.07 Allowed 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -90.57 27.62 1.69 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.364 0.529 . . . . 0.0 111.718 179.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.26 10.88 85.59 Favored Glycine 0 CA--C 1.535 1.288 0 N-CA-C 111.6 -0.6 . . . . 0.0 111.6 -179.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.07 169.81 9.6 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 117.332 0.566 . . . . 0.0 111.097 -178.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 22.0 p -78.89 -162.03 0.35 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.124 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.76 -45.92 40.65 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -178.684 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.7 t -69.35 -56.82 10.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -178.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 72.3 m -56.77 -35.43 68.65 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.424 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 31.7 t80 -57.94 -37.91 74.98 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.778 -0.192 . . . . 0.0 111.166 -179.444 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.6 tttt -77.65 -45.48 24.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.897 0.379 . . . . 0.0 110.129 179.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -57.2 -40.86 78.26 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.878 0.695 . . . . 0.0 112.878 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.424 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.1 p-80 -82.14 -33.85 29.41 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 120.102 -0.639 . . . . 0.0 111.398 -179.085 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.5 tp -64.28 -29.27 70.37 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.582 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -61.94 -40.95 97.3 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.605 0.24 . . . . 0.0 111.289 -179.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 36.9 ttt85 -84.13 -31.38 25.26 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.495 -179.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 . . . . . 0 N--CA 1.465 0.287 0 CA-C-O 120.575 0.226 . . . . 0.0 111.061 -179.68 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 6.7 mmt . . . . . 0 CA--C 1.532 0.27 0 CA-C-O 120.998 0.428 . . . . 0.0 110.63 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.07 146.75 41.23 Favored 'General case' 0 N--CA 1.461 0.086 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.8 t -48.96 124.59 8.95 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -178.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.5 m -62.68 -27.13 69.03 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.758 179.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 68.4 p -71.04 -20.88 62.33 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 84.8 34.09 16.65 Favored Glycine 0 C--N 1.342 0.899 0 N-CA-C 111.855 -0.498 . . . . 0.0 111.855 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.4 p -78.85 -17.12 56.17 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 179.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.53 6.34 59.76 Favored Glycine 0 CA--C 1.538 1.511 0 CA-C-O 119.678 -0.512 . . . . 0.0 113.708 178.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -116.45 167.64 10.86 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 117.936 0.868 . . . . 0.0 111.313 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -69.46 143.99 53.38 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.713 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -114.79 171.09 13.53 Favored Glycine 0 CA--C 1.531 1.041 0 N-CA-C 110.836 -0.905 . . . . 0.0 110.836 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -118.27 139.35 26.66 Favored Pre-proline 0 N--CA 1.471 0.608 0 CA-C-N 116.642 0.221 . . . . 0.0 111.265 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -78.68 -25.31 6.61 Favored 'Trans proline' 0 N--CA 1.489 1.245 0 C-N-CA 122.191 1.927 . . . . 0.0 113.195 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 33.1 mmt180 -74.15 -33.03 63.38 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 178.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 71.0 p -74.57 -155.92 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 177.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -90.01 26.07 1.95 Allowed 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 118.2 0.454 . . . . 0.0 111.446 179.641 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 81.83 10.91 83.5 Favored Glycine 0 CA--C 1.539 1.537 0 N-CA-C 111.429 -0.668 . . . . 0.0 111.429 -179.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.95 163.32 17.76 Favored 'General case' 0 C--N 1.346 0.436 0 CA-C-N 117.335 0.568 . . . . 0.0 110.538 -179.185 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 28.3 p -74.7 -158.59 0.08 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.773 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -75.36 -47.03 29.48 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 16.3 t -69.58 -51.03 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 CA-C-O 120.749 0.309 . . . . 0.0 111.311 -178.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.1 m -62.88 -37.75 88.14 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -178.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.411 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 26.1 t80 -59.22 -45.99 89.65 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -178.682 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 38.5 pttt -74.13 -44.08 55.12 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 120.479 -0.488 . . . . 0.0 110.206 -179.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -55.5 -36.51 66.75 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.411 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 0.7 OUTLIER -86.5 -33.79 20.22 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 120.161 -0.616 . . . . 0.0 112.361 -179.302 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 11.0 tp -62.51 -28.97 70.21 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 121.251 -0.18 . . . . 0.0 111.435 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -63.76 -38.74 92.25 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.407 -179.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 9.8 tpp180 -76.45 -29.35 56.92 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.701 179.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.533 0.315 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.488 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 3.7 mmt . . . . . 0 C--O 1.234 0.28 0 CA-C-O 120.859 0.361 . . . . 0.0 110.359 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.5 mp -74.17 146.78 43.17 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.233 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.3 t -46.6 131.53 11.22 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -179.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -61.55 -32.33 72.39 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.931 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 76.5 p -72.35 -13.98 61.62 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.242 178.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 74.59 42.4 32.87 Favored Glycine 0 C--N 1.345 1.081 0 N-CA-C 111.667 -0.573 . . . . 0.0 111.667 179.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 29.4 p -80.3 -15.87 55.93 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.914 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.3 2.72 61.88 Favored Glycine 0 CA--C 1.54 1.611 0 CA-C-O 119.971 -0.349 . . . . 0.0 113.073 179.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -102.96 -168.13 1.48 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 117.373 0.587 . . . . 0.0 109.837 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -98.9 142.01 30.95 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 110.755 -0.091 . . . . 0.0 110.755 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -108.2 164.56 12.77 Favored Glycine 0 CA--C 1.531 1.07 0 N-CA-C 111.414 -0.675 . . . . 0.0 111.414 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -119.22 122.72 29.29 Favored Pre-proline 0 CA--C 1.54 0.587 0 CA-C-O 119.195 -0.431 . . . . 0.0 111.135 -179.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -67.37 -16.35 47.68 Favored 'Trans proline' 0 N--CA 1.493 1.471 0 C-N-CA 121.775 1.65 . . . . 0.0 112.957 178.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -76.77 -35.58 57.61 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 177.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.6 p -72.08 -156.66 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 178.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -91.22 26.62 2.14 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 118.235 0.47 . . . . 0.0 112.09 179.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 90.15 8.74 66.3 Favored Glycine 0 CA--C 1.534 1.246 0 CA-C-O 119.793 -0.448 . . . . 0.0 112.104 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.64 165.68 18.12 Favored 'General case' 0 C--N 1.345 0.399 0 CA-C-N 117.697 0.749 . . . . 0.0 111.326 -179.097 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 24.3 p -73.22 -156.45 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.744 -178.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.3 -51.48 11.9 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -179.065 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.3 t -67.94 -56.6 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -177.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 81.8 m -58.39 -38.09 76.61 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -178.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.412 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 5.3 t80 -57.16 -39.71 75.8 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -178.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 9.6 ttpt -75.82 -45.07 37.98 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.121 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -55.11 -38.86 68.69 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -179.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.412 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 2.2 p-80 -85.31 -32.38 22.52 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 120.136 -0.626 . . . . 0.0 111.278 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 25.6 tp -61.53 -30.3 70.54 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.612 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 22.8 tt0 -56.57 -37.54 70.72 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 120.732 0.301 . . . . 0.0 111.183 -179.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 45.5 mmm-85 -79.04 -28.22 43.22 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.558 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 . . . . . 0 N--CA 1.466 0.336 0 O-C-N 123.051 0.219 . . . . 0.0 111.45 -179.748 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 12.5 mmt . . . . . 0 CA--C 1.534 0.353 0 CA-C-O 120.823 0.344 . . . . 0.0 111.286 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.7 mp -80.42 147.23 31.07 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 178.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.3 t -49.21 115.86 1.47 Allowed 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 121.24 0.543 . . . . 0.0 112.359 -178.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 66.8 m -60.52 -20.1 59.18 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.073 -0.967 . . . . 0.0 113.129 -178.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 76.0 p -80.74 -11.96 59.54 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 97.98 40.42 3.55 Favored Glycine 0 C--N 1.346 1.093 0 C-N-CA 121.272 -0.489 . . . . 0.0 112.454 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.4 m -87.39 -28.55 22.09 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.808 0.304 . . . . 0.0 111.718 179.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.49 8.13 85.34 Favored Glycine 0 CA--C 1.541 1.675 0 N-CA-C 111.463 -0.655 . . . . 0.0 111.463 -177.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -106.24 -175.98 2.95 Favored 'General case' 0 C--N 1.346 0.435 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -94.03 142.01 27.88 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 120.887 0.375 . . . . 0.0 111.474 -179.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -113.18 169.46 12.95 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 109.967 -1.253 . . . . 0.0 109.967 179.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -112.66 138.65 22.13 Favored Pre-proline 0 CA--C 1.537 0.478 0 CA-C-O 119.646 -0.216 . . . . 0.0 110.577 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -73.48 -27.18 13.38 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 C-N-CA 122.019 1.813 . . . . 0.0 112.547 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 67.2 mtt180 -72.83 -36.07 67.41 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 178.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 60.3 p -75.66 -154.51 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.154 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -90.37 29.48 1.26 Allowed 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.256 0.48 . . . . 0.0 112.153 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.25 17.0 65.54 Favored Glycine 0 CA--C 1.535 1.327 0 C-N-CA 121.126 -0.559 . . . . 0.0 112.374 179.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 15.3 mtt -124.26 179.7 4.79 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 117.339 0.57 . . . . 0.0 109.79 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 20.2 p -83.63 -175.61 5.9 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 122.966 0.166 . . . . 0.0 110.591 -179.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.61 -45.61 78.57 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -177.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 6.4 t -66.28 -37.17 79.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 CA-C-O 120.76 0.314 . . . . 0.0 111.361 -178.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 21.7 m -73.49 -40.08 64.37 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.326 -178.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.409 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 18.4 t80 -61.82 -33.66 74.53 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -177.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.28 -45.85 18.92 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.472 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -62.88 -46.97 85.35 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -178.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.409 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.7 p-80 -76.61 -40.5 49.23 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 119.964 -0.694 . . . . 0.0 112.375 -177.82 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 26.8 tp -60.45 -27.35 67.45 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 120.781 0.324 . . . . 0.0 110.827 178.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -66.77 -38.4 86.5 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.53 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -75.38 -30.09 60.06 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.741 -179.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 . . . . . 0 N--CA 1.465 0.278 0 CA-C-O 120.502 0.191 . . . . 0.0 110.984 179.745 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.536 0.404 0 CA-C-O 120.667 0.27 . . . . 0.0 110.451 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.4 tp -79.56 144.8 33.56 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.948 -0.301 . . . . 0.0 110.338 -179.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.3 t -37.21 117.46 0.54 Allowed 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -179.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 49.0 m -58.91 -26.29 64.19 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.412 179.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 19.7 p -83.28 -8.43 59.45 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 73.59 43.24 37.32 Favored Glycine 0 C--N 1.347 1.14 0 C-N-CA 121.307 -0.473 . . . . 0.0 112.666 178.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.4 p -85.04 -14.32 47.71 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 117.119 0.46 . . . . 0.0 111.83 179.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 96.7 2.72 59.75 Favored Glycine 0 CA--C 1.538 1.493 0 CA-C-O 119.39 -0.672 . . . . 0.0 113.901 178.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -105.91 -171.24 1.87 Allowed 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.304 1.052 . . . . 0.0 110.539 -178.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -96.71 143.73 27.38 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.873 0.368 . . . . 0.0 111.436 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -111.35 161.15 12.87 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 110.199 -1.16 . . . . 0.0 110.199 179.044 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 24.7 t30 -107.33 137.33 19.59 Favored Pre-proline 0 CA--C 1.535 0.368 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -72.73 -28.05 14.3 Favored 'Trans proline' 0 N--CA 1.491 1.382 0 C-N-CA 121.754 1.636 . . . . 0.0 111.957 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -71.92 -31.69 66.62 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.234 178.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 68.5 p -77.1 -150.81 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 178.21 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -90.53 29.58 1.27 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.724 0.693 . . . . 0.0 111.121 179.362 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 73.74 18.22 79.46 Favored Glycine 0 CA--C 1.533 1.187 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -178.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 10.7 mtt -128.84 172.36 11.38 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-N 116.905 0.353 . . . . 0.0 110.398 -179.256 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 57.9 m -60.89 172.26 1.01 Allowed 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.115 -179.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 35.6 m -72.01 -46.32 57.6 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 179.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 16.0 t -70.4 -36.72 67.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 116.097 -0.502 . . . . 0.0 109.89 179.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 80.2 m -72.19 -37.24 69.34 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.654 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . 0.427 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 25.8 t80 -58.1 -33.13 68.77 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.736 -179.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.9 tttt -77.96 -44.15 27.65 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.037 0.446 . . . . 0.0 110.173 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -56.57 -40.83 75.87 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.844 -178.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . 0.427 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.9 p-80 -85.01 -33.63 22.51 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 120.321 -0.551 . . . . 0.0 112.162 -178.579 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.3 tp -60.79 -30.79 70.26 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 122.922 0.139 . . . . 0.0 111.219 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -68.64 -35.39 77.21 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.766 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.1 mmm-85 -71.68 -29.94 65.15 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.616 -179.477 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 . . . . . 0 N--CA 1.466 0.335 0 C-N-CA 121.254 -0.178 . . . . 0.0 111.375 -179.681 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 6.8 mmt . . . . . 0 CA--C 1.534 0.334 0 CA-C-O 120.87 0.367 . . . . 0.0 110.805 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -78.52 146.16 34.49 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.688 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.3 t -42.64 117.98 1.13 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -178.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.34 -23.68 50.41 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.72 179.285 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 46.4 p -81.33 -12.22 59.09 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -179.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.11 43.4 10.8 Favored Glycine 0 C--N 1.344 1.003 0 C-N-CA 121.255 -0.498 . . . . 0.0 112.58 178.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 3.7 p -87.44 -15.56 37.37 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 117.252 0.526 . . . . 0.0 111.989 179.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 92.71 4.35 65.58 Favored Glycine 0 CA--C 1.54 1.623 0 CA-C-O 119.639 -0.534 . . . . 0.0 114.071 178.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 36.7 m-85 -106.12 -169.53 1.59 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 117.944 0.872 . . . . 0.0 110.062 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -96.45 141.38 29.81 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.143 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -116.52 171.92 13.99 Favored Glycine 0 CA--C 1.529 0.956 0 N-CA-C 110.554 -1.019 . . . . 0.0 110.554 179.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -122.53 143.12 38.98 Favored Pre-proline 0 CA--C 1.538 0.497 0 CA-C-N 116.82 0.31 . . . . 0.0 111.181 -179.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -77.01 -21.76 11.97 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 C-N-CA 122.122 1.881 . . . . 0.0 113.122 179.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 5.9 mpt_? -73.98 -34.94 64.4 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 64.4 p -74.25 -156.69 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 178.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -91.52 25.5 2.62 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 118.379 0.536 . . . . 0.0 111.596 179.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.63 13.64 69.68 Favored Glycine 0 CA--C 1.538 1.476 0 N-CA-C 112.041 -0.424 . . . . 0.0 112.041 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.51 165.91 17.62 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-N 117.483 0.642 . . . . 0.0 111.387 -179.25 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 60.7 m -57.34 178.2 0.08 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.788 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 13.2 m -71.76 -43.0 66.53 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 16.2 t -73.98 -37.49 47.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.733 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 71.2 m -72.03 -38.14 69.62 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.715 -179.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -55.93 -38.68 70.61 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-O 120.625 0.25 . . . . 0.0 111.072 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.9 tttt -76.96 -43.9 33.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.955 -179.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -55.95 -40.01 72.57 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.744 -178.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -84.02 -32.73 24.75 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 120.087 -0.645 . . . . 0.0 111.414 -179.529 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 15.1 tp -60.21 -26.46 66.4 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.747 -0.206 . . . . 0.0 111.392 179.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -69.51 -37.81 77.34 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.461 0.172 . . . . 0.0 110.665 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.7 -32.27 60.02 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.7 179.812 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 . . . . . 0 C--O 1.232 0.176 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.985 -179.959 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.303 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.8 m -83.1 -53.81 5.52 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.612 0.244 . . . . 0.0 110.538 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 10.6 ptt? -69.83 156.09 39.57 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.806 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -128.58 32.69 4.78 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.734 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -110.92 33.27 4.69 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.986 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -105.67 97.76 7.55 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.658 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.0 m -97.91 122.63 41.25 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.406 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -115.41 -44.83 2.95 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.648 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -139.43 153.71 47.64 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.331 179.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 6.8 t -95.86 145.78 30.16 Favored Pre-proline 0 CA--C 1.537 0.466 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.584 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -90.86 160.18 4.06 Favored 'Trans proline' 0 N--CA 1.483 0.873 0 C-N-CA 122.531 2.154 . . . . 0.0 111.379 179.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.407 ' N ' ' CD ' ' A' ' 13' ' ' PRO . . . 83.72 44.11 6.97 Favored Glycine 0 CA--C 1.538 1.51 0 CA-C-O 119.252 -0.749 . . . . 0.0 112.393 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.407 ' CD ' ' N ' ' A' ' 12' ' ' GLY . 58.7 Cg_endo -72.49 84.42 1.19 Allowed 'Trans proline' 0 N--CA 1.494 1.538 0 CA-C-N 119.702 1.751 . . . . 0.0 111.099 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 4.5 mmt -71.7 66.04 0.52 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.372 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -75.02 144.92 42.85 Favored 'General case' 0 CA--C 1.527 0.094 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 8.7 t -49.78 128.06 17.34 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 112.27 0.471 . . . . 0.0 112.27 -179.022 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 28.5 m -63.71 -30.21 71.34 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.822 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 80.5 p -73.61 -19.01 60.98 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.03 43.12 6.82 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 121.216 -0.516 . . . . 0.0 112.863 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.8 p -85.7 -22.35 27.87 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 117.286 0.543 . . . . 0.0 111.108 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.28 8.08 50.77 Favored Glycine 0 CA--C 1.537 1.433 0 CA-C-O 119.85 -0.417 . . . . 0.0 113.165 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -114.3 159.37 20.28 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 117.673 0.737 . . . . 0.0 110.425 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.7 t80 -67.57 146.66 53.68 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.98 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -118.43 -179.08 17.07 Favored Glycine 0 CA--C 1.53 0.975 0 N-CA-C 110.526 -1.029 . . . . 0.0 110.526 179.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.3 t30 -126.94 138.88 33.57 Favored Pre-proline 0 N--CA 1.47 0.568 0 CA-C-O 119.466 -0.302 . . . . 0.0 110.528 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -77.11 -22.65 11.12 Favored 'Trans proline' 0 N--CA 1.489 1.206 0 C-N-CA 121.922 1.748 . . . . 0.0 112.53 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 28.2 mtm180 -71.17 -34.14 70.65 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 67.2 p -74.55 -157.49 0.06 Allowed 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 107.594 -1.262 . . . . 0.0 107.594 177.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -90.94 25.41 2.42 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 118.333 0.515 . . . . 0.0 111.208 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 82.52 10.6 83.18 Favored Glycine 0 CA--C 1.541 1.676 0 N-CA-C 111.65 -0.58 . . . . 0.0 111.65 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 3.0 mpp? -115.24 156.42 25.41 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 117.195 0.498 . . . . 0.0 110.448 -179.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 22.9 p -69.98 -160.63 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.036 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.47 -48.3 28.18 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -178.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 8.3 t -68.81 -56.92 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 N-CA-C 111.727 0.269 . . . . 0.0 111.727 -177.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 81.2 m -57.82 -35.32 70.71 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -178.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -62.96 -31.09 72.12 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 121.347 -0.141 . . . . 0.0 111.295 -179.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.7 tttt -75.67 -48.61 21.33 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.72 0.295 . . . . 0.0 110.717 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -63.31 -42.34 99.02 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.138 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 63.9 t60 -63.95 -48.37 76.79 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.621 -179.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 tp -63.63 -30.4 71.51 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 111.627 0.232 . . . . 0.0 111.627 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -65.03 -40.95 95.58 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 120.85 0.357 . . . . 0.0 110.329 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.87 -31.46 64.74 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.117 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -75.29 -39.4 59.69 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.573 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -66.61 -38.02 86.11 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.212 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -62.96 -27.82 69.66 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.656 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 6.8 t -67.56 -63.03 1.14 Allowed 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.72 -0.218 . . . . 0.0 110.724 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.99 -56.3 4.04 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -88.76 76.82 7.96 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 120.93 0.395 . . . . 0.0 110.458 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 17.8 ptt? -84.89 118.67 24.66 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.708 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.8 m -157.19 94.27 2.21 Favored Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.676 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -82.99 84.19 1.79 Allowed 'Trans proline' 0 N--CA 1.489 1.243 0 C-N-CA 122.402 2.068 . . . . 0.0 112.115 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.2 tpp -143.09 39.46 1.46 Allowed 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.419 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 83.56 -67.06 3.8 Favored Glycine 0 CA--C 1.527 0.836 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.0 t -109.86 166.91 10.56 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.684 0.278 . . . . 0.0 110.436 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -144.67 137.67 26.77 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.425 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 40.8 t -83.14 151.42 25.72 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.591 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 81.32 79.66 0.92 Allowed Glycine 0 CA--C 1.526 0.762 0 N-CA-C 110.877 -0.889 . . . . 0.0 110.877 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.1 t -139.99 34.5 1.95 Allowed 'General case' 0 C--O 1.236 0.39 0 CA-C-O 120.825 0.345 . . . . 0.0 110.712 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -83.57 152.26 24.95 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.522 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.0 t -145.93 86.86 6.98 Favored Pre-proline 0 CA--C 1.538 0.511 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.558 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -59.91 148.19 89.65 Favored 'Trans proline' 0 N--CA 1.499 1.844 0 C-N-CA 122.281 1.987 . . . . 0.0 111.936 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.7 p . . . . . 0 C--O 1.221 -0.43 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.516 -179.885 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.304 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.7 p -80.89 139.85 35.68 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 110.412 -0.218 . . . . 0.0 110.412 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 25.9 mmt -92.18 87.06 5.96 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.652 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -137.04 32.03 2.66 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.888 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -122.15 32.83 5.67 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.879 0.371 . . . . 0.0 110.654 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -71.5 -179.26 2.45 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.648 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.2 p -83.26 121.99 27.84 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.37 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -97.64 -30.28 12.93 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.303 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -64.24 97.57 0.19 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.762 -0.199 . . . . 0.0 110.704 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.8 p -155.99 157.32 31.26 Favored Pre-proline 0 CA--C 1.537 0.453 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.643 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -60.53 151.76 73.07 Favored 'Trans proline' 0 N--CA 1.501 1.944 0 C-N-CA 122.497 2.131 . . . . 0.0 112.178 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 169.08 -59.21 0.2 Allowed Glycine 0 CA--C 1.536 1.374 0 CA-C-O 119.362 -0.688 . . . . 0.0 111.769 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -59.33 84.53 0.06 OUTLIER 'Trans proline' 0 N--CA 1.503 2.05 0 C-N-CA 122.229 1.953 . . . . 0.0 112.888 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.04 89.51 0.81 Allowed 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.17 179.494 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.2 mp -75.05 146.58 41.42 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.193 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.2 t -46.7 137.08 7.29 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -179.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.5 m -65.95 -33.94 76.96 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.008 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 79.8 p -70.19 -13.43 62.18 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.309 -0.405 . . . . 0.0 112.084 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.26 25.61 63.4 Favored Glycine 0 CA--C 1.531 1.039 0 N-CA-C 112.133 -0.387 . . . . 0.0 112.133 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.7 p -65.91 -19.3 65.82 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 117.277 0.538 . . . . 0.0 111.832 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.45 8.06 58.8 Favored Glycine 0 CA--C 1.538 1.477 0 CA-C-O 119.863 -0.409 . . . . 0.0 112.967 179.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 44.4 m-85 -104.39 -173.07 2.22 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 117.506 0.653 . . . . 0.0 110.628 -179.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -97.05 142.33 29.12 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.78 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -113.89 176.13 16.9 Favored Glycine 0 CA--C 1.531 1.046 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -126.02 141.28 39.11 Favored Pre-proline 0 CA--C 1.54 0.586 0 CA-C-O 119.488 -0.291 . . . . 0.0 110.903 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -75.22 -24.16 12.74 Favored 'Trans proline' 0 N--CA 1.496 1.626 0 C-N-CA 122.234 1.956 . . . . 0.0 112.787 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 28.5 mtt-85 -72.59 -32.01 65.64 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 178.572 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.4 p -81.03 -152.98 0.09 Allowed 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 177.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -92.33 28.5 1.92 Allowed 'General case' 0 C--O 1.236 0.382 0 CA-C-N 118.166 0.439 . . . . 0.0 111.53 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 76.34 12.72 84.01 Favored Glycine 0 CA--C 1.537 1.452 0 C-N-CA 121.094 -0.574 . . . . 0.0 111.837 -179.245 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 14.7 mtt -118.33 168.31 10.74 Favored 'General case' 0 C--N 1.347 0.484 0 CA-C-N 117.568 0.684 . . . . 0.0 111.168 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 20.7 p -78.43 -164.1 0.52 Allowed 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.392 -178.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.27 -45.39 48.04 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -178.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 21.3 t -70.71 -57.19 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 83.5 m -58.99 -35.16 72.76 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -178.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -66.74 -29.88 69.96 Favored 'General case' 0 N--CA 1.467 0.417 0 O-C-N 123.074 0.234 . . . . 0.0 111.602 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.5 tttt -76.0 -48.04 22.58 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.594 0.235 . . . . 0.0 110.641 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -62.46 -37.78 87.24 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.741 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 32.4 t60 -61.05 -49.02 79.07 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.281 -179.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.3 mp -59.45 -27.99 66.57 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.668 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 4.5 tp60 -60.02 -43.01 95.55 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 120.367 0.127 . . . . 0.0 111.336 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -69.24 -29.63 67.6 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.219 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -65.27 -41.66 94.0 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 120.567 0.222 . . . . 0.0 111.233 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -83.71 17.74 2.18 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -178.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -58.72 -33.39 70.15 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 118.403 0.547 . . . . 0.0 110.85 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 32.7 t -83.57 -62.2 1.64 Allowed 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.448 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.02 -48.84 1.77 Allowed Glycine 0 CA--C 1.528 0.862 0 N-CA-C 112.003 -0.439 . . . . 0.0 112.003 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 68.2 mtm180 -78.05 171.49 14.94 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.587 0.232 . . . . 0.0 110.753 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 12.5 mtt -75.42 -43.88 47.49 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.202 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 10.5 p -131.89 154.38 81.72 Favored Pre-proline 0 CA--C 1.535 0.37 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.813 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -80.11 -169.64 0.84 Allowed 'Trans proline' 0 N--CA 1.493 1.464 0 C-N-CA 122.432 2.088 . . . . 0.0 112.374 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 3.1 ttt -141.52 -55.68 0.47 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.716 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 135.62 -58.31 0.67 Allowed Glycine 0 CA--C 1.526 0.776 0 N-CA-C 110.81 -0.916 . . . . 0.0 110.81 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.9 m -144.46 160.39 41.16 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 110.45 -0.204 . . . . 0.0 110.45 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -82.07 113.77 20.17 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.502 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 57.1 p -119.17 -178.55 3.6 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.283 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.09 58.85 1.2 Allowed Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 10.2 t -147.19 32.72 0.9 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 120.77 0.319 . . . . 0.0 110.912 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -103.8 152.23 22.13 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.457 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.4 m -126.09 91.12 48.74 Favored Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.416 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -81.13 120.19 3.67 Favored 'Trans proline' 0 N--CA 1.492 1.42 0 C-N-CA 122.374 2.049 . . . . 0.0 112.287 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 3.7 m . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.544 179.878 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.463 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 61.3 m -85.77 -36.74 19.93 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.453 0.168 . . . . 0.0 110.835 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 39.1 mtp -137.33 -54.81 0.69 Allowed 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.74 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -133.19 -62.41 0.8 Allowed 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.545 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 14.0 tt0 -133.54 -56.2 0.89 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.472 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -134.96 179.38 6.35 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.414 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -88.72 156.52 18.94 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.669 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -106.26 28.51 7.65 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.382 -179.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -106.14 177.49 4.84 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.641 0.257 . . . . 0.0 110.888 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.2 t -149.69 147.0 21.6 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.342 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -83.3 127.76 4.64 Favored 'Trans proline' 0 N--CA 1.491 1.361 0 C-N-CA 122.419 2.08 . . . . 0.0 112.313 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 83.07 45.44 6.63 Favored Glycine 0 CA--C 1.537 1.438 0 CA-C-O 119.105 -0.831 . . . . 0.0 112.288 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.82 73.66 4.15 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 CA-C-N 119.829 1.815 . . . . 0.0 111.141 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 14.9 mtt -70.11 73.73 0.47 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.509 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -74.21 146.07 43.65 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.627 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.8 t -45.53 137.81 4.82 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -179.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 66.6 m -69.95 -24.53 63.36 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.811 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 75.0 p -80.48 -17.99 49.98 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.43 31.14 22.85 Favored Glycine 0 C--N 1.34 0.762 0 C-N-CA 121.117 -0.564 . . . . 0.0 112.401 179.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.5 p -72.96 -19.79 61.17 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.904 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 97.17 10.46 54.51 Favored Glycine 0 CA--C 1.538 1.491 0 CA-C-O 119.778 -0.457 . . . . 0.0 113.035 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -117.06 166.0 12.72 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 117.707 0.753 . . . . 0.0 111.335 -179.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -67.48 145.74 54.66 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.303 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -110.58 163.72 12.3 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.7 t30 -113.06 126.45 28.21 Favored Pre-proline 0 CA--C 1.539 0.556 0 CA-C-O 119.379 -0.343 . . . . 0.0 110.236 179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.08 -16.63 28.67 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 121.825 1.684 . . . . 0.0 113.073 179.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 50.0 mtt180 -76.89 -35.01 57.71 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 177.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 42.9 p -73.03 -154.77 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 178.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -90.83 27.52 1.77 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.17 0.441 . . . . 0.0 111.253 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 84.94 10.89 77.84 Favored Glycine 0 CA--C 1.537 1.418 0 N-CA-C 111.714 -0.554 . . . . 0.0 111.714 -179.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.92 163.49 19.18 Favored 'General case' 0 C--N 1.344 0.336 0 CA-C-N 117.039 0.419 . . . . 0.0 110.645 -179.296 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 23.9 p -72.16 -158.31 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.71 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.21 -51.49 11.99 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -178.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 10.8 t -66.2 -54.83 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 N-CA-C 111.56 0.208 . . . . 0.0 111.56 -178.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 75.9 m -58.35 -36.14 73.0 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -178.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -57.39 -41.36 80.12 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 111.512 0.19 . . . . 0.0 111.512 -179.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.6 ttpt -75.14 -45.45 40.78 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.918 0.39 . . . . 0.0 110.343 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 -54.75 -39.76 68.64 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.802 -0.635 . . . . 0.0 112.525 -179.034 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -84.6 -32.74 23.58 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.358 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.0 tp -61.69 -27.28 68.58 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.889 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -69.08 -38.94 79.27 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 26.5 mtt-85 -70.83 -30.71 67.21 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.82 179.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -72.6 -34.23 67.25 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.803 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -76.31 -34.02 59.03 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.824 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -65.68 -17.94 64.97 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.7 m -67.37 -34.4 77.22 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 121.132 -0.227 . . . . 0.0 110.973 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 66.91 61.16 5.45 Favored Glycine 0 CA--C 1.528 0.863 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 74.5 mtm180 -87.94 -40.9 13.54 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.451 0.167 . . . . 0.0 111.033 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 8.7 ttt -112.8 35.3 3.94 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.858 0.361 . . . . 0.0 110.539 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.2 p -148.37 158.03 41.38 Favored Pre-proline 0 CA--C 1.536 0.414 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.521 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.62 150.96 28.27 Favored 'Trans proline' 0 N--CA 1.494 1.502 0 C-N-CA 122.291 1.994 . . . . 0.0 111.968 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -143.01 164.58 29.69 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.428 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 103.08 -59.98 0.51 Allowed Glycine 0 CA--C 1.527 0.818 0 N-CA-C 110.783 -0.927 . . . . 0.0 110.783 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 41.3 p -83.2 112.03 19.48 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 110.451 -0.203 . . . . 0.0 110.451 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -93.5 163.51 13.54 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.907 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 72.3 p -146.74 34.79 0.93 Allowed 'General case' 0 C--O 1.237 0.428 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.693 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 84.61 48.55 4.95 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 110.69 -0.964 . . . . 0.0 110.69 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.1 p -149.2 33.93 0.73 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 120.793 0.33 . . . . 0.0 110.597 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -76.2 132.66 40.06 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.636 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.7 m -88.31 154.5 51.61 Favored Pre-proline 0 CA--C 1.533 0.317 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.263 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -76.55 157.75 36.23 Favored 'Trans proline' 0 N--CA 1.494 1.541 0 C-N-CA 122.283 1.988 . . . . 0.0 112.057 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 44.4 p . . . . . 0 C--O 1.22 -0.482 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.506 179.995 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.312 0 N-CA-C 109.408 -1.477 . . . . 0.0 109.408 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.2 t -85.33 -57.72 2.96 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 13.3 mmt -88.9 104.34 16.85 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.397 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -137.74 33.64 2.44 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.697 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -93.28 -55.18 3.4 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.397 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -76.79 175.47 9.4 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.478 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 41.1 p -91.83 -176.41 4.44 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.427 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -91.06 -46.03 8.36 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.187 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -89.21 107.16 18.9 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.447 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.5 p -144.8 96.01 5.17 Favored Pre-proline 0 CA--C 1.536 0.439 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.163 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.26 107.99 0.36 Allowed 'Trans proline' 0 N--CA 1.5 1.87 0 C-N-CA 122.093 1.862 . . . . 0.0 111.987 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -161.68 -62.99 0.02 OUTLIER Glycine 0 CA--C 1.535 1.293 0 N-CA-C 110.908 -0.877 . . . . 0.0 110.908 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -60.03 87.97 0.07 OUTLIER 'Trans proline' 0 N--CA 1.5 1.875 0 C-N-CA 122.41 2.074 . . . . 0.0 112.104 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 29.7 mmm -71.68 84.14 0.88 Allowed 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.7 mp -79.31 145.43 33.48 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.717 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 8.8 t -45.34 131.54 8.1 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -178.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.0 m -62.59 -24.84 67.77 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.215 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 33.7 p -81.2 -10.62 59.59 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -178.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 78.12 25.48 61.76 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.53 179.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.6 p -67.45 -15.57 63.74 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-N 117.324 0.562 . . . . 0.0 111.279 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.15 8.87 68.18 Favored Glycine 0 CA--C 1.535 1.321 0 CA-C-O 119.997 -0.335 . . . . 0.0 113.206 179.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -106.15 -173.6 2.34 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 117.31 0.555 . . . . 0.0 110.303 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -93.14 141.71 28.12 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.865 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -112.75 169.32 12.94 Favored Glycine 0 CA--C 1.528 0.887 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 179.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -115.61 138.42 23.82 Favored Pre-proline 0 CA--C 1.541 0.632 0 CA-C-O 119.65 -0.214 . . . . 0.0 110.673 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -76.65 -25.92 8.9 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 122.49 2.126 . . . . 0.0 112.588 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 13.9 mtt-85 -73.84 -29.26 62.03 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.194 178.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 67.9 p -85.49 -150.43 0.13 Allowed 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 177.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -91.7 28.08 1.87 Allowed 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 118.791 0.723 . . . . 0.0 111.623 179.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 74.56 16.41 80.12 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 121.255 -0.498 . . . . 0.0 111.972 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 35.0 mtt -117.45 163.81 15.83 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 117.339 0.57 . . . . 0.0 109.903 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 31.3 p -73.76 -163.82 0.19 Allowed 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.774 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.47 -41.97 62.5 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.315 0.857 . . . . 0.0 113.315 -178.23 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 10.1 t -72.52 -49.81 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-O 120.785 0.326 . . . . 0.0 110.869 -178.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 72.5 m -65.41 -36.2 83.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.538 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -65.76 -36.8 84.58 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.12 -44.62 46.03 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.266 -0.574 . . . . 0.0 109.716 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -65.35 -43.26 91.39 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 123.146 0.279 . . . . 0.0 111.24 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -59.52 -49.25 78.49 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -178.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.04 -25.94 65.73 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.005 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -64.41 -39.64 94.23 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 111.566 0.21 . . . . 0.0 111.566 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 10.4 mtt-85 -74.85 -30.51 61.37 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.15 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -71.03 -38.63 72.58 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.537 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.9 tt0 -72.37 -37.85 68.67 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.538 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 61.3 m-20 -80.15 -5.24 55.68 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 41.4 t -59.27 -53.7 55.28 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 117.768 0.258 . . . . 0.0 111.237 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 134.93 68.22 0.07 OUTLIER Glycine 0 CA--C 1.527 0.812 0 N-CA-C 111.14 -0.784 . . . . 0.0 111.14 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.3 mtt85 -106.52 37.33 2.34 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 120.969 0.414 . . . . 0.0 110.491 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 9.5 tpt -111.77 -55.98 2.44 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.857 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.9 m -92.49 165.19 20.0 Favored Pre-proline 0 CA--C 1.536 0.438 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.744 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -57.57 -62.8 0.18 Allowed 'Trans proline' 0 N--CA 1.5 1.901 0 C-N-CA 122.305 2.003 . . . . 0.0 112.382 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 18.5 ttt -83.01 -62.85 1.49 Allowed 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.624 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 139.26 -67.68 0.51 Allowed Glycine 0 CA--C 1.526 0.744 0 N-CA-C 111.059 -0.817 . . . . 0.0 111.059 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.8 p -101.63 147.55 26.3 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.546 0.212 . . . . 0.0 110.58 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -85.41 -44.9 12.37 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.443 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.9 t -96.4 -41.01 8.82 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.466 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 70.22 73.99 0.71 Allowed Glycine 0 CA--C 1.526 0.745 0 N-CA-C 111.028 -0.829 . . . . 0.0 111.028 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.0 m -103.73 34.51 2.96 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 120.86 0.362 . . . . 0.0 110.741 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -107.25 143.8 34.96 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.641 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 13.5 p -160.65 159.78 25.61 Favored Pre-proline 0 CA--C 1.535 0.371 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.574 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -55.35 177.73 0.11 Allowed 'Trans proline' 0 N--CA 1.502 1.99 0 C-N-CA 122.396 2.064 . . . . 0.0 112.449 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 4.7 t . . . . . 0 C--O 1.22 -0.449 0 CA-C-O 117.954 -1.022 . . . . 0.0 110.575 179.995 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.316 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.5 t -84.8 127.69 34.25 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.592 0.234 . . . . 0.0 110.522 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 30.1 tpp -82.61 97.94 8.74 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.604 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -136.58 -62.72 0.64 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.557 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -100.34 34.73 2.29 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.749 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -103.87 124.91 49.81 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.428 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 15.9 p -71.7 156.98 38.75 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.989 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -103.09 31.08 4.43 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.892 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -139.11 115.07 10.17 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.64 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 53.2 p -106.37 135.2 19.51 Favored Pre-proline 0 CA--C 1.539 0.525 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.132 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -81.91 123.5 4.15 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 C-N-CA 122.254 1.969 . . . . 0.0 112.296 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 164.89 -54.96 0.27 Allowed Glycine 0 CA--C 1.535 1.334 0 C-N-CA 121.059 -0.591 . . . . 0.0 111.795 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -78.85 82.95 2.36 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 122.274 1.983 . . . . 0.0 112.497 -179.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 12.3 mmt -72.29 82.29 1.03 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.24 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mp -76.11 143.56 41.19 Favored 'General case' 0 C--O 1.232 0.144 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.5 t -40.05 131.48 1.99 Allowed 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 -178.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 47.7 m -65.36 -26.2 67.92 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.16 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 51.9 p -78.96 -12.91 60.05 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 121.186 -0.206 . . . . 0.0 111.377 179.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 78.38 37.13 28.57 Favored Glycine 0 C--N 1.349 1.292 0 CA-C-O 119.808 -0.44 . . . . 0.0 113.375 178.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 29.1 p -77.56 -7.98 57.14 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 117.258 0.529 . . . . 0.0 111.801 178.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 85.4 5.94 84.43 Favored Glycine 0 CA--C 1.538 1.507 0 CA-C-O 119.774 -0.459 . . . . 0.0 113.207 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -109.79 172.02 7.1 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 117.679 0.739 . . . . 0.0 109.995 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -78.49 145.7 34.81 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.155 -178.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -118.59 169.35 13.43 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -112.27 141.81 25.77 Favored Pre-proline 0 N--CA 1.471 0.597 0 CA-C-N 116.73 0.265 . . . . 0.0 110.774 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.0 -29.35 6.78 Favored 'Trans proline' 0 N--CA 1.495 1.565 0 C-N-CA 122.082 1.854 . . . . 0.0 112.307 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -71.72 -27.28 62.91 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 178.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 71.0 p -83.6 -152.74 0.13 Allowed 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -90.87 26.72 2.0 Allowed 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 118.236 0.471 . . . . 0.0 111.238 179.32 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 72.97 15.53 78.41 Favored Glycine 0 CA--C 1.536 1.4 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 -177.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.7 mtp -121.65 163.41 19.02 Favored 'General case' 0 C--N 1.347 0.491 0 CA-C-N 117.085 0.443 . . . . 0.0 109.94 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 29.9 p -74.57 -167.39 0.55 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.911 -178.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.15 -37.68 61.24 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 -177.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.0 t -72.13 -49.42 43.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-O 120.579 0.228 . . . . 0.0 111.247 -177.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 67.4 m -70.27 -34.45 72.81 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.73 -178.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -69.47 -27.51 65.28 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 119.447 -0.311 . . . . 0.0 111.293 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt -78.12 -45.99 21.87 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 117.992 0.36 . . . . 0.0 110.041 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -64.7 -38.87 92.48 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.587 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 54.3 t60 -66.12 -41.41 90.58 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.096 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.2 tp -71.61 -42.22 67.95 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.132 -178.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -65.09 -35.83 82.39 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.865 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 11.2 ttt180 -77.14 -28.48 54.28 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.722 178.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -76.83 -35.6 57.43 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.749 -0.205 . . . . 0.0 111.067 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -77.8 -22.51 49.95 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -178.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -57.9 -39.29 77.56 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -178.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.5 t -136.33 -56.01 0.75 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 120.498 0.189 . . . . 0.0 111.108 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 70.29 51.12 23.72 Favored Glycine 0 CA--C 1.528 0.856 0 N-CA-C 110.583 -1.007 . . . . 0.0 110.583 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -119.53 157.8 27.61 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.5 mtt -69.72 111.67 5.66 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.3 p -147.8 157.5 43.84 Favored Pre-proline 0 CA--C 1.534 0.361 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.004 -179.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -67.08 165.55 26.05 Favored 'Trans proline' 0 N--CA 1.498 1.74 0 C-N-CA 122.278 1.985 . . . . 0.0 112.189 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 9.9 ptt? -64.66 -33.58 76.27 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.97 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 88.77 -67.97 2.9 Favored Glycine 0 CA--C 1.526 0.729 0 N-CA-C 111.293 -0.723 . . . . 0.0 111.293 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.0 m -80.95 138.43 36.1 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.625 0.25 . . . . 0.0 110.86 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -74.89 161.69 29.3 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.404 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.8 t -86.38 -178.96 6.57 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.54 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 74.35 47.78 16.1 Favored Glycine 0 CA--C 1.528 0.856 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 88.1 p -86.93 -40.57 14.7 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.548 0.213 . . . . 0.0 110.453 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 58.2 m-80 -82.89 124.76 30.64 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.512 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 68.0 m -158.09 158.56 30.07 Favored Pre-proline 0 CA--C 1.533 0.325 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.445 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -56.58 138.53 85.01 Favored 'Trans proline' 0 N--CA 1.5 1.912 0 C-N-CA 122.341 2.027 . . . . 0.0 112.288 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 5.1 t . . . . . 0 C--O 1.22 -0.485 0 CA-C-O 117.982 -1.008 . . . . 0.0 110.619 -179.997 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.39 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.1 t -137.53 104.77 5.44 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 110.544 -0.169 . . . . 0.0 110.544 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 63.2 mtp -101.39 94.12 5.76 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.575 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -116.3 -35.55 4.29 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.255 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -67.18 -34.58 77.82 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.438 -179.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -96.37 53.08 1.29 Allowed 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.256 0.55 . . . . 0.0 111.14 -179.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 80.6 p -146.07 153.69 41.0 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.198 179.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -68.63 -49.88 55.73 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.216 179.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 21.3 pt20 -120.98 175.67 5.94 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.035 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 58.7 p -140.61 89.98 10.11 Favored Pre-proline 0 CA--C 1.538 0.489 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.592 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_exo -67.11 137.21 43.41 Favored 'Trans proline' 0 N--CA 1.498 1.766 0 C-N-CA 122.304 2.003 . . . . 0.0 111.781 179.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 170.26 -57.92 0.19 Allowed Glycine 0 CA--C 1.534 1.247 0 N-CA-C 111.548 -0.621 . . . . 0.0 111.548 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -68.98 77.41 0.79 Allowed 'Trans proline' 0 N--CA 1.494 1.509 0 C-N-CA 121.983 1.789 . . . . 0.0 111.861 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 4.2 mmt -71.74 82.3 0.87 Allowed 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.308 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.1 tp -74.83 144.75 43.32 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.294 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.2 t -44.1 132.38 5.59 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -178.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.0 m -65.44 -32.89 74.75 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.332 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 73.8 p -72.65 -13.4 61.35 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.23 43.48 25.61 Favored Glycine 0 C--N 1.345 1.054 0 N-CA-C 111.771 -0.532 . . . . 0.0 111.771 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 29.2 p -85.38 -14.38 46.51 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.59 4.38 60.68 Favored Glycine 0 CA--C 1.536 1.406 0 C-N-CA 121.306 -0.473 . . . . 0.0 113.296 179.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -114.09 163.62 14.93 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-N 117.674 0.737 . . . . 0.0 110.561 -179.629 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -68.05 144.77 54.96 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.749 -179.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -110.13 161.19 13.03 Favored Glycine 0 CA--C 1.528 0.848 0 N-CA-C 110.777 -0.929 . . . . 0.0 110.777 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 22.5 t30 -108.1 118.9 51.49 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-O 119.329 -0.367 . . . . 0.0 110.606 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -67.18 -18.91 51.13 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 C-N-CA 121.675 1.583 . . . . 0.0 112.154 179.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 60.9 mtp180 -75.36 -31.98 60.69 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 177.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 70.4 p -79.09 -153.44 0.07 Allowed 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -89.93 26.54 1.79 Allowed 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 118.204 0.456 . . . . 0.0 111.982 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.02 10.68 78.06 Favored Glycine 0 CA--C 1.536 1.391 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.75 161.8 21.96 Favored 'General case' 0 C--N 1.347 0.457 0 CA-C-N 117.249 0.524 . . . . 0.0 111.193 -178.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 31.1 p -72.25 -157.43 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.652 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.58 -49.26 19.11 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -178.503 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.4 t -69.68 -52.04 35.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -177.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 71.2 m -60.05 -36.15 76.7 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -178.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.42 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 14.5 t80 -58.87 -48.42 81.46 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 -178.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.1 pttt -72.32 -44.14 63.11 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -54.63 -39.61 68.13 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.179 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.42 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 0.8 OUTLIER -85.34 -33.33 22.08 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 120.425 -0.51 . . . . 0.0 111.753 -179.445 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 14.9 tp -62.47 -30.6 71.37 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.453 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -65.93 -39.29 90.38 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.379 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 70.0 mtt-85 -79.23 -30.86 43.41 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.572 -0.286 . . . . 0.0 111.229 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.9 tp60 -75.63 -37.77 59.45 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.076 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -73.64 -40.59 63.63 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.948 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 65.6 m-20 -66.53 -42.19 87.61 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.844 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.1 t -74.42 -63.84 1.15 Allowed 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.825 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 70.96 56.53 7.03 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 53.4 mmt-85 -125.06 -47.6 1.77 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.451 0.167 . . . . 0.0 110.566 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 42.2 mtm -100.97 113.2 25.97 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.373 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.0 m -90.61 166.38 19.59 Favored Pre-proline 0 CA--C 1.535 0.402 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.684 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -58.08 171.35 1.71 Allowed 'Trans proline' 0 N--CA 1.5 1.883 0 C-N-CA 122.294 1.996 . . . . 0.0 112.244 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 74.6 mmm -84.85 174.74 9.6 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.505 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 74.01 35.77 53.18 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.9 p -94.76 157.93 15.73 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.492 0.187 . . . . 0.0 110.565 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -86.26 139.75 30.74 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.494 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.9 t -81.0 174.25 11.8 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.58 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.89 78.1 1.39 Allowed Glycine 0 CA--C 1.527 0.789 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.0 t -122.29 36.19 4.69 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.007 0.432 . . . . 0.0 110.444 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -71.03 127.74 33.59 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.667 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.3 p -158.22 88.91 2.31 Favored Pre-proline 0 CA--C 1.538 0.497 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.414 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -80.24 -169.63 0.83 Allowed 'Trans proline' 0 N--CA 1.492 1.438 0 C-N-CA 122.396 2.064 . . . . 0.0 112.248 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 4.6 t . . . . . 0 C--O 1.22 -0.464 0 CA-C-O 118.061 -0.971 . . . . 0.0 110.577 -179.97 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.418 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.6 m -106.06 111.32 23.89 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 110.436 -0.209 . . . . 0.0 110.436 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 50.8 mtt -150.31 105.1 3.31 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.724 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -136.49 33.64 2.75 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.764 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -135.4 35.57 2.97 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 120.957 0.408 . . . . 0.0 110.723 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -133.6 104.26 6.29 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.475 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 16.9 p -80.4 150.18 29.9 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.595 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -105.0 -35.37 7.68 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.039 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -98.69 94.66 6.76 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.909 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 4.9 t -148.98 90.02 4.83 Favored Pre-proline 0 CA--C 1.54 0.594 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.575 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -57.85 140.24 93.09 Favored 'Trans proline' 0 N--CA 1.502 1.992 0 C-N-CA 122.359 2.04 . . . . 0.0 112.287 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.99 44.78 35.11 Favored Glycine 0 CA--C 1.542 1.762 0 CA-C-O 119.332 -0.704 . . . . 0.0 112.627 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.23 71.64 5.69 Favored 'Trans proline' 0 N--CA 1.498 1.755 0 C-N-CA 122.126 1.884 . . . . 0.0 112.365 -179.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 11.3 mmt -72.46 72.02 0.96 Allowed 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.313 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 18.2 mt -79.36 140.43 37.48 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.375 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.7 t -38.93 136.19 0.8 Allowed 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -177.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m -64.92 -29.33 70.26 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.534 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 44.0 p -82.23 -6.96 59.59 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 71.73 43.52 51.09 Favored Glycine 0 C--N 1.344 0.978 0 C-N-CA 121.24 -0.505 . . . . 0.0 112.085 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.4 p -82.29 -6.81 59.5 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.3 0.62 79.81 Favored Glycine 0 CA--C 1.54 1.614 0 CA-C-O 119.648 -0.529 . . . . 0.0 112.954 179.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -110.64 177.6 4.63 Favored 'General case' 0 C--N 1.344 0.363 0 CA-C-N 117.791 0.795 . . . . 0.0 111.151 -179.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -84.13 144.91 28.7 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.51 -178.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -114.25 159.59 13.63 Favored Glycine 0 CA--C 1.53 1.019 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 178.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -105.97 140.0 20.8 Favored Pre-proline 0 N--CA 1.468 0.428 0 CA-C-O 119.3 -0.381 . . . . 0.0 110.245 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -75.22 -23.15 13.72 Favored 'Trans proline' 0 N--CA 1.489 1.239 0 C-N-CA 121.746 1.63 . . . . 0.0 112.598 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 85.8 mtt-85 -75.33 -28.45 59.65 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 178.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 60.9 p -80.95 -151.29 0.08 Allowed 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 178.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -92.11 28.17 1.95 Allowed 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 117.984 0.356 . . . . 0.0 111.274 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 76.79 15.64 81.43 Favored Glycine 0 CA--C 1.536 1.349 0 N-CA-C 111.272 -0.731 . . . . 0.0 111.272 -178.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 40.2 mtt -123.65 169.76 11.15 Favored 'General case' 0 C--N 1.347 0.474 0 CA-C-N 117.389 0.594 . . . . 0.0 111.334 -179.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 22.4 p -79.08 -165.82 0.82 Allowed 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.781 -178.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.8 -41.98 51.29 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 13.9 t -68.27 -49.3 68.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -177.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 60.8 m -72.1 -34.64 68.79 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 -178.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -64.95 -27.03 68.56 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -178.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 55.2 tttt -75.94 -41.66 50.98 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -67.12 -45.8 76.05 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.458 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 42.3 t60 -57.56 -45.51 85.06 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 -178.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.0 mp -62.88 -29.12 70.52 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.958 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -66.79 -32.46 73.77 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 121.078 -0.249 . . . . 0.0 111.1 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -83.58 -33.59 25.35 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.672 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -78.67 -27.44 45.19 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.378 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -77.66 -41.98 36.31 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.425 -179.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -66.3 -41.1 90.24 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.733 -0.212 . . . . 0.0 110.788 -179.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 36.4 m -72.17 -64.47 0.94 Allowed 'General case' 0 C--O 1.233 0.225 0 N-CA-C 110.129 -0.322 . . . . 0.0 110.129 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.07 -55.59 3.65 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.496 -0.642 . . . . 0.0 111.496 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 21.8 ttm180 -135.13 -58.75 0.79 Allowed 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 121.305 -0.158 . . . . 0.0 111.262 -179.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 5.0 mmt -71.42 107.65 4.46 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.852 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 70.7 m -97.25 157.89 34.15 Favored Pre-proline 0 CA--C 1.533 0.325 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.141 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -77.48 -175.83 2.89 Favored 'Trans proline' 0 N--CA 1.493 1.481 0 C-N-CA 122.254 1.969 . . . . 0.0 112.112 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 45.4 mtm -88.59 -64.67 1.11 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.369 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 140.69 -59.87 0.56 Allowed Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.9 t -71.78 170.61 13.24 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 110.519 -0.178 . . . . 0.0 110.519 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -94.71 170.05 9.73 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.478 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.6 p -144.97 -56.74 0.34 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.465 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 90.28 53.05 2.4 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.5 m -146.09 -57.21 0.3 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.525 0.202 . . . . 0.0 110.586 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -95.05 146.47 24.25 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.631 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 35.7 m -86.62 153.6 55.65 Favored Pre-proline 0 CA--C 1.535 0.384 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.66 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -79.93 102.45 1.46 Allowed 'Trans proline' 0 N--CA 1.491 1.381 0 C-N-CA 122.335 2.023 . . . . 0.0 112.004 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 6.4 m . . . . . 0 C--O 1.219 -0.504 0 CA-C-O 118.022 -0.99 . . . . 0.0 110.592 -179.859 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.356 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.2 m -111.82 32.26 5.59 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 120.645 0.26 . . . . 0.0 110.872 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 61.7 mtt -69.07 -55.05 11.92 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.792 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -102.84 32.64 3.57 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.857 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -116.75 33.03 5.8 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.586 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -109.7 -178.53 3.56 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 120.748 0.308 . . . . 0.0 111.23 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.9 p -73.99 166.52 23.23 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.413 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -106.76 28.81 7.56 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.237 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -137.44 76.97 1.61 Allowed 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.218 0.532 . . . . 0.0 110.056 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 3.3 p -154.2 151.28 24.0 Favored Pre-proline 0 C--O 1.234 0.259 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.673 179.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -73.57 168.51 24.58 Favored 'Trans proline' 0 N--CA 1.493 1.498 0 C-N-CA 122.189 1.926 . . . . 0.0 112.064 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 143.31 -54.03 0.59 Allowed Glycine 0 CA--C 1.535 1.293 0 N-CA-C 111.445 -0.662 . . . . 0.0 111.445 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -79.72 95.15 1.03 Allowed 'Trans proline' 0 N--CA 1.493 1.477 0 C-N-CA 122.295 1.997 . . . . 0.0 112.78 -179.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -72.56 95.7 1.86 Allowed 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.757 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -78.22 142.84 37.63 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.83 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.1 t -51.1 120.95 5.42 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 39.5 m -59.67 -25.36 64.67 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.429 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 66.7 p -72.04 -18.95 61.91 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.63 39.71 8.09 Favored Glycine 0 C--N 1.342 0.91 0 C-N-CA 121.194 -0.527 . . . . 0.0 111.988 178.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.5 p -89.28 -20.38 24.17 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 120.946 -0.301 . . . . 0.0 111.359 178.412 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 93.96 5.5 62.54 Favored Glycine 0 CA--C 1.538 1.514 0 CA-C-O 120.011 -0.327 . . . . 0.0 113.248 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -103.14 -177.57 3.41 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-N 117.444 0.622 . . . . 0.0 110.937 -179.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.7 t80 -89.01 134.03 34.13 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.299 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -107.95 165.38 12.9 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.876 -179.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -114.92 134.89 22.41 Favored Pre-proline 0 CA--C 1.541 0.631 0 CA-C-O 119.523 -0.275 . . . . 0.0 111.419 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -76.55 -26.39 8.57 Favored 'Trans proline' 0 N--CA 1.496 1.638 0 C-N-CA 122.386 2.057 . . . . 0.0 112.228 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 36.3 mtt-85 -71.14 -33.33 69.97 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 45.9 p -77.52 -154.0 0.06 Allowed 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -91.58 27.65 1.95 Allowed 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.322 0.51 . . . . 0.0 111.466 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.88 15.3 79.44 Favored Glycine 0 CA--C 1.534 1.244 0 N-CA-C 112.315 -0.314 . . . . 0.0 112.315 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -118.89 164.18 15.81 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 117.195 0.498 . . . . 0.0 110.706 -179.144 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 31.2 p -76.26 -157.57 0.08 Allowed 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.549 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.78 -50.4 20.75 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -179.114 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 21.3 t -67.36 -55.8 15.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -177.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 91.1 m -55.73 -36.62 67.44 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -178.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.441 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 35.3 t80 -59.62 -43.18 93.86 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.1 ttpt -73.32 -46.37 49.84 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.724 0.297 . . . . 0.0 110.385 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -54.85 -39.4 68.58 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.376 -178.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.441 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 0.8 OUTLIER -85.98 -33.28 21.14 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 120.309 -0.557 . . . . 0.0 112.212 -179.238 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 17.5 tp -63.98 -33.4 75.64 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.555 0.217 . . . . 0.0 111.057 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -69.12 -38.75 79.04 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.864 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 45.7 mtp180 -72.8 -32.35 65.49 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.179 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -76.51 -36.11 57.96 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.734 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 65.0 mt-30 -75.6 -37.18 60.03 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.654 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -67.58 -37.33 82.46 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.719 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 39.0 m -77.33 -50.28 13.14 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.494 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 68.03 48.05 56.13 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.923 -0.871 . . . . 0.0 110.923 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -98.01 -61.55 1.37 Allowed 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.427 0.156 . . . . 0.0 110.68 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 8.7 tpt -105.1 103.89 13.52 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.509 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 97.2 p -162.68 155.83 16.95 Favored Pre-proline 0 CA--C 1.535 0.37 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.58 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -75.43 -36.03 2.53 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 122.298 1.999 . . . . 0.0 112.051 179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 12.1 mmt -138.72 -62.93 0.55 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.483 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 100.12 -35.94 4.45 Favored Glycine 0 CA--C 1.527 0.788 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 40.8 p -124.75 155.18 39.75 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.575 0.226 . . . . 0.0 110.551 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -89.38 117.66 28.48 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.504 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 45.4 m -88.69 176.1 7.24 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.559 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 87.68 77.68 1.27 Allowed Glycine 0 CA--C 1.526 0.749 0 N-CA-C 111.11 -0.796 . . . . 0.0 111.11 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.3 m -145.22 33.67 1.09 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 120.815 0.34 . . . . 0.0 110.815 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -76.28 152.94 36.33 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.674 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 39.9 t -136.72 149.01 65.73 Favored Pre-proline 0 CA--C 1.536 0.428 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.475 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -56.62 145.09 83.28 Favored 'Trans proline' 0 N--CA 1.501 1.957 0 C-N-CA 122.247 1.965 . . . . 0.0 112.414 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 3.5 m . . . . . 0 C--O 1.22 -0.481 0 CA-C-O 118.049 -0.977 . . . . 0.0 110.629 179.964 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.271 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.8 m -136.84 140.83 42.71 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 38.9 mtt -148.35 179.81 7.51 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.713 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -91.78 -39.41 11.8 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.796 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -99.21 30.27 3.55 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.169 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -77.45 113.98 15.81 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.519 179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.1 t -85.73 162.92 18.52 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.455 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -129.99 34.46 4.25 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.821 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -101.5 172.48 6.94 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.665 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 4.5 t -160.62 143.87 9.94 Favored Pre-proline 0 CA--C 1.54 0.575 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.443 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -75.59 167.0 27.39 Favored 'Trans proline' 0 N--CA 1.493 1.495 0 C-N-CA 122.139 1.893 . . . . 0.0 112.176 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 133.6 -62.59 0.63 Allowed Glycine 0 CA--C 1.536 1.39 0 N-CA-C 110.622 -0.991 . . . . 0.0 110.622 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -69.89 73.82 1.4 Allowed 'Trans proline' 0 N--CA 1.5 1.868 0 C-N-CA 122.419 2.079 . . . . 0.0 112.899 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 3.6 mmt -71.54 83.77 0.84 Allowed 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.346 179.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.96 144.99 40.68 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.5 t -46.3 134.03 9.11 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -178.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.9 m -67.92 -24.56 65.21 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 114.869 -1.06 . . . . 0.0 112.153 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 76.9 p -81.53 -16.91 50.33 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -179.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.21 34.41 14.61 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 121.007 -0.616 . . . . 0.0 112.19 178.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 27.2 p -77.74 -18.54 56.41 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.841 178.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 91.62 9.8 62.47 Favored Glycine 0 CA--C 1.534 1.248 0 CA-C-O 119.982 -0.343 . . . . 0.0 112.759 179.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -105.8 -171.05 1.83 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 117.485 0.643 . . . . 0.0 110.602 -179.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -97.46 143.57 28.05 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.66 0.267 . . . . 0.0 111.106 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -113.36 170.85 13.54 Favored Glycine 0 CA--C 1.528 0.856 0 N-CA-C 110.297 -1.121 . . . . 0.0 110.297 179.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -122.82 140.57 33.49 Favored Pre-proline 0 CA--C 1.538 0.513 0 CA-C-O 119.467 -0.301 . . . . 0.0 110.561 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -75.63 -17.36 18.27 Favored 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 121.835 1.69 . . . . 0.0 112.677 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.1 mmt180 -78.26 -34.24 49.19 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 40.7 p -77.63 -151.31 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 178.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -88.94 29.36 1.05 Allowed 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 118.534 0.607 . . . . 0.0 111.2 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 74.39 15.39 80.3 Favored Glycine 0 CA--C 1.535 1.301 0 N-CA-C 111.993 -0.443 . . . . 0.0 111.993 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 10.9 mtt -129.04 176.57 7.78 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 117.416 0.608 . . . . 0.0 109.979 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 14.6 p -77.37 -169.31 1.37 Allowed 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.306 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -74.85 -47.21 31.5 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -177.62 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 20.2 t -68.27 -52.49 37.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 120.999 -0.281 . . . . 0.0 111.3 -178.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 79.2 m -60.73 -36.99 80.24 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.146 -179.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.428 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 29.2 t80 -57.82 -33.21 68.37 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.517 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.4 mtpt -77.02 -45.86 25.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.804 0.335 . . . . 0.0 110.101 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -58.68 -41.3 85.88 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.428 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.3 p-80 -82.11 -36.13 27.85 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 120.21 -0.596 . . . . 0.0 111.697 -178.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.9 tp -62.02 -28.81 69.85 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.576 0.227 . . . . 0.0 110.877 179.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -61.82 -38.69 89.09 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.643 179.314 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 60.2 mtt180 -77.11 -29.45 54.79 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.55 178.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -73.84 -36.22 64.88 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.689 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -72.77 -22.98 60.76 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -51.57 -42.15 61.67 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.8 p -89.76 -51.71 5.36 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.75 -0.205 . . . . 0.0 110.882 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.23 -54.32 2.84 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 111.042 -0.823 . . . . 0.0 111.042 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.5 ttt85 -129.69 97.69 4.59 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.565 0.221 . . . . 0.0 110.555 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 11.2 ttt -120.43 -62.75 1.43 Allowed 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.235 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 10.6 m -100.72 160.04 27.93 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.787 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -54.15 126.49 22.29 Favored 'Trans proline' 0 N--CA 1.501 1.948 0 C-N-CA 122.547 2.165 . . . . 0.0 112.663 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 15.0 ttt -103.31 -41.43 6.04 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.709 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 100.01 -51.83 1.03 Allowed Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.716 -0.954 . . . . 0.0 110.716 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.1 m -90.81 142.54 27.66 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 110.446 -0.205 . . . . 0.0 110.446 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -133.38 -51.03 0.87 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.499 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.8 t -85.87 -37.74 18.83 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.676 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 100.82 39.69 3.08 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.966 -0.854 . . . . 0.0 110.966 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.6 m -84.76 -58.89 2.53 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.514 0.197 . . . . 0.0 110.709 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -91.11 135.25 33.89 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.681 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.6 t -154.06 88.07 3.55 Favored Pre-proline 0 CA--C 1.538 0.492 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.536 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_exo -58.24 150.91 63.4 Favored 'Trans proline' 0 N--CA 1.5 1.868 0 C-N-CA 122.351 2.034 . . . . 0.0 112.18 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 30.9 p . . . . . 0 C--O 1.219 -0.53 0 CA-C-O 118.047 -0.978 . . . . 0.0 110.521 179.9 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.427 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.3 m -82.77 119.82 24.83 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.622 0.249 . . . . 0.0 110.57 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 17.5 ptm -150.94 33.49 0.6 Allowed 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.869 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -102.88 31.59 4.11 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.031 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -101.72 -46.89 4.79 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.555 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -109.93 127.87 55.02 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.736 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.7 t -114.19 159.15 20.43 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.428 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 34.1 m120 -101.09 33.56 2.81 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.684 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -89.88 112.19 23.47 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.815 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 16.4 p -87.57 146.87 40.35 Favored Pre-proline 0 CA--C 1.535 0.383 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.159 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -76.48 142.5 23.6 Favored 'Trans proline' 0 N--CA 1.495 1.607 0 C-N-CA 122.206 1.937 . . . . 0.0 111.829 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 175.9 -62.32 0.1 Allowed Glycine 0 CA--C 1.535 1.319 0 N-CA-C 111.43 -0.668 . . . . 0.0 111.43 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -84.18 70.39 5.98 Favored 'Trans proline' 0 N--CA 1.49 1.307 0 C-N-CA 122.43 2.087 . . . . 0.0 112.286 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 19.1 mtt -70.01 96.84 1.08 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.42 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.77 140.97 46.27 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.255 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.2 t -39.67 137.06 0.92 Allowed 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -178.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 57.8 m -61.65 -25.41 67.36 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.197 -179.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 68.1 p -90.76 -5.58 55.49 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -178.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.35 41.38 85.69 Favored Glycine 0 C--N 1.341 0.841 0 N-CA-C 111.482 -0.647 . . . . 0.0 111.482 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 15.2 p -86.58 -13.23 46.37 Favored 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.2 -7.48 54.51 Favored Glycine 0 CA--C 1.542 1.765 0 CA-C-O 119.746 -0.474 . . . . 0.0 113.539 178.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 -91.41 178.91 5.82 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 117.627 0.714 . . . . 0.0 110.895 -178.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -89.71 135.62 33.51 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.336 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -100.78 140.18 14.76 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 111.069 -0.813 . . . . 0.0 111.069 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -99.89 135.47 20.45 Favored Pre-proline 0 CA--C 1.538 0.491 0 CA-C-O 119.446 -0.312 . . . . 0.0 110.253 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -74.79 -21.78 16.0 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 121.791 1.66 . . . . 0.0 112.863 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -75.3 -31.75 60.77 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 178.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 54.0 p -79.59 -153.27 0.08 Allowed 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 178.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -91.45 27.34 2.0 Allowed 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 118.331 0.514 . . . . 0.0 111.046 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.35 17.25 76.57 Favored Glycine 0 CA--C 1.539 1.593 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -178.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 28.5 mtt -120.58 160.5 23.1 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-O 121.097 0.475 . . . . 0.0 111.571 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 22.4 p -73.88 -161.62 0.12 Allowed 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.888 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.42 -43.21 51.09 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.6 t -69.97 -45.89 75.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.9 m -73.53 -36.22 65.66 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -177.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -63.38 -37.3 86.72 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -178.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.76 -43.0 48.78 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.28 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 62.2 mm-40 -62.79 -47.76 82.09 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.541 179.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -58.49 -46.25 87.06 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.986 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.1 mp -60.96 -26.65 67.69 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.881 -179.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -55.24 -36.26 65.84 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-O 120.752 0.31 . . . . 0.0 111.354 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 11.1 mtm105 -83.87 -29.08 27.51 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.083 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -66.06 -40.53 90.98 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.767 -0.197 . . . . 0.0 110.988 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -66.68 -39.03 87.97 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.852 -178.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -75.34 -45.43 39.53 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 121.029 -0.268 . . . . 0.0 110.82 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 44.4 t -70.85 -56.46 6.23 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.615 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.29 -52.36 0.84 Allowed Glycine 0 CA--C 1.526 0.735 0 N-CA-C 110.867 -0.893 . . . . 0.0 110.867 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -139.33 95.3 2.91 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 7.3 ttt -83.26 -64.17 1.22 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.387 -179.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 66.2 m -89.75 155.32 48.01 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.993 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -74.18 179.73 5.51 Favored 'Trans proline' 0 N--CA 1.494 1.546 0 C-N-CA 122.248 1.965 . . . . 0.0 111.737 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.04 172.6 12.46 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.74 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 145.43 -50.11 0.64 Allowed Glycine 0 CA--C 1.527 0.791 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 43.4 p -145.41 114.71 7.1 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.508 0.194 . . . . 0.0 110.661 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -114.53 84.54 2.08 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.411 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 77.3 p -152.26 -50.29 0.11 Allowed 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.498 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.3 59.75 1.35 Allowed Glycine 0 CA--C 1.527 0.803 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 66.2 m -83.29 -61.18 1.92 Allowed 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.536 0.208 . . . . 0.0 110.721 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 26.2 m120 -80.42 113.77 18.84 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.777 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.8 t -79.16 148.46 71.29 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.468 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -79.81 155.41 23.65 Favored 'Trans proline' 0 N--CA 1.492 1.416 0 C-N-CA 122.319 2.013 . . . . 0.0 112.129 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 16.7 p . . . . . 0 C--O 1.219 -0.55 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.62 -179.88 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.268 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.2 m -87.02 -57.93 2.78 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 8.7 ptp -98.34 159.65 14.8 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.313 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -101.75 36.31 2.1 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 120.985 0.421 . . . . 0.0 110.654 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -109.39 -38.33 5.51 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.661 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -76.85 137.36 39.13 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.475 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.5 p -82.39 176.19 9.63 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.843 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -76.4 -52.58 9.6 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.388 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -82.99 105.84 14.32 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.558 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 6.2 m -156.08 136.81 9.03 Favored Pre-proline 0 CA--C 1.537 0.465 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.963 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -73.14 123.97 9.2 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 121.866 1.711 . . . . 0.0 111.538 179.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 167.68 -55.82 0.22 Allowed Glycine 0 CA--C 1.536 1.351 0 N-CA-C 111.202 -0.759 . . . . 0.0 111.202 -179.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -72.02 67.05 3.31 Favored 'Trans proline' 0 N--CA 1.497 1.691 0 C-N-CA 122.086 1.858 . . . . 0.0 111.76 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 13.4 mtt -72.02 83.54 0.97 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.394 -179.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.3 mt -74.49 148.7 40.77 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.509 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 10.0 t -44.82 132.95 6.4 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -178.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m -61.61 -29.07 69.8 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.796 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 71.2 p -78.89 -9.75 59.59 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 71.94 33.23 62.86 Favored Glycine 0 C--N 1.342 0.888 0 N-CA-C 111.26 -0.736 . . . . 0.0 111.26 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.5 p -71.83 -19.14 62.02 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.37 4.28 53.19 Favored Glycine 0 CA--C 1.539 1.557 0 CA-C-O 119.569 -0.573 . . . . 0.0 113.481 178.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -115.53 164.09 14.81 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 117.944 0.872 . . . . 0.0 111.038 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -69.21 146.55 52.29 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.571 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -109.68 166.89 12.63 Favored Glycine 0 CA--C 1.527 0.794 0 N-CA-C 110.216 -1.153 . . . . 0.0 110.216 178.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -114.93 135.96 22.51 Favored Pre-proline 0 N--CA 1.467 0.416 0 N-CA-C 109.948 -0.389 . . . . 0.0 109.948 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -74.82 -23.46 14.19 Favored 'Trans proline' 0 N--CA 1.495 1.58 0 C-N-CA 122.022 1.814 . . . . 0.0 112.928 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -75.67 -36.81 60.0 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.2 p -70.87 -154.93 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -89.76 29.21 1.2 Allowed 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.681 0.673 . . . . 0.0 111.031 179.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.44 16.27 78.33 Favored Glycine 0 CA--C 1.534 1.24 0 CA-C-O 119.872 -0.404 . . . . 0.0 112.465 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 9.4 mtt -131.2 176.56 8.17 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 117.616 0.708 . . . . 0.0 111.213 -178.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 18.9 p -77.22 -167.15 0.84 Allowed 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.677 -179.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.51 -48.83 30.11 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -177.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.1 t -65.68 -57.74 9.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -177.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 73.2 m -57.51 -35.38 70.18 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 111.641 0.237 . . . . 0.0 111.641 -178.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.439 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 41.1 t80 -57.42 -41.45 80.42 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.216 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -74.29 -45.09 49.8 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -56.69 -39.76 74.37 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -179.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.439 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.6 p-80 -84.46 -33.24 23.68 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 120.006 -0.677 . . . . 0.0 111.675 -179.131 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 15.7 tp -62.33 -30.39 71.13 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.254 179.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -65.11 -39.47 93.16 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.662 0.268 . . . . 0.0 111.0 -179.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 61.9 mtm180 -76.11 -30.53 58.29 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.344 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.74 -38.21 54.61 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.792 -179.683 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -75.26 -31.78 60.88 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 123.231 0.332 . . . . 0.0 110.776 179.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -55.65 -29.38 59.16 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 111.738 0.274 . . . . 0.0 111.738 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 20.2 m -60.47 -64.25 1.02 Allowed 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.358 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 67.87 62.33 4.34 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 110.989 -0.844 . . . . 0.0 110.989 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 72.7 mtt180 -72.27 154.67 40.86 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 10.0 mtt -112.16 96.77 6.22 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.716 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -161.29 159.0 23.95 Favored Pre-proline 0 CA--C 1.537 0.453 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.186 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -57.1 -171.83 0.04 OUTLIER 'Trans proline' 0 N--CA 1.502 1.992 0 C-N-CA 122.338 2.025 . . . . 0.0 112.09 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 14.3 ptp -111.2 150.66 29.23 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.497 179.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 78.1 36.45 31.5 Favored Glycine 0 CA--C 1.527 0.81 0 N-CA-C 111.085 -0.806 . . . . 0.0 111.085 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.3 m -101.57 131.45 47.74 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.554 0.216 . . . . 0.0 110.576 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -80.97 88.46 5.92 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.718 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.3 t -152.72 -177.53 6.31 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.341 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.03 80.19 1.42 Allowed Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.5 t -144.91 33.51 1.12 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 120.743 0.306 . . . . 0.0 110.877 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -100.37 146.97 26.34 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.665 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 87.4 p -149.09 153.63 38.32 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.504 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -77.18 142.8 21.93 Favored 'Trans proline' 0 N--CA 1.495 1.581 0 C-N-CA 122.407 2.071 . . . . 0.0 111.99 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 72.9 p . . . . . 0 C--O 1.22 -0.485 0 CA-C-O 118.041 -0.98 . . . . 0.0 110.59 -179.894 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.178 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.0 p -94.96 -50.26 5.19 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.521 0.201 . . . . 0.0 110.52 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.31 87.58 1.82 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.725 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -93.12 -38.32 11.66 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.621 179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -85.56 -52.72 5.64 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.717 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -80.69 94.85 6.43 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.038 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.7 p -104.98 137.7 42.33 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.147 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -89.55 -66.13 0.95 Allowed 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.624 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -91.26 149.86 21.58 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.282 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 3.9 t -166.8 101.06 0.66 Allowed Pre-proline 0 CA--C 1.538 0.509 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.505 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -74.28 164.62 33.73 Favored 'Trans proline' 0 N--CA 1.492 1.429 0 C-N-CA 121.943 1.762 . . . . 0.0 111.611 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 155.74 -52.61 0.43 Allowed Glycine 0 CA--C 1.535 1.304 0 N-CA-C 111.249 -0.74 . . . . 0.0 111.249 -179.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -76.48 81.47 2.5 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 122.011 1.807 . . . . 0.0 112.236 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 18.7 mmt -71.78 93.85 1.34 Allowed 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.954 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -79.83 139.65 37.12 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.0 t -42.22 121.5 1.9 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 -178.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.1 m -55.94 -22.58 26.99 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.318 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 60.9 p -81.18 -9.64 59.76 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 179.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 74.49 40.24 39.84 Favored Glycine 0 C--N 1.344 1.023 0 C-N-CA 121.457 -0.401 . . . . 0.0 112.357 179.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 24.2 p -86.62 -9.16 56.65 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 117.012 0.406 . . . . 0.0 112.066 179.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.21 -2.74 85.44 Favored Glycine 0 CA--C 1.537 1.441 0 CA-C-O 119.777 -0.457 . . . . 0.0 113.394 178.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 67.2 m-85 -100.79 171.95 7.36 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 117.788 0.794 . . . . 0.0 110.533 -179.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -80.31 139.06 36.78 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.568 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -111.78 155.24 16.3 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 109.874 -1.291 . . . . 0.0 109.874 178.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -101.38 137.46 19.65 Favored Pre-proline 0 CA--C 1.537 0.47 0 CA-C-O 119.499 -0.286 . . . . 0.0 110.822 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -73.13 -27.28 14.01 Favored 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 121.848 1.699 . . . . 0.0 112.294 179.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.4 mmt180 -74.08 -26.9 60.63 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 123.041 0.213 . . . . 0.0 110.526 178.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 68.8 p -82.11 -150.49 0.09 Allowed 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 178.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 54.1 m-20 -91.21 28.3 1.67 Allowed 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 118.375 0.534 . . . . 0.0 110.891 178.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 76.01 17.51 80.0 Favored Glycine 0 CA--C 1.537 1.444 0 N-CA-C 111.702 -0.559 . . . . 0.0 111.702 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 48.6 mtt -123.16 170.34 10.33 Favored 'General case' 0 C--N 1.347 0.491 0 CA-C-N 117.291 0.546 . . . . 0.0 111.419 -179.538 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 31.2 p -77.62 -167.79 1.04 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.639 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.24 -44.41 59.54 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.672 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 18.1 t -62.78 -51.22 74.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -178.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 68.5 m -70.62 -34.55 72.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.944 -178.351 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -64.83 -32.92 74.84 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -77.87 -43.05 31.39 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.906 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -63.64 -45.21 91.24 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 120.869 0.366 . . . . 0.0 110.106 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 39.6 t60 -59.94 -44.86 94.12 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.701 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -65.33 -29.33 70.05 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.634 -178.798 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -71.99 -31.48 66.28 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 120.934 -0.307 . . . . 0.0 110.315 179.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 39.2 ttt-85 -75.21 -31.44 60.89 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.172 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -73.02 -25.53 60.99 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.235 179.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.2 mm-40 -79.43 -22.04 44.76 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -64.24 -36.27 83.55 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -178.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.0 p -73.56 -62.65 1.41 Allowed 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 58.88 57.36 20.29 Favored Glycine 0 CA--C 1.53 1.01 0 CA-C-N 116.19 -0.459 . . . . 0.0 112.684 178.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 2.5 mpp_? -82.63 171.36 14.12 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 179.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 31.2 mtt -109.09 40.27 1.86 Allowed 'General case' 0 C--O 1.236 0.363 0 CA-C-O 120.861 0.362 . . . . 0.0 110.983 -179.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 38.8 m -98.61 155.15 37.08 Favored Pre-proline 0 CA--C 1.533 0.309 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.327 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -82.16 176.67 7.92 Favored 'Trans proline' 0 N--CA 1.489 1.207 0 C-N-CA 122.357 2.038 . . . . 0.0 111.834 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.73 177.82 6.63 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.472 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 84.67 35.96 12.68 Favored Glycine 0 CA--C 1.527 0.787 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.0 m -117.82 109.5 16.65 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 110.396 -0.224 . . . . 0.0 110.396 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -95.82 -43.34 7.9 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.592 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.0 m -77.25 156.82 31.17 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.393 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 85.19 58.46 2.08 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.1 m -152.64 -61.27 0.15 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.504 0.192 . . . . 0.0 110.513 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 13.3 p-10 -86.71 131.68 34.07 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.692 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 44.9 t -160.9 86.2 1.79 Allowed Pre-proline 0 CA--C 1.538 0.513 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.551 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -59.47 161.3 17.64 Favored 'Trans proline' 0 N--CA 1.498 1.789 0 C-N-CA 122.274 1.982 . . . . 0.0 112.026 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 6.5 t . . . . . 0 C--O 1.221 -0.433 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.601 179.973 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.367 0 N-CA-C 109.661 -1.375 . . . . 0.0 109.661 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.0 t -114.36 122.69 47.43 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.438 0.161 . . . . 0.0 110.588 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 64.8 mtt -89.67 -179.99 5.89 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.628 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -138.19 34.32 2.33 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.933 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -119.11 35.49 4.8 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.557 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -74.61 148.96 40.28 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.871 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.4 t -77.93 150.98 33.94 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.746 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -130.49 35.08 4.08 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.612 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -72.14 121.8 19.91 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.864 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 3.2 p -149.82 161.73 30.45 Favored Pre-proline 0 CA--C 1.536 0.439 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.926 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -56.74 103.93 0.13 Allowed 'Trans proline' 0 N--CA 1.5 1.87 0 C-N-CA 122.079 1.852 . . . . 0.0 112.073 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -159.83 45.79 0.42 Allowed Glycine 0 CA--C 1.542 1.756 0 CA-C-O 119.199 -0.778 . . . . 0.0 111.982 -179.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -67.68 71.99 0.69 Allowed 'Trans proline' 0 N--CA 1.503 2.043 0 C-N-CA 122.193 1.929 . . . . 0.0 112.361 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 14.8 mmt -72.87 97.6 2.29 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.832 -179.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mp -76.65 144.28 39.57 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.5 t -48.79 123.71 7.37 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.9 m -65.32 -30.57 71.43 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.015 -179.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 51.0 p -64.81 -23.03 67.11 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -178.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 91.05 36.93 6.47 Favored Glycine 0 CA--C 1.526 0.76 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.132 179.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.9 p -84.81 -16.44 41.4 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 117.034 0.417 . . . . 0.0 110.91 178.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.49 12.68 66.72 Favored Glycine 0 C--N 1.349 1.298 0 CA-C-O 119.747 -0.474 . . . . 0.0 113.097 178.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -114.37 176.71 4.93 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 117.633 0.717 . . . . 0.0 111.833 -179.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 8.1 t80 -81.21 140.82 34.7 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.101 -0.954 . . . . 0.0 111.025 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -124.7 -176.51 14.62 Favored Glycine 0 CA--C 1.53 1.008 0 N-CA-C 111.054 -0.819 . . . . 0.0 111.054 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -130.13 139.25 35.08 Favored Pre-proline 0 N--CA 1.47 0.536 0 CA-C-O 119.548 -0.263 . . . . 0.0 111.389 -179.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -77.07 -14.89 16.64 Favored 'Trans proline' 0 N--CA 1.49 1.273 0 C-N-CA 121.994 1.796 . . . . 0.0 112.949 178.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -77.6 -35.87 52.41 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 178.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 66.6 p -72.52 -154.77 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 177.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -90.77 26.02 2.19 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.574 0.624 . . . . 0.0 111.622 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 84.31 8.27 83.75 Favored Glycine 0 CA--C 1.538 1.484 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.8 163.31 16.35 Favored 'General case' 0 C--N 1.346 0.413 0 CA-C-N 117.146 0.473 . . . . 0.0 110.987 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 30.8 p -76.04 -157.71 0.08 Allowed 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -74.77 -48.3 26.28 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -179.061 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.2 t -69.03 -55.69 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 -178.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 77.7 m -57.19 -35.47 69.65 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -178.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.411 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 30.5 t80 -59.03 -40.44 85.04 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 111.833 0.309 . . . . 0.0 111.833 -179.127 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.6 tttm -74.37 -45.39 47.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.825 0.345 . . . . 0.0 110.347 -179.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -56.25 -38.51 71.23 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -178.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.411 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.6 p-80 -86.4 -33.4 20.49 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 120.191 -0.603 . . . . 0.0 112.155 -178.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.0 tt -65.91 -30.63 71.25 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.804 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -58.77 -40.53 84.18 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.393 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -84.79 -29.56 25.33 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.894 179.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -69.83 -44.19 70.47 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.96 0.409 . . . . 0.0 110.089 179.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -67.63 -26.83 66.42 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.973 -179.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -63.17 -47.51 82.31 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 120.495 0.188 . . . . 0.0 111.32 -179.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 12.3 p -100.77 -64.79 1.01 Allowed 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 179.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 79.06 34.81 32.37 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 111.488 -0.645 . . . . 0.0 111.488 179.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 -104.41 160.65 14.74 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 109.948 -0.389 . . . . 0.0 109.948 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 38.9 mtt -101.89 -36.2 8.73 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.558 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.6 p -133.01 157.62 77.9 Favored Pre-proline 0 CA--C 1.535 0.398 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.685 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -73.21 114.4 4.03 Favored 'Trans proline' 0 N--CA 1.494 1.554 0 C-N-CA 122.43 2.086 . . . . 0.0 112.289 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -85.78 -40.66 15.81 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.419 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 95.18 35.82 5.64 Favored Glycine 0 CA--C 1.527 0.836 0 N-CA-C 111.314 -0.714 . . . . 0.0 111.314 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.2 m -107.08 147.7 29.68 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.47 -177.82 2.35 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.485 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 5.4 m -69.33 -42.04 75.86 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.365 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 106.78 80.05 1.28 Allowed Glycine 0 CA--C 1.526 0.753 0 N-CA-C 111.11 -0.796 . . . . 0.0 111.11 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 35.2 p -124.54 33.73 5.18 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.828 0.347 . . . . 0.0 110.768 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -92.41 131.77 37.31 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.754 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 13.1 m -91.6 158.18 40.82 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.687 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_endo -79.38 138.04 13.65 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 122.311 2.007 . . . . 0.0 112.066 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 5.2 t . . . . . 0 C--O 1.219 -0.526 0 CA-C-O 118.059 -0.972 . . . . 0.0 110.51 -179.875 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.377 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.6 m -137.78 135.17 36.06 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.526 0.203 . . . . 0.0 110.68 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 56.3 mtm -143.47 123.55 13.65 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.622 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -126.46 33.28 5.03 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.791 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.0 tp60 -80.6 -60.11 2.44 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.408 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -103.75 111.03 23.36 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.413 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.4 m -86.77 119.34 26.89 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.449 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -90.81 -54.07 4.13 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.764 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -89.72 152.43 21.34 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.612 179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.3 p -92.48 158.32 38.77 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.953 -179.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -76.11 159.58 37.2 Favored 'Trans proline' 0 N--CA 1.497 1.682 0 C-N-CA 122.406 2.071 . . . . 0.0 112.567 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.419 ' N ' ' CD ' ' A' ' 13' ' ' PRO . . . 67.06 44.01 89.13 Favored Glycine 0 CA--C 1.542 1.764 0 CA-C-O 119.125 -0.819 . . . . 0.0 112.71 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 12' ' ' GLY . 51.1 Cg_endo -71.41 -83.99 0.01 OUTLIER 'Trans proline' 0 N--CA 1.498 1.781 0 CA-C-N 119.802 1.801 . . . . 0.0 113.956 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 1.5 mtt -71.44 78.42 0.77 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.068 0.461 . . . . 0.0 112.173 -178.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -71.27 148.36 47.24 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.139 179.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 11.2 t -41.34 140.66 0.82 Allowed 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -179.035 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 68.7 m -63.81 -29.19 70.42 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.824 -179.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.5 p -88.17 -5.19 58.55 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -179.174 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 71.03 38.71 63.81 Favored Glycine 0 C--N 1.343 0.972 0 CA-C-O 119.931 -0.372 . . . . 0.0 113.099 178.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 32.0 p -78.68 -17.78 55.41 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 117.179 0.489 . . . . 0.0 111.887 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 105.03 1.26 41.9 Favored Glycine 0 CA--C 1.54 1.621 0 CA-C-O 119.711 -0.494 . . . . 0.0 113.243 179.291 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 67.1 m-85 -109.01 156.74 19.39 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 117.767 0.783 . . . . 0.0 110.685 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 26.4 t80 -65.25 146.17 55.29 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.289 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -109.04 163.43 12.59 Favored Glycine 0 CA--C 1.529 0.932 0 N-CA-C 110.257 -1.137 . . . . 0.0 110.257 179.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -113.21 136.22 21.8 Favored Pre-proline 0 CA--C 1.541 0.608 0 CA-C-O 119.276 -0.392 . . . . 0.0 110.098 -179.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -76.59 -22.73 11.88 Favored 'Trans proline' 0 N--CA 1.494 1.525 0 C-N-CA 122.052 1.835 . . . . 0.0 112.313 179.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 61.7 mtp180 -74.53 -33.57 62.8 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 178.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.8 p -82.12 -155.42 0.14 Allowed 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 178.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -89.56 24.94 2.12 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 118.623 0.647 . . . . 0.0 111.825 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.42 17.75 75.31 Favored Glycine 0 CA--C 1.54 1.604 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 -179.187 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 16.9 mtt -120.33 155.38 33.46 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-N 117.152 0.476 . . . . 0.0 110.772 -179.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 29.3 p -66.38 -162.72 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.105 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -74.12 -48.36 30.0 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -178.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 17.5 t -62.61 -56.63 16.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 116.301 -0.409 . . . . 0.0 112.053 -178.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.6 m -60.39 -33.49 72.56 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -178.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 30.2 t80 -65.25 -34.87 79.38 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -178.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 39.3 tttt -77.26 -47.86 19.02 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.159 -179.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -66.1 -42.98 88.52 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.421 -179.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -59.39 -49.27 78.44 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.877 -178.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.76 -29.27 70.5 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 -178.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -57.96 -40.65 81.09 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.47 0.176 . . . . 0.0 111.195 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.6 ptp180 -82.17 -30.84 30.77 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.952 179.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -70.69 -52.44 21.07 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.475 -179.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -58.15 -34.28 70.11 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.662 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -65.63 -55.98 14.65 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.993 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.2 m -124.66 -64.68 1.09 Allowed 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.518 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 73.32 33.53 58.78 Favored Glycine 0 CA--C 1.528 0.886 0 N-CA-C 111.243 -0.743 . . . . 0.0 111.243 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -132.81 -65.01 0.73 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.483 0.182 . . . . 0.0 110.764 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 39.7 mtm -120.93 -60.09 1.68 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.836 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.7 p -156.6 159.49 31.33 Favored Pre-proline 0 CA--C 1.537 0.454 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.934 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -76.24 -49.16 0.13 Allowed 'Trans proline' 0 N--CA 1.495 1.569 0 C-N-CA 122.452 2.101 . . . . 0.0 112.518 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -93.41 -44.32 8.33 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.757 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 99.77 -59.98 0.76 Allowed Glycine 0 CA--C 1.527 0.783 0 N-CA-C 111.03 -0.828 . . . . 0.0 111.03 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 21.0 p -92.46 173.92 7.55 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.486 0.184 . . . . 0.0 110.584 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -76.67 127.93 33.72 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.547 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 21.4 m -150.8 178.9 8.68 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.618 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.87 51.51 1.37 Allowed Glycine 0 CA--C 1.526 0.723 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 77.4 p -148.81 34.67 0.76 Allowed 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.995 0.426 . . . . 0.0 110.828 179.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -106.19 130.75 54.01 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.611 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 22.7 t -86.08 149.13 49.49 Favored Pre-proline 0 CA--C 1.536 0.435 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.403 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -55.08 132.62 53.4 Favored 'Trans proline' 0 N--CA 1.502 1.985 0 C-N-CA 122.364 2.043 . . . . 0.0 112.573 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 4.9 m . . . . . 0 N--CA 1.471 0.589 0 CA-C-O 117.966 -1.016 . . . . 0.0 111.188 179.909 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.247 0 N-CA-C 109.641 -1.383 . . . . 0.0 109.641 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.6 t -84.41 116.59 23.14 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.542 0.211 . . . . 0.0 110.583 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 10.3 ptp -142.34 32.85 1.5 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.083 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -77.76 -50.67 11.9 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.571 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -73.07 -45.32 58.03 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.542 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -85.72 111.44 20.12 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.533 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.5 m -140.75 155.38 46.45 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.648 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -91.7 -39.96 11.53 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.909 -179.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -79.16 176.33 9.76 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.027 -179.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 13.5 m -153.94 106.29 2.48 Favored Pre-proline 0 CA--C 1.541 0.596 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.395 -179.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -87.39 130.6 2.86 Favored 'Trans proline' 0 N--CA 1.492 1.386 0 C-N-CA 122.408 2.072 . . . . 0.0 112.528 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.411 ' N ' ' CD ' ' A' ' 13' ' ' PRO . . . 65.21 43.87 94.72 Favored Glycine 0 CA--C 1.543 1.803 0 CA-C-O 119.111 -0.827 . . . . 0.0 112.856 179.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.411 ' CD ' ' N ' ' A' ' 12' ' ' GLY . 56.1 Cg_endo -71.88 87.07 0.86 Allowed 'Trans proline' 0 N--CA 1.498 1.779 0 C-N-CA 121.992 1.795 . . . . 0.0 112.373 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.04 78.51 0.93 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.427 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.19 145.21 33.78 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.7 t -51.29 124.26 11.38 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -178.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.8 m -64.6 -22.03 66.87 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.525 -0.761 . . . . 0.0 112.11 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 58.0 p -76.7 -19.54 57.59 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.65 43.19 6.56 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 121.168 -0.539 . . . . 0.0 112.081 179.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.9 p -88.37 -22.6 23.71 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 116.958 0.379 . . . . 0.0 111.706 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 98.65 6.94 56.13 Favored Glycine 0 CA--C 1.539 1.531 0 CA-C-O 119.707 -0.496 . . . . 0.0 113.6 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -108.36 -170.34 1.66 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 117.819 0.809 . . . . 0.0 111.13 -179.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -96.7 141.21 30.2 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.201 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -111.08 172.59 15.22 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 111.049 -0.821 . . . . 0.0 111.049 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -124.92 138.11 30.85 Favored Pre-proline 0 CA--C 1.54 0.571 0 CA-C-O 119.501 -0.285 . . . . 0.0 110.821 -179.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -75.79 -19.16 16.49 Favored 'Trans proline' 0 N--CA 1.498 1.748 0 C-N-CA 122.269 1.979 . . . . 0.0 112.488 178.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.0 mtt180 -75.96 -34.95 59.83 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 70.1 p -77.77 -154.41 0.07 Allowed 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -90.57 27.62 1.69 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.364 0.529 . . . . 0.0 111.718 179.825 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.26 10.88 85.59 Favored Glycine 0 CA--C 1.535 1.288 0 N-CA-C 111.6 -0.6 . . . . 0.0 111.6 -179.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.07 169.81 9.6 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 117.332 0.566 . . . . 0.0 111.097 -178.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 22.0 p -78.89 -162.03 0.35 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.124 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.76 -45.92 40.65 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -178.684 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.7 t -69.35 -56.82 10.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -178.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 72.3 m -56.77 -35.43 68.65 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.424 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 31.7 t80 -57.94 -37.91 74.98 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.778 -0.192 . . . . 0.0 111.166 -179.444 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.6 tttt -77.65 -45.48 24.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.897 0.379 . . . . 0.0 110.129 179.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -57.2 -40.86 78.26 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.878 0.695 . . . . 0.0 112.878 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.424 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.1 p-80 -82.14 -33.85 29.41 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 120.102 -0.639 . . . . 0.0 111.398 -179.085 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.5 tp -64.28 -29.27 70.37 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.582 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -61.94 -40.95 97.3 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.605 0.24 . . . . 0.0 111.289 -179.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 36.9 ttt85 -84.13 -31.38 25.26 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.495 -179.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 -73.1 -48.18 37.93 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.575 0.226 . . . . 0.0 111.061 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -63.82 -21.89 66.65 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 116.286 -0.416 . . . . 0.0 112.083 -179.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -57.42 -31.63 66.07 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 2.7 t -59.85 -66.85 0.45 Allowed 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 66.25 63.04 4.2 Favored Glycine 0 CA--C 1.528 0.878 0 N-CA-C 111.027 -0.829 . . . . 0.0 111.027 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.2 ptt180 -94.67 64.75 3.02 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.22 0.533 . . . . 0.0 110.768 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 5.4 tpt -87.22 -61.58 1.69 Allowed 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.044 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.2 t -91.8 153.76 43.73 Favored Pre-proline 0 CA--C 1.534 0.355 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.83 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -57.43 -41.93 67.04 Favored 'Trans proline' 0 N--CA 1.501 1.924 0 C-N-CA 122.16 1.906 . . . . 0.0 112.135 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 56.1 mtt -73.22 -62.72 1.37 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.351 179.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 135.3 -41.74 1.41 Allowed Glycine 0 CA--C 1.527 0.805 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 179.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 37.2 p -128.93 126.08 38.91 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 110.474 -0.195 . . . . 0.0 110.474 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -91.27 173.32 7.98 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.55 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.6 m -148.45 177.08 9.76 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.611 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 74.49 68.55 1.54 Allowed Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.006 -0.838 . . . . 0.0 111.006 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 28.4 p -149.88 32.69 0.68 Allowed 'General case' 0 C--O 1.236 0.352 0 CA-C-O 120.772 0.32 . . . . 0.0 110.906 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -97.24 127.41 43.18 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.564 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.4 m -155.32 158.25 31.91 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.537 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -74.91 153.29 42.12 Favored 'Trans proline' 0 N--CA 1.495 1.596 0 C-N-CA 122.317 2.012 . . . . 0.0 111.933 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 32.4 p . . . . . 0 C--O 1.219 -0.518 0 CA-C-O 118.018 -0.992 . . . . 0.0 110.513 -179.984 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.34 0 N-CA-C 109.589 -1.404 . . . . 0.0 109.589 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.7 m -88.53 137.73 32.06 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.552 0.215 . . . . 0.0 110.608 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 33.0 ttp -101.41 35.33 2.3 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.248 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -112.27 -33.92 6.07 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.175 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -96.88 43.28 1.07 Allowed 'General case' 0 C--O 1.238 0.466 0 CA-C-O 120.948 0.404 . . . . 0.0 111.029 -179.447 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -134.37 49.03 2.27 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.205 0.526 . . . . 0.0 110.333 179.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.0 p -144.11 168.46 19.98 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.572 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -72.42 -36.14 68.53 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.949 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -96.88 131.05 44.03 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.376 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 5.0 t -135.73 96.56 13.26 Favored Pre-proline 0 CA--C 1.541 0.632 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.657 179.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -78.66 -174.88 2.45 Favored 'Trans proline' 0 N--CA 1.498 1.753 0 C-N-CA 122.357 2.038 . . . . 0.0 112.569 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 156.94 -55.37 0.39 Allowed Glycine 0 CA--C 1.535 1.33 0 N-CA-C 111.106 -0.798 . . . . 0.0 111.106 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -84.46 100.09 0.77 Allowed 'Trans proline' 0 N--CA 1.488 1.171 0 C-N-CA 122.442 2.095 . . . . 0.0 112.195 -179.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 6.7 mmt -70.81 82.64 0.64 Allowed 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.63 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.07 146.75 41.23 Favored 'General case' 0 N--CA 1.461 0.086 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.8 t -48.96 124.59 8.95 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -178.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.5 m -62.68 -27.13 69.03 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.758 179.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 68.4 p -71.04 -20.88 62.33 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 84.8 34.09 16.65 Favored Glycine 0 C--N 1.342 0.899 0 N-CA-C 111.855 -0.498 . . . . 0.0 111.855 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.4 p -78.85 -17.12 56.17 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 179.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.53 6.34 59.76 Favored Glycine 0 CA--C 1.538 1.511 0 CA-C-O 119.678 -0.512 . . . . 0.0 113.708 178.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -116.45 167.64 10.86 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 117.936 0.868 . . . . 0.0 111.313 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -69.46 143.99 53.38 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.713 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -114.79 171.09 13.53 Favored Glycine 0 CA--C 1.531 1.041 0 N-CA-C 110.836 -0.905 . . . . 0.0 110.836 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -118.27 139.35 26.66 Favored Pre-proline 0 N--CA 1.471 0.608 0 CA-C-N 116.642 0.221 . . . . 0.0 111.265 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -78.68 -25.31 6.61 Favored 'Trans proline' 0 N--CA 1.489 1.245 0 C-N-CA 122.191 1.927 . . . . 0.0 113.195 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 33.1 mmt180 -74.15 -33.03 63.38 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 178.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 71.0 p -74.57 -155.92 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 177.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -90.01 26.07 1.95 Allowed 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 118.2 0.454 . . . . 0.0 111.446 179.641 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 81.83 10.91 83.5 Favored Glycine 0 CA--C 1.539 1.537 0 N-CA-C 111.429 -0.668 . . . . 0.0 111.429 -179.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.95 163.32 17.76 Favored 'General case' 0 C--N 1.346 0.436 0 CA-C-N 117.335 0.568 . . . . 0.0 110.538 -179.185 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 28.3 p -74.7 -158.59 0.08 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.773 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -75.36 -47.03 29.48 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 16.3 t -69.58 -51.03 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 CA-C-O 120.749 0.309 . . . . 0.0 111.311 -178.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.1 m -62.88 -37.75 88.14 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -178.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.411 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 26.1 t80 -59.22 -45.99 89.65 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -178.682 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 38.5 pttt -74.13 -44.08 55.12 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 120.479 -0.488 . . . . 0.0 110.206 -179.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -55.5 -36.51 66.75 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.411 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 0.7 OUTLIER -86.5 -33.79 20.22 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 120.161 -0.616 . . . . 0.0 112.361 -179.302 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 11.0 tp -62.51 -28.97 70.21 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 121.251 -0.18 . . . . 0.0 111.435 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -63.76 -38.74 92.25 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.407 -179.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 9.8 tpp180 -76.45 -29.35 56.92 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.701 179.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.47 -38.43 62.93 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.488 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -74.67 -42.93 57.56 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.104 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -61.46 -33.09 73.16 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.233 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.2 m -82.29 -65.82 0.96 Allowed 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.067 179.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.62 -56.19 4.15 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 111.529 -0.628 . . . . 0.0 111.529 179.326 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 56.5 mtp85 -140.02 -69.27 0.41 Allowed 'General case' 0 C--O 1.233 0.199 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 18.9 mtt -99.55 146.11 26.77 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.462 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 96.7 p -105.62 144.52 29.03 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.251 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -56.05 -63.39 0.18 Allowed 'Trans proline' 0 N--CA 1.503 2.049 0 C-N-CA 122.21 1.94 . . . . 0.0 112.558 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 11.7 ttt -101.77 -59.13 1.75 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.59 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.12 -55.63 0.59 Allowed Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.3 t -144.56 150.9 38.28 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.525 0.203 . . . . 0.0 110.521 179.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -141.47 119.48 11.99 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.629 -179.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 12.6 t -147.58 104.74 3.64 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.584 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 68.11 41.06 87.86 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.05 -0.82 . . . . 0.0 111.05 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.2 m -98.99 -62.59 1.21 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.544 0.212 . . . . 0.0 110.515 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 12.3 p-10 -96.43 125.23 40.77 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.685 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.5 t -154.18 90.77 3.2 Favored Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.602 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -82.12 155.83 17.24 Favored 'Trans proline' 0 N--CA 1.493 1.455 0 C-N-CA 122.286 1.99 . . . . 0.0 111.902 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 6.4 m . . . . . 0 C--O 1.221 -0.421 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.587 -179.945 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.308 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.0 p -91.45 136.35 33.18 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.579 0.228 . . . . 0.0 110.438 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 55.2 mtt -143.13 121.68 12.47 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.541 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -92.71 -35.13 13.64 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.908 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.5 tm0? -80.67 -39.19 27.7 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.537 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -69.9 152.74 44.16 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.351 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.3 m -67.32 101.23 0.91 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.595 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -93.91 -38.94 10.95 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.576 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -78.79 135.48 37.1 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.428 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 6.3 t -151.12 92.97 3.71 Favored Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 116.444 -0.343 . . . . 0.0 110.757 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_exo -58.7 100.68 0.12 Allowed 'Trans proline' 0 N--CA 1.501 1.945 0 C-N-CA 122.322 2.014 . . . . 0.0 112.179 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -114.82 -61.54 0.38 Allowed Glycine 0 CA--C 1.539 1.532 0 N-CA-C 111.709 -0.556 . . . . 0.0 111.709 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_exo -60.64 100.68 0.16 Allowed 'Trans proline' 0 N--CA 1.499 1.8 0 C-N-CA 122.164 1.909 . . . . 0.0 112.177 -179.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 3.7 mmt -71.86 83.27 0.92 Allowed 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.359 179.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.5 mp -74.17 146.78 43.17 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.233 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.3 t -46.6 131.53 11.22 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -179.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -61.55 -32.33 72.39 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.931 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 76.5 p -72.35 -13.98 61.62 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.242 178.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 74.59 42.4 32.87 Favored Glycine 0 C--N 1.345 1.081 0 N-CA-C 111.667 -0.573 . . . . 0.0 111.667 179.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 29.4 p -80.3 -15.87 55.93 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.914 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.3 2.72 61.88 Favored Glycine 0 CA--C 1.54 1.611 0 CA-C-O 119.971 -0.349 . . . . 0.0 113.073 179.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -102.96 -168.13 1.48 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 117.373 0.587 . . . . 0.0 109.837 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -98.9 142.01 30.95 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 110.755 -0.091 . . . . 0.0 110.755 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -108.2 164.56 12.77 Favored Glycine 0 CA--C 1.531 1.07 0 N-CA-C 111.414 -0.675 . . . . 0.0 111.414 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -119.22 122.72 29.29 Favored Pre-proline 0 CA--C 1.54 0.587 0 CA-C-O 119.195 -0.431 . . . . 0.0 111.135 -179.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -67.37 -16.35 47.68 Favored 'Trans proline' 0 N--CA 1.493 1.471 0 C-N-CA 121.775 1.65 . . . . 0.0 112.957 178.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -76.77 -35.58 57.61 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 177.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.6 p -72.08 -156.66 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 178.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -91.22 26.62 2.14 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 118.235 0.47 . . . . 0.0 112.09 179.507 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 90.15 8.74 66.3 Favored Glycine 0 CA--C 1.534 1.246 0 CA-C-O 119.793 -0.448 . . . . 0.0 112.104 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.64 165.68 18.12 Favored 'General case' 0 C--N 1.345 0.399 0 CA-C-N 117.697 0.749 . . . . 0.0 111.326 -179.097 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 24.3 p -73.22 -156.45 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.744 -178.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.3 -51.48 11.9 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -179.065 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.3 t -67.94 -56.6 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -177.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 81.8 m -58.39 -38.09 76.61 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -178.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.412 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 5.3 t80 -57.16 -39.71 75.8 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -178.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 9.6 ttpt -75.82 -45.07 37.98 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.121 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -55.11 -38.86 68.69 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -179.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.412 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 2.2 p-80 -85.31 -32.38 22.52 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 120.136 -0.626 . . . . 0.0 111.278 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 25.6 tp -61.53 -30.3 70.54 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.612 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 22.8 tt0 -56.57 -37.54 70.72 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 120.732 0.301 . . . . 0.0 111.183 -179.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 45.5 mmm-85 -79.04 -28.22 43.22 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.558 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -81.19 -32.67 33.42 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 123.051 0.219 . . . . 0.0 111.45 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -74.29 -25.49 59.61 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.66 -38.87 92.02 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.571 0.224 . . . . 0.0 110.905 -179.629 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 77.8 p -97.22 -44.65 6.84 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.0 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 68.15 43.7 79.52 Favored Glycine 0 CA--C 1.526 0.769 0 N-CA-C 110.461 -1.056 . . . . 0.0 110.461 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 26.6 mmt180 -75.69 142.1 42.58 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.835 0.35 . . . . 0.0 111.556 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -122.52 33.93 5.3 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.36 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.3 t -162.01 144.7 8.85 Favored Pre-proline 0 CA--C 1.538 0.514 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.919 -179.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -82.24 96.92 0.88 Allowed 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 122.467 2.111 . . . . 0.0 112.005 179.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 26.7 mmt -103.29 -51.7 3.18 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.604 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 74.21 36.38 50.91 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 111.327 -0.709 . . . . 0.0 111.327 179.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.7 m -96.15 118.32 32.49 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 110.385 -0.228 . . . . 0.0 110.385 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -89.95 103.47 16.13 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.538 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.7 t -145.02 102.58 3.78 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.694 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 74.65 43.54 28.96 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.241 -0.744 . . . . 0.0 111.241 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 66.1 p -85.3 -52.02 6.18 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.595 0.236 . . . . 0.0 110.394 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -86.58 110.75 20.02 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.676 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 22.8 p -85.93 158.72 55.75 Favored Pre-proline 0 CA--C 1.534 0.334 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.294 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -75.5 -178.68 4.44 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 122.248 1.965 . . . . 0.0 112.152 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 17.6 p . . . . . 0 C--O 1.221 -0.44 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.525 -179.96 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.1 m -92.46 98.47 11.49 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.611 0.243 . . . . 0.0 110.724 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 34.9 mtt -154.27 32.46 0.43 Allowed 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.752 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -111.69 35.07 3.81 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.845 0.355 . . . . 0.0 110.604 179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -131.86 37.84 3.59 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.18 0.514 . . . . 0.0 110.589 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -98.28 -53.23 3.41 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.225 179.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.3 m -90.63 140.46 29.74 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.65 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -130.74 -50.42 1.05 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.693 179.474 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -91.12 139.3 30.89 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.061 179.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.6 m -150.85 91.34 4.04 Favored Pre-proline 0 CA--C 1.536 0.413 0 CA-C-N 116.226 -0.443 . . . . 0.0 109.856 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_exo -58.82 164.62 9.47 Favored 'Trans proline' 0 N--CA 1.497 1.734 0 C-N-CA 122.335 2.024 . . . . 0.0 112.671 -178.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.413 ' N ' ' CD ' ' A' ' 13' ' ' PRO . . . 77.01 44.5 13.8 Favored Glycine 0 CA--C 1.538 1.48 0 CA-C-O 119.277 -0.735 . . . . 0.0 111.742 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.413 ' CD ' ' N ' ' A' ' 12' ' ' GLY . 39.7 Cg_endo -67.91 90.89 0.36 Allowed 'Trans proline' 0 N--CA 1.494 1.53 0 CA-C-N 119.532 1.666 . . . . 0.0 111.535 -179.279 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 12.5 mmt -64.86 82.39 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.286 -179.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.7 mp -80.42 147.23 31.07 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 178.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.3 t -49.21 115.86 1.47 Allowed 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 121.24 0.543 . . . . 0.0 112.359 -178.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 66.8 m -60.52 -20.1 59.18 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.073 -0.967 . . . . 0.0 113.129 -178.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 76.0 p -80.74 -11.96 59.54 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 97.98 40.42 3.55 Favored Glycine 0 C--N 1.346 1.093 0 C-N-CA 121.272 -0.489 . . . . 0.0 112.454 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.4 m -87.39 -28.55 22.09 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.808 0.304 . . . . 0.0 111.718 179.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.49 8.13 85.34 Favored Glycine 0 CA--C 1.541 1.675 0 N-CA-C 111.463 -0.655 . . . . 0.0 111.463 -177.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -106.24 -175.98 2.95 Favored 'General case' 0 C--N 1.346 0.435 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -94.03 142.01 27.88 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 120.887 0.375 . . . . 0.0 111.474 -179.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -113.18 169.46 12.95 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 109.967 -1.253 . . . . 0.0 109.967 179.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -112.66 138.65 22.13 Favored Pre-proline 0 CA--C 1.537 0.478 0 CA-C-O 119.646 -0.216 . . . . 0.0 110.577 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -73.48 -27.18 13.38 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 C-N-CA 122.019 1.813 . . . . 0.0 112.547 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 67.2 mtt180 -72.83 -36.07 67.41 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 178.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 60.3 p -75.66 -154.51 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.154 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -90.37 29.48 1.26 Allowed 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.256 0.48 . . . . 0.0 112.153 -179.697 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.25 17.0 65.54 Favored Glycine 0 CA--C 1.535 1.327 0 C-N-CA 121.126 -0.559 . . . . 0.0 112.374 179.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 15.3 mtt -124.26 179.7 4.79 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 117.339 0.57 . . . . 0.0 109.79 -179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 20.2 p -83.63 -175.61 5.9 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 122.966 0.166 . . . . 0.0 110.591 -179.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.61 -45.61 78.57 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -177.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 6.4 t -66.28 -37.17 79.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 CA-C-O 120.76 0.314 . . . . 0.0 111.361 -178.415 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 21.7 m -73.49 -40.08 64.37 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.326 -178.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.409 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 18.4 t80 -61.82 -33.66 74.53 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -177.736 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.28 -45.85 18.92 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.472 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -62.88 -46.97 85.35 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -178.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.409 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.7 p-80 -76.61 -40.5 49.23 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 119.964 -0.694 . . . . 0.0 112.375 -177.82 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 26.8 tp -60.45 -27.35 67.45 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 120.781 0.324 . . . . 0.0 110.827 178.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -66.77 -38.4 86.5 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.53 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -75.38 -30.09 60.06 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.741 -179.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -78.69 -34.88 45.78 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.502 0.191 . . . . 0.0 110.984 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -68.73 -43.23 76.35 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.721 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 -65.73 -20.69 66.37 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.783 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.3 t -60.75 -55.21 35.84 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.469 0.176 . . . . 0.0 111.324 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 146.13 68.5 0.01 OUTLIER Glycine 0 CA--C 1.526 0.763 0 N-CA-C 111.384 -0.686 . . . . 0.0 111.384 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.0 ttm180 -123.31 135.96 54.45 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 110.148 -0.315 . . . . 0.0 110.148 179.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 38.5 mtt -119.99 175.21 6.02 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.315 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.6 p -150.91 155.19 35.2 Favored Pre-proline 0 CA--C 1.535 0.37 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.457 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.04 -46.09 0.13 Allowed 'Trans proline' 0 N--CA 1.494 1.526 0 C-N-CA 122.341 2.028 . . . . 0.0 112.172 -179.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 10.2 ttp -111.48 146.0 38.03 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.231 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 92.27 36.41 6.27 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.3 p -79.65 114.22 18.41 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 110.494 -0.187 . . . . 0.0 110.494 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -81.54 177.01 9.2 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.598 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.4 t -142.05 170.74 15.14 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.401 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 109.6 -38.18 3.44 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.818 -0.913 . . . . 0.0 110.818 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.5 m -74.25 -47.39 35.45 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.546 0.212 . . . . 0.0 110.45 179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -79.4 118.24 21.11 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.621 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.7 t -83.82 150.14 58.35 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.507 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -83.33 157.45 14.73 Favored 'Trans proline' 0 N--CA 1.492 1.417 0 C-N-CA 122.341 2.027 . . . . 0.0 112.148 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 40.5 p . . . . . 0 C--O 1.219 -0.541 0 CA-C-O 118.017 -0.992 . . . . 0.0 110.603 -179.89 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.303 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 52.3 p -136.73 -52.96 0.71 Allowed 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.545 0.212 . . . . 0.0 110.593 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 70.8 mtm -151.41 140.38 21.04 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.559 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -101.35 34.21 2.65 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.704 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -92.63 -35.98 13.23 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.743 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -74.5 169.35 17.91 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.452 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.3 m -72.62 110.04 6.69 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.565 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -70.86 -37.71 73.1 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.638 -179.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -72.38 127.62 33.11 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.729 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.2 p -148.66 109.1 3.56 Favored Pre-proline 0 CA--C 1.539 0.523 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.415 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -59.49 -178.88 0.17 Allowed 'Trans proline' 0 N--CA 1.498 1.763 0 C-N-CA 121.989 1.793 . . . . 0.0 112.11 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . 0.433 ' N ' ' CD ' ' A' ' 13' ' ' PRO . . . 83.0 42.25 8.2 Favored Glycine 0 CA--C 1.542 1.757 0 CA-C-O 119.25 -0.75 . . . . 0.0 112.224 -179.568 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . 0.433 ' CD ' ' N ' ' A' ' 12' ' ' GLY . 18.5 Cg_endo -58.71 -72.16 0.03 OUTLIER 'Trans proline' 0 N--CA 1.5 1.872 0 C-N-CA 122.098 1.865 . . . . 0.0 112.546 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.2 65.35 0.82 Allowed 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 120.667 0.27 . . . . 0.0 110.451 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.4 tp -79.56 144.8 33.56 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.948 -0.301 . . . . 0.0 110.338 -179.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.3 t -37.21 117.46 0.54 Allowed 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -179.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 49.0 m -58.91 -26.29 64.19 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.412 179.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 19.7 p -83.28 -8.43 59.45 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 73.59 43.24 37.32 Favored Glycine 0 C--N 1.347 1.14 0 C-N-CA 121.307 -0.473 . . . . 0.0 112.666 178.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.4 p -85.04 -14.32 47.71 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 117.119 0.46 . . . . 0.0 111.83 179.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 96.7 2.72 59.75 Favored Glycine 0 CA--C 1.538 1.493 0 CA-C-O 119.39 -0.672 . . . . 0.0 113.901 178.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -105.91 -171.24 1.87 Allowed 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.304 1.052 . . . . 0.0 110.539 -178.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -96.71 143.73 27.38 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.873 0.368 . . . . 0.0 111.436 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -111.35 161.15 12.87 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 110.199 -1.16 . . . . 0.0 110.199 179.044 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 24.7 t30 -107.33 137.33 19.59 Favored Pre-proline 0 CA--C 1.535 0.368 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -72.73 -28.05 14.3 Favored 'Trans proline' 0 N--CA 1.491 1.382 0 C-N-CA 121.754 1.636 . . . . 0.0 111.957 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -71.92 -31.69 66.62 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.234 178.515 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 68.5 p -77.1 -150.81 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 178.21 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -90.53 29.58 1.27 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.724 0.693 . . . . 0.0 111.121 179.362 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 73.74 18.22 79.46 Favored Glycine 0 CA--C 1.533 1.187 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -178.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 10.7 mtt -128.84 172.36 11.38 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-N 116.905 0.353 . . . . 0.0 110.398 -179.256 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 57.9 m -60.89 172.26 1.01 Allowed 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.115 -179.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 35.6 m -72.01 -46.32 57.6 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 179.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 16.0 t -70.4 -36.72 67.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 116.097 -0.502 . . . . 0.0 109.89 179.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 80.2 m -72.19 -37.24 69.34 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.654 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.427 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 25.8 t80 -58.1 -33.13 68.77 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.736 -179.617 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.9 tttt -77.96 -44.15 27.65 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.037 0.446 . . . . 0.0 110.173 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -56.57 -40.83 75.87 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.844 -178.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . 0.427 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.9 p-80 -85.01 -33.63 22.51 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 120.321 -0.551 . . . . 0.0 112.162 -178.579 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.3 tp -60.79 -30.79 70.26 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 122.922 0.139 . . . . 0.0 111.219 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -68.64 -35.39 77.21 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.766 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.1 mmm-85 -71.68 -29.94 65.15 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.616 -179.477 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 -77.11 -31.06 55.57 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 121.254 -0.178 . . . . 0.0 111.375 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -77.24 -48.7 16.85 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.789 0.328 . . . . 0.0 110.483 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -62.7 -17.49 60.8 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.92 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.6 m -58.95 -60.76 3.35 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 111.616 0.228 . . . . 0.0 111.616 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 139.96 69.27 0.04 OUTLIER Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.728 -0.949 . . . . 0.0 110.728 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.1 ttt180 -58.56 -36.33 73.76 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 111.364 0.135 . . . . 0.0 111.364 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 10.9 mtp -82.51 -49.62 9.71 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.179 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.1 p -145.41 94.31 5.22 Favored Pre-proline 0 CA--C 1.538 0.487 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.68 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -56.07 -61.98 0.29 Allowed 'Trans proline' 0 N--CA 1.501 1.927 0 C-N-CA 122.212 1.941 . . . . 0.0 112.234 179.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -125.08 -50.48 1.69 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.19 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 144.3 -37.23 1.41 Allowed Glycine 0 CA--C 1.525 0.718 0 N-CA-C 111.026 -0.83 . . . . 0.0 111.026 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.5 t -133.42 148.13 51.77 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.59 0.233 . . . . 0.0 110.639 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -145.28 148.66 33.7 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.591 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 13.0 m -150.15 153.14 35.82 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.692 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 120.65 72.62 0.33 Allowed Glycine 0 CA--C 1.526 0.771 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 74.4 m -104.27 34.84 2.91 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 120.849 0.357 . . . . 0.0 110.709 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 15.6 p30 -70.48 147.41 49.43 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.687 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.4 p -86.99 158.31 53.21 Favored Pre-proline 0 CA--C 1.535 0.387 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.623 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -73.51 118.59 5.55 Favored 'Trans proline' 0 N--CA 1.495 1.595 0 C-N-CA 122.221 1.947 . . . . 0.0 112.189 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 59.2 p . . . . . 0 N--CA 1.476 0.827 0 CA-C-O 118.216 -0.897 . . . . 0.0 112.039 179.959 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.241 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.5 m -84.77 165.96 17.37 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.544 0.211 . . . . 0.0 110.884 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.8 ptt? -77.09 142.41 39.79 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.605 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -137.39 -63.01 0.6 Allowed 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.376 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -103.11 33.43 3.29 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.762 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -81.87 -41.94 20.27 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.475 179.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.0 p -74.13 105.34 5.3 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.863 -179.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -107.1 -39.89 5.59 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.547 -179.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -92.82 161.83 14.35 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.947 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 5.0 t -156.19 94.86 2.38 Favored Pre-proline 0 CA--C 1.544 0.726 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.273 179.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -80.65 117.24 3.32 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 C-N-CA 122.216 1.944 . . . . 0.0 112.113 -179.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -175.48 -62.42 0.06 OUTLIER Glycine 0 CA--C 1.535 1.311 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -80.72 85.38 1.82 Allowed 'Trans proline' 0 N--CA 1.494 1.525 0 C-N-CA 122.373 2.049 . . . . 0.0 111.997 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 6.8 mmt -71.4 81.63 0.77 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.805 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -78.52 146.16 34.49 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.688 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.3 t -42.64 117.98 1.13 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -178.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.34 -23.68 50.41 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.72 179.285 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 46.4 p -81.33 -12.22 59.09 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -179.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.11 43.4 10.8 Favored Glycine 0 C--N 1.344 1.003 0 C-N-CA 121.255 -0.498 . . . . 0.0 112.58 178.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 3.7 p -87.44 -15.56 37.37 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 117.252 0.526 . . . . 0.0 111.989 179.391 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 92.71 4.35 65.58 Favored Glycine 0 CA--C 1.54 1.623 0 CA-C-O 119.639 -0.534 . . . . 0.0 114.071 178.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 36.7 m-85 -106.12 -169.53 1.59 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 117.944 0.872 . . . . 0.0 110.062 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -96.45 141.38 29.81 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.143 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -116.52 171.92 13.99 Favored Glycine 0 CA--C 1.529 0.956 0 N-CA-C 110.554 -1.019 . . . . 0.0 110.554 179.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -122.53 143.12 38.98 Favored Pre-proline 0 CA--C 1.538 0.497 0 CA-C-N 116.82 0.31 . . . . 0.0 111.181 -179.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -77.01 -21.76 11.97 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 C-N-CA 122.122 1.881 . . . . 0.0 113.122 179.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 5.9 mpt_? -73.98 -34.94 64.4 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 64.4 p -74.25 -156.69 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 178.027 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -91.52 25.5 2.62 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 118.379 0.536 . . . . 0.0 111.596 179.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.63 13.64 69.68 Favored Glycine 0 CA--C 1.538 1.476 0 N-CA-C 112.041 -0.424 . . . . 0.0 112.041 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.51 165.91 17.62 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-N 117.483 0.642 . . . . 0.0 111.387 -179.25 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 60.7 m -57.34 178.2 0.08 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.788 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 13.2 m -71.76 -43.0 66.53 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 16.2 t -73.98 -37.49 47.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.733 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 71.2 m -72.03 -38.14 69.62 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.715 -179.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -55.93 -38.68 70.61 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-O 120.625 0.25 . . . . 0.0 111.072 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.9 tttt -76.96 -43.9 33.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.955 -179.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -55.95 -40.01 72.57 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.744 -178.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -84.02 -32.73 24.75 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 120.087 -0.645 . . . . 0.0 111.414 -179.529 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 15.1 tp -60.21 -26.46 66.4 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.747 -0.206 . . . . 0.0 111.392 179.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -69.51 -37.81 77.34 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.461 0.172 . . . . 0.0 110.665 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.7 -32.27 60.02 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.7 179.812 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -70.62 -43.09 69.99 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.985 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 -57.68 -26.13 61.27 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.755 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -61.32 -19.68 62.07 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 123.039 0.212 . . . . 0.0 111.423 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 10.8 t -59.61 -36.65 76.74 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.582 0.23 . . . . 0.0 111.169 -179.812 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.7 -41.93 2.02 Favored Glycine 0 CA--C 1.524 0.638 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -78.34 134.08 37.51 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.537 0.208 . . . . 0.0 110.844 -179.774 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.8 mtt -95.8 164.73 12.62 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.428 179.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.7 t -162.28 93.89 1.27 Allowed Pre-proline 0 CA--C 1.539 0.532 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.778 179.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -73.54 -35.77 4.46 Favored 'Trans proline' 0 N--CA 1.497 1.734 0 C-N-CA 122.263 1.976 . . . . 0.0 112.488 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.64 -175.4 3.44 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.79 0.328 . . . . 0.0 110.257 -179.683 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 137.64 -53.93 0.72 Allowed Glycine 0 CA--C 1.527 0.794 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 77.4 p -74.19 134.0 42.75 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.476 0.179 . . . . 0.0 110.617 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -69.57 134.75 49.17 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.584 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.1 t -76.59 112.79 13.51 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.531 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 86.75 52.13 3.23 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 111.01 -0.836 . . . . 0.0 111.01 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.1 t -80.33 -43.91 20.41 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.593 0.235 . . . . 0.0 110.516 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -78.23 149.73 33.58 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.745 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.1 t -139.22 90.84 11.54 Favored Pre-proline 0 CA--C 1.539 0.527 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.23 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -58.4 157.43 26.6 Favored 'Trans proline' 0 N--CA 1.498 1.768 0 C-N-CA 122.301 2.001 . . . . 0.0 112.163 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 39.8 p . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.465 -179.941 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 4.5 mmt . . . . . 0 CA--C 1.536 0.408 0 CA-C-O 120.916 0.389 . . . . 0.0 110.372 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -75.02 144.92 42.85 Favored 'General case' 0 CA--C 1.527 0.094 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 8.7 t -49.78 128.06 17.34 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 112.27 0.471 . . . . 0.0 112.27 -179.022 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 28.5 m -63.71 -30.21 71.34 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.822 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 80.5 p -73.61 -19.01 60.98 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.03 43.12 6.82 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 121.216 -0.516 . . . . 0.0 112.863 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.8 p -85.7 -22.35 27.87 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 117.286 0.543 . . . . 0.0 111.108 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.28 8.08 50.77 Favored Glycine 0 CA--C 1.537 1.433 0 CA-C-O 119.85 -0.417 . . . . 0.0 113.165 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -114.3 159.37 20.28 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 117.673 0.737 . . . . 0.0 110.425 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.7 t80 -67.57 146.66 53.68 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.98 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -118.43 -179.08 17.07 Favored Glycine 0 CA--C 1.53 0.975 0 N-CA-C 110.526 -1.029 . . . . 0.0 110.526 179.676 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.3 t30 -126.94 138.88 33.57 Favored Pre-proline 0 N--CA 1.47 0.568 0 CA-C-O 119.466 -0.302 . . . . 0.0 110.528 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -77.11 -22.65 11.12 Favored 'Trans proline' 0 N--CA 1.489 1.206 0 C-N-CA 121.922 1.748 . . . . 0.0 112.53 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 28.2 mtm180 -71.17 -34.14 70.65 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 67.2 p -74.55 -157.49 0.06 Allowed 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 107.594 -1.262 . . . . 0.0 107.594 177.472 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -90.94 25.41 2.42 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 118.333 0.515 . . . . 0.0 111.208 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 82.52 10.6 83.18 Favored Glycine 0 CA--C 1.541 1.676 0 N-CA-C 111.65 -0.58 . . . . 0.0 111.65 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 3.0 mpp? -115.24 156.42 25.41 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 117.195 0.498 . . . . 0.0 110.448 -179.418 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 22.9 p -69.98 -160.63 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.036 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.47 -48.3 28.18 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -178.758 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 8.3 t -68.81 -56.92 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 N-CA-C 111.727 0.269 . . . . 0.0 111.727 -177.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 81.2 m -57.82 -35.32 70.71 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -178.741 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -62.96 -31.09 72.12 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 121.347 -0.141 . . . . 0.0 111.295 -179.29 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.7 tttt -75.67 -48.61 21.33 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.72 0.295 . . . . 0.0 110.717 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -63.31 -42.34 99.02 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.138 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 63.9 t60 -63.95 -48.37 76.79 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.621 -179.069 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 tp -63.63 -30.4 71.51 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 111.627 0.232 . . . . 0.0 111.627 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -65.03 -40.95 95.58 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 120.85 0.357 . . . . 0.0 110.329 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.87 -31.46 64.74 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.117 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 . . . . . 0 N--CA 1.464 0.275 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.573 -179.626 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.323 0 N-CA-C 110.17 -0.307 . . . . 0.0 110.17 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.2 mp -75.05 146.58 41.42 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.193 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.2 t -46.7 137.08 7.29 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -179.132 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.5 m -65.95 -33.94 76.96 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.008 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 79.8 p -70.19 -13.43 62.18 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.309 -0.405 . . . . 0.0 112.084 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.26 25.61 63.4 Favored Glycine 0 CA--C 1.531 1.039 0 N-CA-C 112.133 -0.387 . . . . 0.0 112.133 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.7 p -65.91 -19.3 65.82 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 117.277 0.538 . . . . 0.0 111.832 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.45 8.06 58.8 Favored Glycine 0 CA--C 1.538 1.477 0 CA-C-O 119.863 -0.409 . . . . 0.0 112.967 179.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 44.4 m-85 -104.39 -173.07 2.22 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 117.506 0.653 . . . . 0.0 110.628 -179.03 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -97.05 142.33 29.12 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.78 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -113.89 176.13 16.9 Favored Glycine 0 CA--C 1.531 1.046 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -126.02 141.28 39.11 Favored Pre-proline 0 CA--C 1.54 0.586 0 CA-C-O 119.488 -0.291 . . . . 0.0 110.903 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -75.22 -24.16 12.74 Favored 'Trans proline' 0 N--CA 1.496 1.626 0 C-N-CA 122.234 1.956 . . . . 0.0 112.787 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 28.5 mtt-85 -72.59 -32.01 65.64 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 178.572 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.4 p -81.03 -152.98 0.09 Allowed 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 177.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -92.33 28.5 1.92 Allowed 'General case' 0 C--O 1.236 0.382 0 CA-C-N 118.166 0.439 . . . . 0.0 111.53 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 76.34 12.72 84.01 Favored Glycine 0 CA--C 1.537 1.452 0 C-N-CA 121.094 -0.574 . . . . 0.0 111.837 -179.245 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 14.7 mtt -118.33 168.31 10.74 Favored 'General case' 0 C--N 1.347 0.484 0 CA-C-N 117.568 0.684 . . . . 0.0 111.168 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 20.7 p -78.43 -164.1 0.52 Allowed 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.392 -178.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.27 -45.39 48.04 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -178.474 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 21.3 t -70.71 -57.19 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 83.5 m -58.99 -35.16 72.76 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -178.499 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -66.74 -29.88 69.96 Favored 'General case' 0 N--CA 1.467 0.417 0 O-C-N 123.074 0.234 . . . . 0.0 111.602 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.5 tttt -76.0 -48.04 22.58 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.594 0.235 . . . . 0.0 110.641 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -62.46 -37.78 87.24 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.741 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 32.4 t60 -61.05 -49.02 79.07 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.281 -179.192 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.3 mp -59.45 -27.99 66.57 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.668 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 4.5 tp60 -60.02 -43.01 95.55 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 120.367 0.127 . . . . 0.0 111.336 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -69.24 -29.63 67.6 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.219 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 . . . . . 0 N--CA 1.467 0.415 0 CA-C-O 120.567 0.222 . . . . 0.0 111.233 179.886 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 14.9 mtt . . . . . 0 CA--C 1.535 0.401 0 CA-C-O 121.029 0.442 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.514 HD13 ' O ' ' A' ' 22' ' ' PHE . 2.6 mm? -74.21 146.07 43.65 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.627 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.8 t -45.53 137.81 4.82 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -179.261 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 66.6 m -69.95 -24.53 63.36 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.811 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 75.0 p -80.48 -17.99 49.98 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.43 31.14 22.85 Favored Glycine 0 C--N 1.34 0.762 0 C-N-CA 121.117 -0.564 . . . . 0.0 112.401 179.162 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.5 p -72.96 -19.79 61.17 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.904 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 97.17 10.46 54.51 Favored Glycine 0 CA--C 1.538 1.491 0 CA-C-O 119.778 -0.457 . . . . 0.0 113.035 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.514 ' O ' HD13 ' A' ' 15' ' ' LEU . 75.8 m-85 -117.06 166.0 12.72 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 117.707 0.753 . . . . 0.0 111.335 -179.597 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -67.48 145.74 54.66 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.303 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -110.58 163.72 12.3 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.498 ' HB3' HG23 ' A' ' 28' ' ' THR . 22.7 t30 -113.06 126.45 28.21 Favored Pre-proline 0 CA--C 1.539 0.556 0 CA-C-O 119.379 -0.343 . . . . 0.0 110.236 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.08 -16.63 28.67 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 121.825 1.684 . . . . 0.0 113.073 179.582 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 50.0 mtt180 -76.89 -35.01 57.71 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 177.852 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.498 HG23 ' HB3' ' A' ' 25' ' ' ASN . 42.9 p -73.03 -154.77 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 178.197 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -90.83 27.52 1.77 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.17 0.441 . . . . 0.0 111.253 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 84.94 10.89 77.84 Favored Glycine 0 CA--C 1.537 1.418 0 N-CA-C 111.714 -0.554 . . . . 0.0 111.714 -179.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.92 163.49 19.18 Favored 'General case' 0 C--N 1.344 0.336 0 CA-C-N 117.039 0.419 . . . . 0.0 110.645 -179.296 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 23.9 p -72.16 -158.31 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.71 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.21 -51.49 11.99 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -178.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 10.8 t -66.2 -54.83 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 N-CA-C 111.56 0.208 . . . . 0.0 111.56 -178.12 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 75.9 m -58.35 -36.14 73.0 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -178.359 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -57.39 -41.36 80.12 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 111.512 0.19 . . . . 0.0 111.512 -179.161 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.6 ttpt -75.14 -45.45 40.78 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.918 0.39 . . . . 0.0 110.343 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 -54.75 -39.76 68.64 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.802 -0.635 . . . . 0.0 112.525 -179.034 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -84.6 -32.74 23.58 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.358 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.0 tp -61.69 -27.28 68.58 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.889 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -69.08 -38.94 79.27 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 26.5 mtt-85 -70.83 -30.71 67.21 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.82 179.346 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 . . . . . 0 C--O 1.232 0.168 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.803 179.89 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 29.7 mmm . . . . . 0 C--O 1.235 0.312 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.7 mp -79.31 145.43 33.48 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.717 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 8.8 t -45.34 131.54 8.1 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -178.617 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.0 m -62.59 -24.84 67.77 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.215 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 33.7 p -81.2 -10.62 59.59 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -178.52 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 78.12 25.48 61.76 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.53 179.428 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.6 p -67.45 -15.57 63.74 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-N 117.324 0.562 . . . . 0.0 111.279 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.15 8.87 68.18 Favored Glycine 0 CA--C 1.535 1.321 0 CA-C-O 119.997 -0.335 . . . . 0.0 113.206 179.227 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -106.15 -173.6 2.34 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 117.31 0.555 . . . . 0.0 110.303 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -93.14 141.71 28.12 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.865 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -112.75 169.32 12.94 Favored Glycine 0 CA--C 1.528 0.887 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 179.631 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -115.61 138.42 23.82 Favored Pre-proline 0 CA--C 1.541 0.632 0 CA-C-O 119.65 -0.214 . . . . 0.0 110.673 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -76.65 -25.92 8.9 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 122.49 2.126 . . . . 0.0 112.588 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 13.9 mtt-85 -73.84 -29.26 62.03 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.194 178.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 67.9 p -85.49 -150.43 0.13 Allowed 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 177.756 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -91.7 28.08 1.87 Allowed 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 118.791 0.723 . . . . 0.0 111.623 179.37 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 74.56 16.41 80.12 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 121.255 -0.498 . . . . 0.0 111.972 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 35.0 mtt -117.45 163.81 15.83 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 117.339 0.57 . . . . 0.0 109.903 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 31.3 p -73.76 -163.82 0.19 Allowed 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.774 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.47 -41.97 62.5 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.315 0.857 . . . . 0.0 113.315 -178.23 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 10.1 t -72.52 -49.81 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-O 120.785 0.326 . . . . 0.0 110.869 -178.22 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 72.5 m -65.41 -36.2 83.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.538 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -65.76 -36.8 84.58 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.12 -44.62 46.03 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.266 -0.574 . . . . 0.0 109.716 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -65.35 -43.26 91.39 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 123.146 0.279 . . . . 0.0 111.24 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 41.6 t-80 -59.52 -49.25 78.49 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -178.619 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.04 -25.94 65.73 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.005 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -64.41 -39.64 94.23 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 111.566 0.21 . . . . 0.0 111.566 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 10.4 mtt-85 -74.85 -30.51 61.37 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.15 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 . . . . . 0 N--CA 1.463 0.205 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.537 179.966 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 12.3 mmt . . . . . 0 CA--C 1.533 0.305 0 CA-C-O 120.988 0.423 . . . . 0.0 111.24 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mp -76.11 143.56 41.19 Favored 'General case' 0 C--O 1.232 0.144 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.5 t -40.05 131.48 1.99 Allowed 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 -178.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 47.7 m -65.36 -26.2 67.92 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.16 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 51.9 p -78.96 -12.91 60.05 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 121.186 -0.206 . . . . 0.0 111.377 179.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 78.38 37.13 28.57 Favored Glycine 0 C--N 1.349 1.292 0 CA-C-O 119.808 -0.44 . . . . 0.0 113.375 178.019 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 29.1 p -77.56 -7.98 57.14 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 117.258 0.529 . . . . 0.0 111.801 178.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 85.4 5.94 84.43 Favored Glycine 0 CA--C 1.538 1.507 0 CA-C-O 119.774 -0.459 . . . . 0.0 113.207 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -109.79 172.02 7.1 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 117.679 0.739 . . . . 0.0 109.995 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -78.49 145.7 34.81 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.155 -178.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -118.59 169.35 13.43 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -112.27 141.81 25.77 Favored Pre-proline 0 N--CA 1.471 0.597 0 CA-C-N 116.73 0.265 . . . . 0.0 110.774 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.0 -29.35 6.78 Favored 'Trans proline' 0 N--CA 1.495 1.565 0 C-N-CA 122.082 1.854 . . . . 0.0 112.307 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -71.72 -27.28 62.91 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 178.234 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 71.0 p -83.6 -152.74 0.13 Allowed 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.412 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -90.87 26.72 2.0 Allowed 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 118.236 0.471 . . . . 0.0 111.238 179.32 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 72.97 15.53 78.41 Favored Glycine 0 CA--C 1.536 1.4 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 -177.826 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.7 mtp -121.65 163.41 19.02 Favored 'General case' 0 C--N 1.347 0.491 0 CA-C-N 117.085 0.443 . . . . 0.0 109.94 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 29.9 p -74.57 -167.39 0.55 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.911 -178.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.15 -37.68 61.24 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 -177.801 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.0 t -72.13 -49.42 43.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-O 120.579 0.228 . . . . 0.0 111.247 -177.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 67.4 m -70.27 -34.45 72.81 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.73 -178.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -69.47 -27.51 65.28 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 119.447 -0.311 . . . . 0.0 111.293 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt -78.12 -45.99 21.87 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 117.992 0.36 . . . . 0.0 110.041 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -64.7 -38.87 92.48 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.587 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 54.3 t60 -66.12 -41.41 90.58 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.096 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.2 tp -71.61 -42.22 67.95 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.132 -178.204 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -65.09 -35.83 82.39 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.865 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 11.2 ttt180 -77.14 -28.48 54.28 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.722 178.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 . . . . . 0 CA--C 1.535 0.389 0 CA-C-N 116.749 -0.205 . . . . 0.0 111.067 179.557 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 4.2 mmt . . . . . 0 C--O 1.234 0.245 0 CA-C-O 121.102 0.477 . . . . 0.0 110.308 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.1 tp -74.83 144.75 43.32 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.294 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.2 t -44.1 132.38 5.59 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -178.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.0 m -65.44 -32.89 74.75 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.332 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 73.8 p -72.65 -13.4 61.35 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.23 43.48 25.61 Favored Glycine 0 C--N 1.345 1.054 0 N-CA-C 111.771 -0.532 . . . . 0.0 111.771 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 29.2 p -85.38 -14.38 46.51 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.59 4.38 60.68 Favored Glycine 0 CA--C 1.536 1.406 0 C-N-CA 121.306 -0.473 . . . . 0.0 113.296 179.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -114.09 163.62 14.93 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-N 117.674 0.737 . . . . 0.0 110.561 -179.629 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -68.05 144.77 54.96 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.749 -179.016 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -110.13 161.19 13.03 Favored Glycine 0 CA--C 1.528 0.848 0 N-CA-C 110.777 -0.929 . . . . 0.0 110.777 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.412 ' HB3' HG23 ' A' ' 28' ' ' THR . 22.5 t30 -108.1 118.9 51.49 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-O 119.329 -0.367 . . . . 0.0 110.606 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -67.18 -18.91 51.13 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 C-N-CA 121.675 1.583 . . . . 0.0 112.154 179.03 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 60.9 mtp180 -75.36 -31.98 60.69 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 177.715 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.412 HG23 ' HB3' ' A' ' 25' ' ' ASN . 70.4 p -79.09 -153.44 0.07 Allowed 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.467 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -89.93 26.54 1.79 Allowed 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 118.204 0.456 . . . . 0.0 111.982 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.02 10.68 78.06 Favored Glycine 0 CA--C 1.536 1.391 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.75 161.8 21.96 Favored 'General case' 0 C--N 1.347 0.457 0 CA-C-N 117.249 0.524 . . . . 0.0 111.193 -178.835 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 31.1 p -72.25 -157.43 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.652 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.58 -49.26 19.11 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -178.503 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.4 t -69.68 -52.04 35.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -177.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 71.2 m -60.05 -36.15 76.7 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -178.4 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.445 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 14.5 t80 -58.87 -48.42 81.46 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 -178.797 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.1 pttt -72.32 -44.14 63.11 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -54.63 -39.61 68.13 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.179 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.445 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 0.8 OUTLIER -85.34 -33.33 22.08 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 120.425 -0.51 . . . . 0.0 111.753 -179.445 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 14.9 tp -62.47 -30.6 71.37 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.453 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -65.93 -39.29 90.38 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.379 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 70.0 mtt-85 -79.23 -30.86 43.41 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.572 -0.286 . . . . 0.0 111.229 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.9 tp60 . . . . . 0 CA--C 1.531 0.243 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.076 179.609 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 11.3 mmt . . . . . 0 C--O 1.237 0.444 0 CA-C-O 120.797 0.332 . . . . 0.0 110.313 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.448 HD23 ' HA ' ' A' ' 15' ' ' LEU . 18.2 mt -79.36 140.43 37.48 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.375 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.7 t -38.93 136.19 0.8 Allowed 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -177.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m -64.92 -29.33 70.26 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.534 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 44.0 p -82.23 -6.96 59.59 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 71.73 43.52 51.09 Favored Glycine 0 C--N 1.344 0.978 0 C-N-CA 121.24 -0.505 . . . . 0.0 112.085 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.4 p -82.29 -6.81 59.5 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.3 0.62 79.81 Favored Glycine 0 CA--C 1.54 1.614 0 CA-C-O 119.648 -0.529 . . . . 0.0 112.954 179.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -110.64 177.6 4.63 Favored 'General case' 0 C--N 1.344 0.363 0 CA-C-N 117.791 0.795 . . . . 0.0 111.151 -179.136 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -84.13 144.91 28.7 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.51 -178.687 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -114.25 159.59 13.63 Favored Glycine 0 CA--C 1.53 1.019 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 178.546 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -105.97 140.0 20.8 Favored Pre-proline 0 N--CA 1.468 0.428 0 CA-C-O 119.3 -0.381 . . . . 0.0 110.245 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -75.22 -23.15 13.72 Favored 'Trans proline' 0 N--CA 1.489 1.239 0 C-N-CA 121.746 1.63 . . . . 0.0 112.598 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 85.8 mtt-85 -75.33 -28.45 59.65 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 178.256 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 60.9 p -80.95 -151.29 0.08 Allowed 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 178.649 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -92.11 28.17 1.95 Allowed 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 117.984 0.356 . . . . 0.0 111.274 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 76.79 15.64 81.43 Favored Glycine 0 CA--C 1.536 1.349 0 N-CA-C 111.272 -0.731 . . . . 0.0 111.272 -178.686 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 40.2 mtt -123.65 169.76 11.15 Favored 'General case' 0 C--N 1.347 0.474 0 CA-C-N 117.389 0.594 . . . . 0.0 111.334 -179.32 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 22.4 p -79.08 -165.82 0.82 Allowed 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.781 -178.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.8 -41.98 51.29 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 13.9 t -68.27 -49.3 68.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -177.732 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 60.8 m -72.1 -34.64 68.79 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 -178.057 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -64.95 -27.03 68.56 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -178.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 55.2 tttt -75.94 -41.66 50.98 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -67.12 -45.8 76.05 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.458 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 42.3 t60 -57.56 -45.51 85.06 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 -178.4 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.0 mp -62.88 -29.12 70.52 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.958 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -66.79 -32.46 73.77 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 121.078 -0.249 . . . . 0.0 111.1 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -83.58 -33.59 25.35 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.672 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 . . . . . 0 CA--C 1.535 0.373 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.378 179.643 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 1.2 mpt? . . . . . 0 C--O 1.233 0.229 0 CA-C-O 120.539 0.209 . . . . 0.0 110.757 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.462 HD13 ' O ' ' A' ' 22' ' ' PHE . 2.1 mm? -78.22 142.84 37.63 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.83 179.722 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.1 t -51.1 120.95 5.42 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 39.5 m -59.67 -25.36 64.67 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.429 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 66.7 p -72.04 -18.95 61.91 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.63 39.71 8.09 Favored Glycine 0 C--N 1.342 0.91 0 C-N-CA 121.194 -0.527 . . . . 0.0 111.988 178.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.5 p -89.28 -20.38 24.17 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 120.946 -0.301 . . . . 0.0 111.359 178.412 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 93.96 5.5 62.54 Favored Glycine 0 CA--C 1.538 1.514 0 CA-C-O 120.011 -0.327 . . . . 0.0 113.248 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.462 ' O ' HD13 ' A' ' 15' ' ' LEU . 18.7 m-85 -103.14 -177.57 3.41 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-N 117.444 0.622 . . . . 0.0 110.937 -179.125 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.7 t80 -89.01 134.03 34.13 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.299 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -107.95 165.38 12.9 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.876 -179.536 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -114.92 134.89 22.41 Favored Pre-proline 0 CA--C 1.541 0.631 0 CA-C-O 119.523 -0.275 . . . . 0.0 111.419 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -76.55 -26.39 8.57 Favored 'Trans proline' 0 N--CA 1.496 1.638 0 C-N-CA 122.386 2.057 . . . . 0.0 112.228 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 36.3 mtt-85 -71.14 -33.33 69.97 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.153 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 45.9 p -77.52 -154.0 0.06 Allowed 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -91.58 27.65 1.95 Allowed 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.322 0.51 . . . . 0.0 111.466 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.88 15.3 79.44 Favored Glycine 0 CA--C 1.534 1.244 0 N-CA-C 112.315 -0.314 . . . . 0.0 112.315 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -118.89 164.18 15.81 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 117.195 0.498 . . . . 0.0 110.706 -179.144 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 31.2 p -76.26 -157.57 0.08 Allowed 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.549 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.78 -50.4 20.75 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -179.114 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 21.3 t -67.36 -55.8 15.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -177.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 91.1 m -55.73 -36.62 67.44 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -178.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -59.62 -43.18 93.86 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.923 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.1 ttpt -73.32 -46.37 49.84 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.724 0.297 . . . . 0.0 110.385 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -54.85 -39.4 68.58 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.376 -178.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -85.98 -33.28 21.14 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 120.309 -0.557 . . . . 0.0 112.212 -179.238 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 17.5 tp -63.98 -33.4 75.64 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.555 0.217 . . . . 0.0 111.057 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -69.12 -38.75 79.04 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.864 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 45.7 mtp180 -72.8 -32.35 65.49 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.179 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 . . . . . 0 N--CA 1.465 0.303 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.734 -179.725 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 3.6 mmt . . . . . 0 C--O 1.235 0.331 0 CA-C-O 120.888 0.375 . . . . 0.0 110.346 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.96 144.99 40.68 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.5 t -46.3 134.03 9.11 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -178.184 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.9 m -67.92 -24.56 65.21 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 114.869 -1.06 . . . . 0.0 112.153 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.62 HG23 ' SD ' ' A' ' 31' ' ' MET . 76.9 p -81.53 -16.91 50.33 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -179.241 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.21 34.41 14.61 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 121.007 -0.616 . . . . 0.0 112.19 178.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 27.2 p -77.74 -18.54 56.41 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.841 178.905 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 91.62 9.8 62.47 Favored Glycine 0 CA--C 1.534 1.248 0 CA-C-O 119.982 -0.343 . . . . 0.0 112.759 179.297 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -105.8 -171.05 1.83 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 117.485 0.643 . . . . 0.0 110.602 -179.163 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -97.46 143.57 28.05 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.66 0.267 . . . . 0.0 111.106 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -113.36 170.85 13.54 Favored Glycine 0 CA--C 1.528 0.856 0 N-CA-C 110.297 -1.121 . . . . 0.0 110.297 179.342 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -122.82 140.57 33.49 Favored Pre-proline 0 CA--C 1.538 0.513 0 CA-C-O 119.467 -0.301 . . . . 0.0 110.561 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -75.63 -17.36 18.27 Favored 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 121.835 1.69 . . . . 0.0 112.677 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.1 mmt180 -78.26 -34.24 49.19 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 40.7 p -77.63 -151.31 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 178.555 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -88.94 29.36 1.05 Allowed 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 118.534 0.607 . . . . 0.0 111.2 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 74.39 15.39 80.3 Favored Glycine 0 CA--C 1.535 1.301 0 N-CA-C 111.993 -0.443 . . . . 0.0 111.993 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.62 ' SD ' HG23 ' A' ' 18' ' ' THR . 10.9 mtt -129.04 176.57 7.78 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 117.416 0.608 . . . . 0.0 109.979 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 14.6 p -77.37 -169.31 1.37 Allowed 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.306 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -74.85 -47.21 31.5 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -177.62 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 20.2 t -68.27 -52.49 37.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 120.999 -0.281 . . . . 0.0 111.3 -178.165 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 79.2 m -60.73 -36.99 80.24 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.146 -179.191 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.446 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 29.2 t80 -57.82 -33.21 68.37 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.517 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.4 mtpt -77.02 -45.86 25.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.804 0.335 . . . . 0.0 110.101 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -58.68 -41.3 85.88 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.671 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.446 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.3 p-80 -82.11 -36.13 27.85 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 120.21 -0.596 . . . . 0.0 111.697 -178.817 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.9 tp -62.02 -28.81 69.85 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.576 0.227 . . . . 0.0 110.877 179.122 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -61.82 -38.69 89.09 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.643 179.314 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 60.2 mtt180 -77.11 -29.45 54.79 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.55 178.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 . . . . . 0 CA--C 1.533 0.289 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.689 179.497 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 19.1 mtt . . . . . 0 N--CA 1.465 0.292 0 CA-C-O 120.521 0.201 . . . . 0.0 111.42 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.438 HD13 ' O ' ' A' ' 22' ' ' PHE . 0.9 OUTLIER -73.77 140.97 46.27 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.255 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.2 t -39.67 137.06 0.92 Allowed 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -178.711 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 57.8 m -61.65 -25.41 67.36 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.197 -179.353 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 68.1 p -90.76 -5.58 55.49 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -178.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.35 41.38 85.69 Favored Glycine 0 C--N 1.341 0.841 0 N-CA-C 111.482 -0.647 . . . . 0.0 111.482 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 15.2 p -86.58 -13.23 46.37 Favored 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.2 -7.48 54.51 Favored Glycine 0 CA--C 1.542 1.765 0 CA-C-O 119.746 -0.474 . . . . 0.0 113.539 178.935 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.438 ' O ' HD13 ' A' ' 15' ' ' LEU . 11.4 m-85 -91.41 178.91 5.82 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 117.627 0.714 . . . . 0.0 110.895 -178.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -89.71 135.62 33.51 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.336 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -100.78 140.18 14.76 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 111.069 -0.813 . . . . 0.0 111.069 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -99.89 135.47 20.45 Favored Pre-proline 0 CA--C 1.538 0.491 0 CA-C-O 119.446 -0.312 . . . . 0.0 110.253 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -74.79 -21.78 16.0 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 121.791 1.66 . . . . 0.0 112.863 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -75.3 -31.75 60.77 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 178.404 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 54.0 p -79.59 -153.27 0.08 Allowed 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 178.278 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -91.45 27.34 2.0 Allowed 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 118.331 0.514 . . . . 0.0 111.046 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.35 17.25 76.57 Favored Glycine 0 CA--C 1.539 1.593 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -178.231 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 28.5 mtt -120.58 160.5 23.1 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-O 121.097 0.475 . . . . 0.0 111.571 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 22.4 p -73.88 -161.62 0.12 Allowed 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.888 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.42 -43.21 51.09 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.846 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.6 t -69.97 -45.89 75.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.9 m -73.53 -36.22 65.66 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -177.765 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -63.38 -37.3 86.72 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -178.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.76 -43.0 48.78 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.28 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 62.2 mm-40 -62.79 -47.76 82.09 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.541 179.669 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -58.49 -46.25 87.06 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.986 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.1 mp -60.96 -26.65 67.69 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.881 -179.008 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -55.24 -36.26 65.84 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-O 120.752 0.31 . . . . 0.0 111.354 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 11.1 mtm105 -83.87 -29.08 27.51 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.083 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 . . . . . 0 CA--C 1.535 0.366 0 CA-C-N 116.767 -0.197 . . . . 0.0 110.988 179.67 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 13.4 mtt . . . . . 0 CA--C 1.535 0.396 0 CA-C-O 120.825 0.345 . . . . 0.0 111.394 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.3 mt -74.49 148.7 40.77 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.509 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 10.0 t -44.82 132.95 6.4 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -178.622 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m -61.61 -29.07 69.8 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.796 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.556 HG23 ' SD ' ' A' ' 31' ' ' MET . 71.2 p -78.89 -9.75 59.59 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.652 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 71.94 33.23 62.86 Favored Glycine 0 C--N 1.342 0.888 0 N-CA-C 111.26 -0.736 . . . . 0.0 111.26 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.5 p -71.83 -19.14 62.02 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.37 4.28 53.19 Favored Glycine 0 CA--C 1.539 1.557 0 CA-C-O 119.569 -0.573 . . . . 0.0 113.481 178.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -115.53 164.09 14.81 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 117.944 0.872 . . . . 0.0 111.038 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -69.21 146.55 52.29 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.571 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -109.68 166.89 12.63 Favored Glycine 0 CA--C 1.527 0.794 0 N-CA-C 110.216 -1.153 . . . . 0.0 110.216 178.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -114.93 135.96 22.51 Favored Pre-proline 0 N--CA 1.467 0.416 0 N-CA-C 109.948 -0.389 . . . . 0.0 109.948 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -74.82 -23.46 14.19 Favored 'Trans proline' 0 N--CA 1.495 1.58 0 C-N-CA 122.022 1.814 . . . . 0.0 112.928 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -75.67 -36.81 60.0 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.579 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.2 p -70.87 -154.93 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -89.76 29.21 1.2 Allowed 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.681 0.673 . . . . 0.0 111.031 179.235 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.44 16.27 78.33 Favored Glycine 0 CA--C 1.534 1.24 0 CA-C-O 119.872 -0.404 . . . . 0.0 112.465 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.556 ' SD ' HG23 ' A' ' 18' ' ' THR . 9.4 mtt -131.2 176.56 8.17 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 117.616 0.708 . . . . 0.0 111.213 -178.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 18.9 p -77.22 -167.15 0.84 Allowed 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.677 -179.209 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.51 -48.83 30.11 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -177.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.1 t -65.68 -57.74 9.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -177.293 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 73.2 m -57.51 -35.38 70.18 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 111.641 0.237 . . . . 0.0 111.641 -178.63 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.46 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 41.1 t80 -57.42 -41.45 80.42 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.216 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -74.29 -45.09 49.8 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -56.69 -39.76 74.37 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -179.235 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.46 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.6 p-80 -84.46 -33.24 23.68 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 120.006 -0.677 . . . . 0.0 111.675 -179.131 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 15.7 tp -62.33 -30.39 71.13 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.254 179.303 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -65.11 -39.47 93.16 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.662 0.268 . . . . 0.0 111.0 -179.797 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 61.9 mtm180 -76.11 -30.53 58.29 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.344 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.236 0.358 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.792 -179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 18.7 mmt . . . . . 0 C--O 1.235 0.297 0 CA-C-O 120.526 0.203 . . . . 0.0 110.954 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.463 HD13 ' HA ' ' A' ' 15' ' ' LEU . 2.5 mm? -79.83 139.65 37.12 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.0 t -42.22 121.5 1.9 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 -178.855 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.1 m -55.94 -22.58 26.99 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.318 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 60.9 p -81.18 -9.64 59.76 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 179.321 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 74.49 40.24 39.84 Favored Glycine 0 C--N 1.344 1.023 0 C-N-CA 121.457 -0.401 . . . . 0.0 112.357 179.344 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 24.2 p -86.62 -9.16 56.65 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 117.012 0.406 . . . . 0.0 112.066 179.339 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.21 -2.74 85.44 Favored Glycine 0 CA--C 1.537 1.441 0 CA-C-O 119.777 -0.457 . . . . 0.0 113.394 178.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.428 ' O ' HD13 ' A' ' 15' ' ' LEU . 67.2 m-85 -100.79 171.95 7.36 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 117.788 0.794 . . . . 0.0 110.533 -179.607 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -80.31 139.06 36.78 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.568 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -111.78 155.24 16.3 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 109.874 -1.291 . . . . 0.0 109.874 178.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.495 ' HB3' HG23 ' A' ' 28' ' ' THR . 1.9 t-20 -101.38 137.46 19.65 Favored Pre-proline 0 CA--C 1.537 0.47 0 CA-C-O 119.499 -0.286 . . . . 0.0 110.822 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -73.13 -27.28 14.01 Favored 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 121.848 1.699 . . . . 0.0 112.294 179.303 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.4 mmt180 -74.08 -26.9 60.63 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 123.041 0.213 . . . . 0.0 110.526 178.515 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.495 HG23 ' HB3' ' A' ' 25' ' ' ASN . 68.8 p -82.11 -150.49 0.09 Allowed 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 178.535 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 54.1 m-20 -91.21 28.3 1.67 Allowed 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 118.375 0.534 . . . . 0.0 110.891 178.681 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 76.01 17.51 80.0 Favored Glycine 0 CA--C 1.537 1.444 0 N-CA-C 111.702 -0.559 . . . . 0.0 111.702 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 48.6 mtt -123.16 170.34 10.33 Favored 'General case' 0 C--N 1.347 0.491 0 CA-C-N 117.291 0.546 . . . . 0.0 111.419 -179.538 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 31.2 p -77.62 -167.79 1.04 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.639 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.24 -44.41 59.54 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.672 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 18.1 t -62.78 -51.22 74.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -178.55 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 68.5 m -70.62 -34.55 72.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.944 -178.351 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.437 ' CE1' HD13 ' A' ' 40' ' ' LEU . 38.9 t80 -64.83 -32.92 74.84 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.46 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -77.87 -43.05 31.39 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.906 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -63.64 -45.21 91.24 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 120.869 0.366 . . . . 0.0 110.106 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 39.6 t60 -59.94 -44.86 94.12 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.701 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.437 HD13 ' CE1' ' A' ' 36' ' ' TYR . 1.0 OUTLIER -65.33 -29.33 70.05 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.634 -178.798 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -71.99 -31.48 66.28 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 120.934 -0.307 . . . . 0.0 110.315 179.302 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 39.2 ttt-85 -75.21 -31.44 60.89 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.172 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 . . . . . 0 CA--C 1.531 0.234 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.235 179.534 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 14.8 mmt . . . . . 0 C--O 1.233 0.213 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mp -76.65 144.28 39.57 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.254 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.5 t -48.79 123.71 7.37 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.9 m -65.32 -30.57 71.43 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.015 -179.335 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 51.0 p -64.81 -23.03 67.11 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -178.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 91.05 36.93 6.47 Favored Glycine 0 CA--C 1.526 0.76 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.132 179.066 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.9 p -84.81 -16.44 41.4 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 117.034 0.417 . . . . 0.0 110.91 178.442 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.49 12.68 66.72 Favored Glycine 0 C--N 1.349 1.298 0 CA-C-O 119.747 -0.474 . . . . 0.0 113.097 178.807 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -114.37 176.71 4.93 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 117.633 0.717 . . . . 0.0 111.833 -179.103 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 8.1 t80 -81.21 140.82 34.7 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.101 -0.954 . . . . 0.0 111.025 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -124.7 -176.51 14.62 Favored Glycine 0 CA--C 1.53 1.008 0 N-CA-C 111.054 -0.819 . . . . 0.0 111.054 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -130.13 139.25 35.08 Favored Pre-proline 0 N--CA 1.47 0.536 0 CA-C-O 119.548 -0.263 . . . . 0.0 111.389 -179.739 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -77.07 -14.89 16.64 Favored 'Trans proline' 0 N--CA 1.49 1.273 0 C-N-CA 121.994 1.796 . . . . 0.0 112.949 178.63 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -77.6 -35.87 52.41 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 178.348 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 66.6 p -72.52 -154.77 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 177.478 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -90.77 26.02 2.19 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.574 0.624 . . . . 0.0 111.622 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 84.31 8.27 83.75 Favored Glycine 0 CA--C 1.538 1.484 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.8 163.31 16.35 Favored 'General case' 0 C--N 1.346 0.413 0 CA-C-N 117.146 0.473 . . . . 0.0 110.987 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 30.8 p -76.04 -157.71 0.08 Allowed 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -74.77 -48.3 26.28 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -179.061 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.2 t -69.03 -55.69 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 -178.185 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 77.7 m -57.19 -35.47 69.65 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -178.395 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.429 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 30.5 t80 -59.03 -40.44 85.04 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 111.833 0.309 . . . . 0.0 111.833 -179.127 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.6 tttm -74.37 -45.39 47.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.825 0.345 . . . . 0.0 110.347 -179.233 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -56.25 -38.51 71.23 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -178.609 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.429 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.6 p-80 -86.4 -33.4 20.49 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 120.191 -0.603 . . . . 0.0 112.155 -178.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.0 tt -65.91 -30.63 71.25 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.804 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -58.77 -40.53 84.18 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.393 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -84.79 -29.56 25.33 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.894 179.144 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 . . . . . 0 N--CA 1.464 0.228 0 CA-C-O 120.96 0.409 . . . . 0.0 110.089 179.282 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 1.5 mtt . . . . . 0 CA--C 1.536 0.417 0 CA-C-O 121.068 0.461 . . . . 0.0 112.173 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -71.27 148.36 47.24 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.139 179.018 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 11.2 t -41.34 140.66 0.82 Allowed 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -179.035 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 68.7 m -63.81 -29.19 70.42 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.824 -179.314 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.5 p -88.17 -5.19 58.55 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -179.174 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 71.03 38.71 63.81 Favored Glycine 0 C--N 1.343 0.972 0 CA-C-O 119.931 -0.372 . . . . 0.0 113.099 178.437 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 32.0 p -78.68 -17.78 55.41 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 117.179 0.489 . . . . 0.0 111.887 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 105.03 1.26 41.9 Favored Glycine 0 CA--C 1.54 1.621 0 CA-C-O 119.711 -0.494 . . . . 0.0 113.243 179.291 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 67.1 m-85 -109.01 156.74 19.39 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 117.767 0.783 . . . . 0.0 110.685 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 26.4 t80 -65.25 146.17 55.29 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.289 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -109.04 163.43 12.59 Favored Glycine 0 CA--C 1.529 0.932 0 N-CA-C 110.257 -1.137 . . . . 0.0 110.257 179.131 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -113.21 136.22 21.8 Favored Pre-proline 0 CA--C 1.541 0.608 0 CA-C-O 119.276 -0.392 . . . . 0.0 110.098 -179.574 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -76.59 -22.73 11.88 Favored 'Trans proline' 0 N--CA 1.494 1.525 0 C-N-CA 122.052 1.835 . . . . 0.0 112.313 179.408 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 61.7 mtp180 -74.53 -33.57 62.8 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 178.016 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.8 p -82.12 -155.42 0.14 Allowed 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 178.156 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -89.56 24.94 2.12 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 118.623 0.647 . . . . 0.0 111.825 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.42 17.75 75.31 Favored Glycine 0 CA--C 1.54 1.604 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 -179.187 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 16.9 mtt -120.33 155.38 33.46 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-N 117.152 0.476 . . . . 0.0 110.772 -179.714 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 29.3 p -66.38 -162.72 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.105 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -74.12 -48.36 30.0 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -178.835 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 17.5 t -62.61 -56.63 16.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 116.301 -0.409 . . . . 0.0 112.053 -178.253 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.6 m -60.39 -33.49 72.56 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -178.269 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 30.2 t80 -65.25 -34.87 79.38 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -178.628 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 39.3 tttt -77.26 -47.86 19.02 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.159 -179.509 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -66.1 -42.98 88.52 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.421 -179.002 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -59.39 -49.27 78.44 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.877 -178.746 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.76 -29.27 70.5 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 -178.516 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -57.96 -40.65 81.09 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.47 0.176 . . . . 0.0 111.195 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.6 ptp180 -82.17 -30.84 30.77 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.952 179.44 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 . . . . . 0 N--CA 1.463 0.183 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.475 -179.303 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.389 0 CA-C-O 120.801 0.334 . . . . 0.0 110.427 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.549 HD23 ' O ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -79.19 145.21 33.78 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 179.864 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.7 t -51.29 124.26 11.38 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -178.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.8 m -64.6 -22.03 66.87 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.525 -0.761 . . . . 0.0 112.11 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 58.0 p -76.7 -19.54 57.59 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.65 43.19 6.56 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 121.168 -0.539 . . . . 0.0 112.081 179.412 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.9 p -88.37 -22.6 23.71 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 116.958 0.379 . . . . 0.0 111.706 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 98.65 6.94 56.13 Favored Glycine 0 CA--C 1.539 1.531 0 CA-C-O 119.707 -0.496 . . . . 0.0 113.6 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.549 ' O ' HD23 ' A' ' 15' ' ' LEU . 63.8 m-85 -108.36 -170.34 1.66 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 117.819 0.809 . . . . 0.0 111.13 -179.265 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -96.7 141.21 30.2 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.201 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -111.08 172.59 15.22 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 111.049 -0.821 . . . . 0.0 111.049 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -124.92 138.11 30.85 Favored Pre-proline 0 CA--C 1.54 0.571 0 CA-C-O 119.501 -0.285 . . . . 0.0 110.821 -179.558 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -75.79 -19.16 16.49 Favored 'Trans proline' 0 N--CA 1.498 1.748 0 C-N-CA 122.269 1.979 . . . . 0.0 112.488 178.797 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.0 mtt180 -75.96 -34.95 59.83 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 70.1 p -77.77 -154.41 0.07 Allowed 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.253 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -90.57 27.62 1.69 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.364 0.529 . . . . 0.0 111.718 179.825 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.26 10.88 85.59 Favored Glycine 0 CA--C 1.535 1.288 0 N-CA-C 111.6 -0.6 . . . . 0.0 111.6 -179.386 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.07 169.81 9.6 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 117.332 0.566 . . . . 0.0 111.097 -178.818 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 22.0 p -78.89 -162.03 0.35 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.124 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.76 -45.92 40.65 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -178.684 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.7 t -69.35 -56.82 10.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -178.175 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 72.3 m -56.77 -35.43 68.65 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.448 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -57.94 -37.91 74.98 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.778 -0.192 . . . . 0.0 111.166 -179.444 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.6 tttt -77.65 -45.48 24.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.897 0.379 . . . . 0.0 110.129 179.19 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -57.2 -40.86 78.26 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.878 0.695 . . . . 0.0 112.878 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 1.2 p80 -82.14 -33.85 29.41 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 120.102 -0.639 . . . . 0.0 111.398 -179.085 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.5 tp -64.28 -29.27 70.37 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.582 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -61.94 -40.95 97.3 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.605 0.24 . . . . 0.0 111.289 -179.493 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 36.9 ttt85 -84.13 -31.38 25.26 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.495 -179.675 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 . . . . . 0 N--CA 1.465 0.287 0 CA-C-O 120.575 0.226 . . . . 0.0 111.061 -179.68 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 6.7 mmt . . . . . 0 CA--C 1.532 0.27 0 CA-C-O 120.998 0.428 . . . . 0.0 110.63 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.07 146.75 41.23 Favored 'General case' 0 N--CA 1.461 0.086 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.8 t -48.96 124.59 8.95 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -178.593 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.5 m -62.68 -27.13 69.03 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.758 179.719 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 68.4 p -71.04 -20.88 62.33 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 84.8 34.09 16.65 Favored Glycine 0 C--N 1.342 0.899 0 N-CA-C 111.855 -0.498 . . . . 0.0 111.855 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.4 p -78.85 -17.12 56.17 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 179.573 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.53 6.34 59.76 Favored Glycine 0 CA--C 1.538 1.511 0 CA-C-O 119.678 -0.512 . . . . 0.0 113.708 178.542 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -116.45 167.64 10.86 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 117.936 0.868 . . . . 0.0 111.313 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -69.46 143.99 53.38 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.713 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -114.79 171.09 13.53 Favored Glycine 0 CA--C 1.531 1.041 0 N-CA-C 110.836 -0.905 . . . . 0.0 110.836 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -118.27 139.35 26.66 Favored Pre-proline 0 N--CA 1.471 0.608 0 CA-C-N 116.642 0.221 . . . . 0.0 111.265 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -78.68 -25.31 6.61 Favored 'Trans proline' 0 N--CA 1.489 1.245 0 C-N-CA 122.191 1.927 . . . . 0.0 113.195 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 33.1 mmt180 -74.15 -33.03 63.38 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 178.521 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 71.0 p -74.57 -155.92 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 177.614 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -90.01 26.07 1.95 Allowed 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 118.2 0.454 . . . . 0.0 111.446 179.641 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 81.83 10.91 83.5 Favored Glycine 0 CA--C 1.539 1.537 0 N-CA-C 111.429 -0.668 . . . . 0.0 111.429 -179.258 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.95 163.32 17.76 Favored 'General case' 0 C--N 1.346 0.436 0 CA-C-N 117.335 0.568 . . . . 0.0 110.538 -179.185 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 28.3 p -74.7 -158.59 0.08 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.773 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -75.36 -47.03 29.48 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.752 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 16.3 t -69.58 -51.03 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 CA-C-O 120.749 0.309 . . . . 0.0 111.311 -178.13 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.1 m -62.88 -37.75 88.14 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -178.405 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.433 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 26.1 t80 -59.22 -45.99 89.65 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -178.682 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 38.5 pttt -74.13 -44.08 55.12 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 120.479 -0.488 . . . . 0.0 110.206 -179.545 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -55.5 -36.51 66.75 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.433 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 0.7 OUTLIER -86.5 -33.79 20.22 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 120.161 -0.616 . . . . 0.0 112.361 -179.302 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 11.0 tp -62.51 -28.97 70.21 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 121.251 -0.18 . . . . 0.0 111.435 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -63.76 -38.74 92.25 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.407 -179.643 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 9.8 tpp180 -76.45 -29.35 56.92 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.701 179.039 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.533 0.315 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.488 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 3.7 mmt . . . . . 0 C--O 1.234 0.28 0 CA-C-O 120.859 0.361 . . . . 0.0 110.359 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.5 mp -74.17 146.78 43.17 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.233 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.3 t -46.6 131.53 11.22 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -179.228 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -61.55 -32.33 72.39 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.931 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 76.5 p -72.35 -13.98 61.62 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.242 178.555 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 74.59 42.4 32.87 Favored Glycine 0 C--N 1.345 1.081 0 N-CA-C 111.667 -0.573 . . . . 0.0 111.667 179.255 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 29.4 p -80.3 -15.87 55.93 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.914 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.3 2.72 61.88 Favored Glycine 0 CA--C 1.54 1.611 0 CA-C-O 119.971 -0.349 . . . . 0.0 113.073 179.291 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -102.96 -168.13 1.48 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 117.373 0.587 . . . . 0.0 109.837 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -98.9 142.01 30.95 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 110.755 -0.091 . . . . 0.0 110.755 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -108.2 164.56 12.77 Favored Glycine 0 CA--C 1.531 1.07 0 N-CA-C 111.414 -0.675 . . . . 0.0 111.414 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.492 ' HB3' HG23 ' A' ' 28' ' ' THR . 13.2 t-20 -119.22 122.72 29.29 Favored Pre-proline 0 CA--C 1.54 0.587 0 CA-C-O 119.195 -0.431 . . . . 0.0 111.135 -179.424 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -67.37 -16.35 47.68 Favored 'Trans proline' 0 N--CA 1.493 1.471 0 C-N-CA 121.775 1.65 . . . . 0.0 112.957 178.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -76.77 -35.58 57.61 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 177.759 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.492 HG23 ' HB3' ' A' ' 25' ' ' ASN . 46.6 p -72.08 -156.66 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 178.109 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -91.22 26.62 2.14 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 118.235 0.47 . . . . 0.0 112.09 179.507 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 90.15 8.74 66.3 Favored Glycine 0 CA--C 1.534 1.246 0 CA-C-O 119.793 -0.448 . . . . 0.0 112.104 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.64 165.68 18.12 Favored 'General case' 0 C--N 1.345 0.399 0 CA-C-N 117.697 0.749 . . . . 0.0 111.326 -179.097 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 24.3 p -73.22 -156.45 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.744 -178.893 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.3 -51.48 11.9 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -179.065 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.3 t -67.94 -56.6 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -177.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 81.8 m -58.39 -38.09 76.61 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -178.256 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -57.16 -39.71 75.8 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -178.895 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 9.6 ttpt -75.82 -45.07 37.98 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.121 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -55.11 -38.86 68.69 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -179.055 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -85.31 -32.38 22.52 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 120.136 -0.626 . . . . 0.0 111.278 -179.635 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 25.6 tp -61.53 -30.3 70.54 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.612 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 22.8 tt0 -56.57 -37.54 70.72 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 120.732 0.301 . . . . 0.0 111.183 -179.584 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 45.5 mmm-85 -79.04 -28.22 43.22 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.558 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 . . . . . 0 N--CA 1.466 0.336 0 O-C-N 123.051 0.219 . . . . 0.0 111.45 -179.748 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 12.5 mmt . . . . . 0 CA--C 1.534 0.353 0 CA-C-O 120.823 0.344 . . . . 0.0 111.286 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.7 mp -80.42 147.23 31.07 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 178.798 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.3 t -49.21 115.86 1.47 Allowed 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 121.24 0.543 . . . . 0.0 112.359 -178.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 66.8 m -60.52 -20.1 59.18 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.073 -0.967 . . . . 0.0 113.129 -178.636 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.42 HG23 ' SD ' ' A' ' 31' ' ' MET . 76.0 p -80.74 -11.96 59.54 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.828 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 97.98 40.42 3.55 Favored Glycine 0 C--N 1.346 1.093 0 C-N-CA 121.272 -0.489 . . . . 0.0 112.454 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.4 m -87.39 -28.55 22.09 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.808 0.304 . . . . 0.0 111.718 179.353 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.49 8.13 85.34 Favored Glycine 0 CA--C 1.541 1.675 0 N-CA-C 111.463 -0.655 . . . . 0.0 111.463 -177.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -106.24 -175.98 2.95 Favored 'General case' 0 C--N 1.346 0.435 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -94.03 142.01 27.88 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 120.887 0.375 . . . . 0.0 111.474 -179.752 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -113.18 169.46 12.95 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 109.967 -1.253 . . . . 0.0 109.967 179.135 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -112.66 138.65 22.13 Favored Pre-proline 0 CA--C 1.537 0.478 0 CA-C-O 119.646 -0.216 . . . . 0.0 110.577 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -73.48 -27.18 13.38 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 C-N-CA 122.019 1.813 . . . . 0.0 112.547 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 67.2 mtt180 -72.83 -36.07 67.41 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 178.272 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 60.3 p -75.66 -154.51 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.154 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.41 ' HB2' ' CD1' ' A' ' 36' ' ' TYR . 0.4 OUTLIER -90.37 29.48 1.26 Allowed 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.256 0.48 . . . . 0.0 112.153 -179.697 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.25 17.0 65.54 Favored Glycine 0 CA--C 1.535 1.327 0 C-N-CA 121.126 -0.559 . . . . 0.0 112.374 179.708 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' MET . . . . . 0.42 ' SD ' HG23 ' A' ' 18' ' ' THR . 15.3 mtt -124.26 179.7 4.79 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 117.339 0.57 . . . . 0.0 109.79 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 20.2 p -83.63 -175.61 5.9 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 122.966 0.166 . . . . 0.0 110.591 -179.256 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.61 -45.61 78.57 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -177.931 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 6.4 t -66.28 -37.17 79.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 CA-C-O 120.76 0.314 . . . . 0.0 111.361 -178.415 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 21.7 m -73.49 -40.08 64.37 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.326 -178.707 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' TYR . . . . . 0.43 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 18.4 t80 -61.82 -33.66 74.53 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -177.736 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.28 -45.85 18.92 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.472 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -62.88 -46.97 85.35 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -178.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' HIS . . . . . 0.43 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.7 p-80 -76.61 -40.5 49.23 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 119.964 -0.694 . . . . 0.0 112.375 -177.82 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 26.8 tp -60.45 -27.35 67.45 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 120.781 0.324 . . . . 0.0 110.827 178.32 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -66.77 -38.4 86.5 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.53 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -75.38 -30.09 60.06 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.741 -179.523 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 . . . . . 0 N--CA 1.465 0.278 0 CA-C-O 120.502 0.191 . . . . 0.0 110.984 179.745 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.536 0.404 0 CA-C-O 120.667 0.27 . . . . 0.0 110.451 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.438 HD12 ' HA ' ' A' ' 15' ' ' LEU . 5.4 tp -79.56 144.8 33.56 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.948 -0.301 . . . . 0.0 110.338 -179.499 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.3 t -37.21 117.46 0.54 Allowed 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -179.193 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 49.0 m -58.91 -26.29 64.19 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.412 179.426 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 19.7 p -83.28 -8.43 59.45 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 73.59 43.24 37.32 Favored Glycine 0 C--N 1.347 1.14 0 C-N-CA 121.307 -0.473 . . . . 0.0 112.666 178.786 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.4 p -85.04 -14.32 47.71 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 117.119 0.46 . . . . 0.0 111.83 179.428 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 96.7 2.72 59.75 Favored Glycine 0 CA--C 1.538 1.493 0 CA-C-O 119.39 -0.672 . . . . 0.0 113.901 178.341 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -105.91 -171.24 1.87 Allowed 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.304 1.052 . . . . 0.0 110.539 -178.821 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -96.71 143.73 27.38 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.873 0.368 . . . . 0.0 111.436 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -111.35 161.15 12.87 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 110.199 -1.16 . . . . 0.0 110.199 179.044 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.412 ' HB3' HG23 ' A' ' 28' ' ' THR . 24.7 t30 -107.33 137.33 19.59 Favored Pre-proline 0 CA--C 1.535 0.368 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.672 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -72.73 -28.05 14.3 Favored 'Trans proline' 0 N--CA 1.491 1.382 0 C-N-CA 121.754 1.636 . . . . 0.0 111.957 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -71.92 -31.69 66.62 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.234 178.515 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.412 HG23 ' HB3' ' A' ' 25' ' ' ASN . 68.5 p -77.1 -150.81 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 178.21 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -90.53 29.58 1.27 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.724 0.693 . . . . 0.0 111.121 179.362 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 73.74 18.22 79.46 Favored Glycine 0 CA--C 1.533 1.187 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -178.766 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 10.7 mtt -128.84 172.36 11.38 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-N 116.905 0.353 . . . . 0.0 110.398 -179.256 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 57.9 m -60.89 172.26 1.01 Allowed 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.115 -179.145 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 35.6 m -72.01 -46.32 57.6 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 179.379 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 16.0 t -70.4 -36.72 67.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 116.097 -0.502 . . . . 0.0 109.89 179.516 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 80.2 m -72.19 -37.24 69.34 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.654 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -58.1 -33.13 68.77 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.736 -179.617 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.9 tttt -77.96 -44.15 27.65 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.037 0.446 . . . . 0.0 110.173 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -56.57 -40.83 75.87 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.844 -178.542 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 3.6 p80 -85.01 -33.63 22.51 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 120.321 -0.551 . . . . 0.0 112.162 -178.579 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.3 tp -60.79 -30.79 70.26 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 122.922 0.139 . . . . 0.0 111.219 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -68.64 -35.39 77.21 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.766 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.1 mmm-85 -71.68 -29.94 65.15 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.616 -179.477 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 . . . . . 0 N--CA 1.466 0.335 0 C-N-CA 121.254 -0.178 . . . . 0.0 111.375 -179.681 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 6.8 mmt . . . . . 0 CA--C 1.534 0.334 0 CA-C-O 120.87 0.367 . . . . 0.0 110.805 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -78.52 146.16 34.49 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.688 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.3 t -42.64 117.98 1.13 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -178.817 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.34 -23.68 50.41 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.72 179.285 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 46.4 p -81.33 -12.22 59.09 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -179.351 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.11 43.4 10.8 Favored Glycine 0 C--N 1.344 1.003 0 C-N-CA 121.255 -0.498 . . . . 0.0 112.58 178.757 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 3.7 p -87.44 -15.56 37.37 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 117.252 0.526 . . . . 0.0 111.989 179.391 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 92.71 4.35 65.58 Favored Glycine 0 CA--C 1.54 1.623 0 CA-C-O 119.639 -0.534 . . . . 0.0 114.071 178.144 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 36.7 m-85 -106.12 -169.53 1.59 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 117.944 0.872 . . . . 0.0 110.062 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -96.45 141.38 29.81 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.143 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -116.52 171.92 13.99 Favored Glycine 0 CA--C 1.529 0.956 0 N-CA-C 110.554 -1.019 . . . . 0.0 110.554 179.011 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -122.53 143.12 38.98 Favored Pre-proline 0 CA--C 1.538 0.497 0 CA-C-N 116.82 0.31 . . . . 0.0 111.181 -179.029 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -77.01 -21.76 11.97 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 C-N-CA 122.122 1.881 . . . . 0.0 113.122 179.302 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 5.9 mpt_? -73.98 -34.94 64.4 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 64.4 p -74.25 -156.69 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 178.027 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -91.52 25.5 2.62 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 118.379 0.536 . . . . 0.0 111.596 179.589 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.63 13.64 69.68 Favored Glycine 0 CA--C 1.538 1.476 0 N-CA-C 112.041 -0.424 . . . . 0.0 112.041 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.51 165.91 17.62 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-N 117.483 0.642 . . . . 0.0 111.387 -179.25 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 60.7 m -57.34 178.2 0.08 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.788 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 13.2 m -71.76 -43.0 66.53 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 16.2 t -73.98 -37.49 47.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.733 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 71.2 m -72.03 -38.14 69.62 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.715 -179.348 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -55.93 -38.68 70.61 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-O 120.625 0.25 . . . . 0.0 111.072 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.9 tttt -76.96 -43.9 33.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.955 -179.846 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -55.95 -40.01 72.57 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.744 -178.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -84.02 -32.73 24.75 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 120.087 -0.645 . . . . 0.0 111.414 -179.529 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 15.1 tp -60.21 -26.46 66.4 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.747 -0.206 . . . . 0.0 111.392 179.589 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -69.51 -37.81 77.34 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.461 0.172 . . . . 0.0 110.665 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.7 -32.27 60.02 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.7 179.812 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 . . . . . 0 C--O 1.232 0.176 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.985 -179.959 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.303 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.8 m -83.1 -53.81 5.52 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.612 0.244 . . . . 0.0 110.538 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 10.6 ptt? -69.83 156.09 39.57 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.806 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -128.58 32.69 4.78 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.734 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -110.92 33.27 4.69 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.986 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -105.67 97.76 7.55 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.658 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.0 m -97.91 122.63 41.25 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.406 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -115.41 -44.83 2.95 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.648 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -139.43 153.71 47.64 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.331 179.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 6.8 t -95.86 145.78 30.16 Favored Pre-proline 0 CA--C 1.537 0.466 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.584 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -90.86 160.18 4.06 Favored 'Trans proline' 0 N--CA 1.483 0.873 0 C-N-CA 122.531 2.154 . . . . 0.0 111.379 179.304 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.407 ' N ' ' CD ' ' A' ' 13' ' ' PRO . . . 83.72 44.11 6.97 Favored Glycine 0 CA--C 1.538 1.51 0 CA-C-O 119.252 -0.749 . . . . 0.0 112.393 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.407 ' CD ' ' N ' ' A' ' 12' ' ' GLY . 58.7 Cg_endo -72.49 84.42 1.19 Allowed 'Trans proline' 0 N--CA 1.494 1.538 0 CA-C-N 119.702 1.751 . . . . 0.0 111.099 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 4.5 mmt -71.7 66.04 0.52 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.372 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -75.02 144.92 42.85 Favored 'General case' 0 CA--C 1.527 0.094 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 8.7 t -49.78 128.06 17.34 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 112.27 0.471 . . . . 0.0 112.27 -179.022 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 28.5 m -63.71 -30.21 71.34 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.822 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 80.5 p -73.61 -19.01 60.98 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.03 43.12 6.82 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 121.216 -0.516 . . . . 0.0 112.863 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.8 p -85.7 -22.35 27.87 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 117.286 0.543 . . . . 0.0 111.108 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.28 8.08 50.77 Favored Glycine 0 CA--C 1.537 1.433 0 CA-C-O 119.85 -0.417 . . . . 0.0 113.165 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -114.3 159.37 20.28 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 117.673 0.737 . . . . 0.0 110.425 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.7 t80 -67.57 146.66 53.68 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.98 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -118.43 -179.08 17.07 Favored Glycine 0 CA--C 1.53 0.975 0 N-CA-C 110.526 -1.029 . . . . 0.0 110.526 179.676 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.3 t30 -126.94 138.88 33.57 Favored Pre-proline 0 N--CA 1.47 0.568 0 CA-C-O 119.466 -0.302 . . . . 0.0 110.528 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -77.11 -22.65 11.12 Favored 'Trans proline' 0 N--CA 1.489 1.206 0 C-N-CA 121.922 1.748 . . . . 0.0 112.53 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 28.2 mtm180 -71.17 -34.14 70.65 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 67.2 p -74.55 -157.49 0.06 Allowed 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 107.594 -1.262 . . . . 0.0 107.594 177.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -90.94 25.41 2.42 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 118.333 0.515 . . . . 0.0 111.208 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 82.52 10.6 83.18 Favored Glycine 0 CA--C 1.541 1.676 0 N-CA-C 111.65 -0.58 . . . . 0.0 111.65 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 3.0 mpp? -115.24 156.42 25.41 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 117.195 0.498 . . . . 0.0 110.448 -179.418 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 22.9 p -69.98 -160.63 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.036 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.47 -48.3 28.18 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -178.758 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 8.3 t -68.81 -56.92 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 N-CA-C 111.727 0.269 . . . . 0.0 111.727 -177.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 81.2 m -57.82 -35.32 70.71 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -178.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -62.96 -31.09 72.12 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 121.347 -0.141 . . . . 0.0 111.295 -179.29 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.7 tttt -75.67 -48.61 21.33 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.72 0.295 . . . . 0.0 110.717 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -63.31 -42.34 99.02 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.138 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 63.9 t60 -63.95 -48.37 76.79 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.621 -179.069 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 tp -63.63 -30.4 71.51 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 111.627 0.232 . . . . 0.0 111.627 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -65.03 -40.95 95.58 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 120.85 0.357 . . . . 0.0 110.329 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.87 -31.46 64.74 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.117 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -75.29 -39.4 59.69 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.573 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -66.61 -38.02 86.11 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.212 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -62.96 -27.82 69.66 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.656 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 6.8 t -67.56 -63.03 1.14 Allowed 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.72 -0.218 . . . . 0.0 110.724 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.99 -56.3 4.04 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -88.76 76.82 7.96 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 120.93 0.395 . . . . 0.0 110.458 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 17.8 ptt? -84.89 118.67 24.66 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.708 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.8 m -157.19 94.27 2.21 Favored Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.676 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -82.99 84.19 1.79 Allowed 'Trans proline' 0 N--CA 1.489 1.243 0 C-N-CA 122.402 2.068 . . . . 0.0 112.115 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.2 tpp -143.09 39.46 1.46 Allowed 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.419 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 83.56 -67.06 3.8 Favored Glycine 0 CA--C 1.527 0.836 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.0 t -109.86 166.91 10.56 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.684 0.278 . . . . 0.0 110.436 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -144.67 137.67 26.77 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.425 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 40.8 t -83.14 151.42 25.72 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.591 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 81.32 79.66 0.92 Allowed Glycine 0 CA--C 1.526 0.762 0 N-CA-C 110.877 -0.889 . . . . 0.0 110.877 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.1 t -139.99 34.5 1.95 Allowed 'General case' 0 C--O 1.236 0.39 0 CA-C-O 120.825 0.345 . . . . 0.0 110.712 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -83.57 152.26 24.95 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.522 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.0 t -145.93 86.86 6.98 Favored Pre-proline 0 CA--C 1.538 0.511 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.558 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -59.91 148.19 89.65 Favored 'Trans proline' 0 N--CA 1.499 1.844 0 C-N-CA 122.281 1.987 . . . . 0.0 111.936 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.7 p . . . . . 0 C--O 1.221 -0.43 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.516 -179.885 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.304 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.7 p -80.89 139.85 35.68 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 110.412 -0.218 . . . . 0.0 110.412 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 25.9 mmt -92.18 87.06 5.96 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.652 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -137.04 32.03 2.66 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.888 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -122.15 32.83 5.67 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.879 0.371 . . . . 0.0 110.654 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -71.5 -179.26 2.45 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.648 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.2 p -83.26 121.99 27.84 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.37 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -97.64 -30.28 12.93 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.303 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.465 ' O ' HG23 ' A' ' 10' ' ' THR . 15.0 mm100 -64.24 97.57 0.19 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.762 -0.199 . . . . 0.0 110.704 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.465 HG23 ' O ' ' A' ' 9' ' ' GLN . 2.8 p -155.99 157.32 31.26 Favored Pre-proline 0 CA--C 1.537 0.453 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.643 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -60.53 151.76 73.07 Favored 'Trans proline' 0 N--CA 1.501 1.944 0 C-N-CA 122.497 2.131 . . . . 0.0 112.178 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 169.08 -59.21 0.2 Allowed Glycine 0 CA--C 1.536 1.374 0 CA-C-O 119.362 -0.688 . . . . 0.0 111.769 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -59.33 84.53 0.06 OUTLIER 'Trans proline' 0 N--CA 1.503 2.05 0 C-N-CA 122.229 1.953 . . . . 0.0 112.888 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.04 89.51 0.81 Allowed 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.17 179.494 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.2 mp -75.05 146.58 41.42 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.193 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.2 t -46.7 137.08 7.29 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -179.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.5 m -65.95 -33.94 76.96 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.008 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 79.8 p -70.19 -13.43 62.18 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.309 -0.405 . . . . 0.0 112.084 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.26 25.61 63.4 Favored Glycine 0 CA--C 1.531 1.039 0 N-CA-C 112.133 -0.387 . . . . 0.0 112.133 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.7 p -65.91 -19.3 65.82 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 117.277 0.538 . . . . 0.0 111.832 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.45 8.06 58.8 Favored Glycine 0 CA--C 1.538 1.477 0 CA-C-O 119.863 -0.409 . . . . 0.0 112.967 179.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 44.4 m-85 -104.39 -173.07 2.22 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 117.506 0.653 . . . . 0.0 110.628 -179.03 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -97.05 142.33 29.12 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.78 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -113.89 176.13 16.9 Favored Glycine 0 CA--C 1.531 1.046 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -126.02 141.28 39.11 Favored Pre-proline 0 CA--C 1.54 0.586 0 CA-C-O 119.488 -0.291 . . . . 0.0 110.903 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -75.22 -24.16 12.74 Favored 'Trans proline' 0 N--CA 1.496 1.626 0 C-N-CA 122.234 1.956 . . . . 0.0 112.787 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 28.5 mtt-85 -72.59 -32.01 65.64 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 178.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.4 p -81.03 -152.98 0.09 Allowed 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 177.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -92.33 28.5 1.92 Allowed 'General case' 0 C--O 1.236 0.382 0 CA-C-N 118.166 0.439 . . . . 0.0 111.53 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 76.34 12.72 84.01 Favored Glycine 0 CA--C 1.537 1.452 0 C-N-CA 121.094 -0.574 . . . . 0.0 111.837 -179.245 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 14.7 mtt -118.33 168.31 10.74 Favored 'General case' 0 C--N 1.347 0.484 0 CA-C-N 117.568 0.684 . . . . 0.0 111.168 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 20.7 p -78.43 -164.1 0.52 Allowed 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.392 -178.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.27 -45.39 48.04 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -178.474 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 21.3 t -70.71 -57.19 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 83.5 m -58.99 -35.16 72.76 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -178.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -66.74 -29.88 69.96 Favored 'General case' 0 N--CA 1.467 0.417 0 O-C-N 123.074 0.234 . . . . 0.0 111.602 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.5 tttt -76.0 -48.04 22.58 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.594 0.235 . . . . 0.0 110.641 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -62.46 -37.78 87.24 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.741 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 32.4 t60 -61.05 -49.02 79.07 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.281 -179.192 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.3 mp -59.45 -27.99 66.57 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.668 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 4.5 tp60 -60.02 -43.01 95.55 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 120.367 0.127 . . . . 0.0 111.336 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -69.24 -29.63 67.6 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.219 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -65.27 -41.66 94.0 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 120.567 0.222 . . . . 0.0 111.233 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -83.71 17.74 2.18 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -178.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -58.72 -33.39 70.15 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 118.403 0.547 . . . . 0.0 110.85 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 32.7 t -83.57 -62.2 1.64 Allowed 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.448 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.02 -48.84 1.77 Allowed Glycine 0 CA--C 1.528 0.862 0 N-CA-C 112.003 -0.439 . . . . 0.0 112.003 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 68.2 mtm180 -78.05 171.49 14.94 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.587 0.232 . . . . 0.0 110.753 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 12.5 mtt -75.42 -43.88 47.49 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.202 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 10.5 p -131.89 154.38 81.72 Favored Pre-proline 0 CA--C 1.535 0.37 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.813 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -80.11 -169.64 0.84 Allowed 'Trans proline' 0 N--CA 1.493 1.464 0 C-N-CA 122.432 2.088 . . . . 0.0 112.374 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 3.1 ttt -141.52 -55.68 0.47 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.716 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 135.62 -58.31 0.67 Allowed Glycine 0 CA--C 1.526 0.776 0 N-CA-C 110.81 -0.916 . . . . 0.0 110.81 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.9 m -144.46 160.39 41.16 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 110.45 -0.204 . . . . 0.0 110.45 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -82.07 113.77 20.17 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.502 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 57.1 p -119.17 -178.55 3.6 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.283 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.09 58.85 1.2 Allowed Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 10.2 t -147.19 32.72 0.9 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 120.77 0.319 . . . . 0.0 110.912 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -103.8 152.23 22.13 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.457 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.4 m -126.09 91.12 48.74 Favored Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.416 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -81.13 120.19 3.67 Favored 'Trans proline' 0 N--CA 1.492 1.42 0 C-N-CA 122.374 2.049 . . . . 0.0 112.287 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 3.7 m . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.544 179.878 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.463 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 61.3 m -85.77 -36.74 19.93 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.453 0.168 . . . . 0.0 110.835 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 39.1 mtp -137.33 -54.81 0.69 Allowed 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.74 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -133.19 -62.41 0.8 Allowed 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.545 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 14.0 tt0 -133.54 -56.2 0.89 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.472 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -134.96 179.38 6.35 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.414 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -88.72 156.52 18.94 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.669 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -106.26 28.51 7.65 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.382 -179.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -106.14 177.49 4.84 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.641 0.257 . . . . 0.0 110.888 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.2 t -149.69 147.0 21.6 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.342 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -83.3 127.76 4.64 Favored 'Trans proline' 0 N--CA 1.491 1.361 0 C-N-CA 122.419 2.08 . . . . 0.0 112.313 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 83.07 45.44 6.63 Favored Glycine 0 CA--C 1.537 1.438 0 CA-C-O 119.105 -0.831 . . . . 0.0 112.288 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.82 73.66 4.15 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 CA-C-N 119.829 1.815 . . . . 0.0 111.141 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 14.9 mtt -70.11 73.73 0.47 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.509 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.514 HD13 ' O ' ' A' ' 22' ' ' PHE . 2.6 mm? -74.21 146.07 43.65 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.627 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.8 t -45.53 137.81 4.82 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -179.261 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 66.6 m -69.95 -24.53 63.36 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.811 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 75.0 p -80.48 -17.99 49.98 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.43 31.14 22.85 Favored Glycine 0 C--N 1.34 0.762 0 C-N-CA 121.117 -0.564 . . . . 0.0 112.401 179.162 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.5 p -72.96 -19.79 61.17 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.904 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 97.17 10.46 54.51 Favored Glycine 0 CA--C 1.538 1.491 0 CA-C-O 119.778 -0.457 . . . . 0.0 113.035 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.514 ' O ' HD13 ' A' ' 15' ' ' LEU . 75.8 m-85 -117.06 166.0 12.72 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 117.707 0.753 . . . . 0.0 111.335 -179.597 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -67.48 145.74 54.66 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.303 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -110.58 163.72 12.3 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.498 ' HB3' HG23 ' A' ' 28' ' ' THR . 22.7 t30 -113.06 126.45 28.21 Favored Pre-proline 0 CA--C 1.539 0.556 0 CA-C-O 119.379 -0.343 . . . . 0.0 110.236 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.08 -16.63 28.67 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 121.825 1.684 . . . . 0.0 113.073 179.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 50.0 mtt180 -76.89 -35.01 57.71 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 177.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.498 HG23 ' HB3' ' A' ' 25' ' ' ASN . 42.9 p -73.03 -154.77 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 178.197 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -90.83 27.52 1.77 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.17 0.441 . . . . 0.0 111.253 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 84.94 10.89 77.84 Favored Glycine 0 CA--C 1.537 1.418 0 N-CA-C 111.714 -0.554 . . . . 0.0 111.714 -179.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.92 163.49 19.18 Favored 'General case' 0 C--N 1.344 0.336 0 CA-C-N 117.039 0.419 . . . . 0.0 110.645 -179.296 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 23.9 p -72.16 -158.31 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.71 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.21 -51.49 11.99 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -178.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 10.8 t -66.2 -54.83 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 N-CA-C 111.56 0.208 . . . . 0.0 111.56 -178.12 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 75.9 m -58.35 -36.14 73.0 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -178.359 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -57.39 -41.36 80.12 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 111.512 0.19 . . . . 0.0 111.512 -179.161 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.6 ttpt -75.14 -45.45 40.78 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.918 0.39 . . . . 0.0 110.343 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 -54.75 -39.76 68.64 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.802 -0.635 . . . . 0.0 112.525 -179.034 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -84.6 -32.74 23.58 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.358 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.0 tp -61.69 -27.28 68.58 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.889 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -69.08 -38.94 79.27 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 26.5 mtt-85 -70.83 -30.71 67.21 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.82 179.346 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -72.6 -34.23 67.25 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.803 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -76.31 -34.02 59.03 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.824 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 6.2 m-80 -65.68 -17.94 64.97 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.7 m -67.37 -34.4 77.22 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 121.132 -0.227 . . . . 0.0 110.973 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 66.91 61.16 5.45 Favored Glycine 0 CA--C 1.528 0.863 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 74.5 mtm180 -87.94 -40.9 13.54 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.451 0.167 . . . . 0.0 111.033 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 8.7 ttt -112.8 35.3 3.94 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.858 0.361 . . . . 0.0 110.539 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.2 p -148.37 158.03 41.38 Favored Pre-proline 0 CA--C 1.536 0.414 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.521 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.62 150.96 28.27 Favored 'Trans proline' 0 N--CA 1.494 1.502 0 C-N-CA 122.291 1.994 . . . . 0.0 111.968 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -143.01 164.58 29.69 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.428 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 103.08 -59.98 0.51 Allowed Glycine 0 CA--C 1.527 0.818 0 N-CA-C 110.783 -0.927 . . . . 0.0 110.783 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 41.3 p -83.2 112.03 19.48 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 110.451 -0.203 . . . . 0.0 110.451 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -93.5 163.51 13.54 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.907 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 72.3 p -146.74 34.79 0.93 Allowed 'General case' 0 C--O 1.237 0.428 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.693 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 84.61 48.55 4.95 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 110.69 -0.964 . . . . 0.0 110.69 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.1 p -149.2 33.93 0.73 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 120.793 0.33 . . . . 0.0 110.597 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -76.2 132.66 40.06 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.636 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.7 m -88.31 154.5 51.61 Favored Pre-proline 0 CA--C 1.533 0.317 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.263 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -76.55 157.75 36.23 Favored 'Trans proline' 0 N--CA 1.494 1.541 0 C-N-CA 122.283 1.988 . . . . 0.0 112.057 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 44.4 p . . . . . 0 C--O 1.22 -0.482 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.506 179.995 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.312 0 N-CA-C 109.408 -1.477 . . . . 0.0 109.408 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.2 t -85.33 -57.72 2.96 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 13.3 mmt -88.9 104.34 16.85 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.397 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -137.74 33.64 2.44 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.697 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -93.28 -55.18 3.4 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.397 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -76.79 175.47 9.4 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.478 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 41.1 p -91.83 -176.41 4.44 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.427 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -91.06 -46.03 8.36 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.187 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -89.21 107.16 18.9 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.447 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.5 p -144.8 96.01 5.17 Favored Pre-proline 0 CA--C 1.536 0.439 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.163 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.26 107.99 0.36 Allowed 'Trans proline' 0 N--CA 1.5 1.87 0 C-N-CA 122.093 1.862 . . . . 0.0 111.987 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -161.68 -62.99 0.02 OUTLIER Glycine 0 CA--C 1.535 1.293 0 N-CA-C 110.908 -0.877 . . . . 0.0 110.908 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -60.03 87.97 0.07 OUTLIER 'Trans proline' 0 N--CA 1.5 1.875 0 C-N-CA 122.41 2.074 . . . . 0.0 112.104 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 29.7 mmm -71.68 84.14 0.88 Allowed 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.7 mp -79.31 145.43 33.48 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.717 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 8.8 t -45.34 131.54 8.1 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -178.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.0 m -62.59 -24.84 67.77 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.215 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 33.7 p -81.2 -10.62 59.59 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -178.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 78.12 25.48 61.76 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.53 179.428 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.6 p -67.45 -15.57 63.74 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-N 117.324 0.562 . . . . 0.0 111.279 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.15 8.87 68.18 Favored Glycine 0 CA--C 1.535 1.321 0 CA-C-O 119.997 -0.335 . . . . 0.0 113.206 179.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -106.15 -173.6 2.34 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 117.31 0.555 . . . . 0.0 110.303 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -93.14 141.71 28.12 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.865 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -112.75 169.32 12.94 Favored Glycine 0 CA--C 1.528 0.887 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 179.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -115.61 138.42 23.82 Favored Pre-proline 0 CA--C 1.541 0.632 0 CA-C-O 119.65 -0.214 . . . . 0.0 110.673 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -76.65 -25.92 8.9 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 122.49 2.126 . . . . 0.0 112.588 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 13.9 mtt-85 -73.84 -29.26 62.03 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.194 178.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 67.9 p -85.49 -150.43 0.13 Allowed 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 177.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -91.7 28.08 1.87 Allowed 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 118.791 0.723 . . . . 0.0 111.623 179.37 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 74.56 16.41 80.12 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 121.255 -0.498 . . . . 0.0 111.972 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 35.0 mtt -117.45 163.81 15.83 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 117.339 0.57 . . . . 0.0 109.903 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 31.3 p -73.76 -163.82 0.19 Allowed 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.774 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.47 -41.97 62.5 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.315 0.857 . . . . 0.0 113.315 -178.23 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 10.1 t -72.52 -49.81 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-O 120.785 0.326 . . . . 0.0 110.869 -178.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 72.5 m -65.41 -36.2 83.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.538 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -65.76 -36.8 84.58 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.12 -44.62 46.03 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.266 -0.574 . . . . 0.0 109.716 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -65.35 -43.26 91.39 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 123.146 0.279 . . . . 0.0 111.24 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 41.6 t-80 -59.52 -49.25 78.49 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -178.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.04 -25.94 65.73 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.005 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -64.41 -39.64 94.23 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 111.566 0.21 . . . . 0.0 111.566 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 10.4 mtt-85 -74.85 -30.51 61.37 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.15 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -71.03 -38.63 72.58 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.537 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.9 tt0 -72.37 -37.85 68.67 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.538 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 61.3 m-20 -80.15 -5.24 55.68 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 41.4 t -59.27 -53.7 55.28 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 117.768 0.258 . . . . 0.0 111.237 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 134.93 68.22 0.07 OUTLIER Glycine 0 CA--C 1.527 0.812 0 N-CA-C 111.14 -0.784 . . . . 0.0 111.14 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.3 mtt85 -106.52 37.33 2.34 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 120.969 0.414 . . . . 0.0 110.491 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 9.5 tpt -111.77 -55.98 2.44 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.857 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.9 m -92.49 165.19 20.0 Favored Pre-proline 0 CA--C 1.536 0.438 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.744 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -57.57 -62.8 0.18 Allowed 'Trans proline' 0 N--CA 1.5 1.901 0 C-N-CA 122.305 2.003 . . . . 0.0 112.382 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 18.5 ttt -83.01 -62.85 1.49 Allowed 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.624 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 139.26 -67.68 0.51 Allowed Glycine 0 CA--C 1.526 0.744 0 N-CA-C 111.059 -0.817 . . . . 0.0 111.059 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.8 p -101.63 147.55 26.3 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.546 0.212 . . . . 0.0 110.58 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -85.41 -44.9 12.37 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.443 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.9 t -96.4 -41.01 8.82 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.466 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 70.22 73.99 0.71 Allowed Glycine 0 CA--C 1.526 0.745 0 N-CA-C 111.028 -0.829 . . . . 0.0 111.028 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.0 m -103.73 34.51 2.96 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 120.86 0.362 . . . . 0.0 110.741 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -107.25 143.8 34.96 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.641 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 13.5 p -160.65 159.78 25.61 Favored Pre-proline 0 CA--C 1.535 0.371 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.574 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -55.35 177.73 0.11 Allowed 'Trans proline' 0 N--CA 1.502 1.99 0 C-N-CA 122.396 2.064 . . . . 0.0 112.449 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 4.7 t . . . . . 0 C--O 1.22 -0.449 0 CA-C-O 117.954 -1.022 . . . . 0.0 110.575 179.995 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.316 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.5 t -84.8 127.69 34.25 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.592 0.234 . . . . 0.0 110.522 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 30.1 tpp -82.61 97.94 8.74 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.604 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -136.58 -62.72 0.64 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.557 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -100.34 34.73 2.29 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.749 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -103.87 124.91 49.81 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.428 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 15.9 p -71.7 156.98 38.75 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.989 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -103.09 31.08 4.43 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.892 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -139.11 115.07 10.17 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.64 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 53.2 p -106.37 135.2 19.51 Favored Pre-proline 0 CA--C 1.539 0.525 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.132 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -81.91 123.5 4.15 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 C-N-CA 122.254 1.969 . . . . 0.0 112.296 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 164.89 -54.96 0.27 Allowed Glycine 0 CA--C 1.535 1.334 0 C-N-CA 121.059 -0.591 . . . . 0.0 111.795 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -78.85 82.95 2.36 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 122.274 1.983 . . . . 0.0 112.497 -179.243 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 12.3 mmt -72.29 82.29 1.03 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.24 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mp -76.11 143.56 41.19 Favored 'General case' 0 C--O 1.232 0.144 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.5 t -40.05 131.48 1.99 Allowed 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 -178.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 47.7 m -65.36 -26.2 67.92 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.16 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 51.9 p -78.96 -12.91 60.05 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 121.186 -0.206 . . . . 0.0 111.377 179.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 78.38 37.13 28.57 Favored Glycine 0 C--N 1.349 1.292 0 CA-C-O 119.808 -0.44 . . . . 0.0 113.375 178.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 29.1 p -77.56 -7.98 57.14 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 117.258 0.529 . . . . 0.0 111.801 178.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 85.4 5.94 84.43 Favored Glycine 0 CA--C 1.538 1.507 0 CA-C-O 119.774 -0.459 . . . . 0.0 113.207 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -109.79 172.02 7.1 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 117.679 0.739 . . . . 0.0 109.995 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -78.49 145.7 34.81 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.155 -178.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -118.59 169.35 13.43 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -112.27 141.81 25.77 Favored Pre-proline 0 N--CA 1.471 0.597 0 CA-C-N 116.73 0.265 . . . . 0.0 110.774 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.0 -29.35 6.78 Favored 'Trans proline' 0 N--CA 1.495 1.565 0 C-N-CA 122.082 1.854 . . . . 0.0 112.307 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -71.72 -27.28 62.91 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 178.234 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 71.0 p -83.6 -152.74 0.13 Allowed 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.412 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -90.87 26.72 2.0 Allowed 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 118.236 0.471 . . . . 0.0 111.238 179.32 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 72.97 15.53 78.41 Favored Glycine 0 CA--C 1.536 1.4 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 -177.826 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.7 mtp -121.65 163.41 19.02 Favored 'General case' 0 C--N 1.347 0.491 0 CA-C-N 117.085 0.443 . . . . 0.0 109.94 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 29.9 p -74.57 -167.39 0.55 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.911 -178.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.15 -37.68 61.24 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 -177.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.0 t -72.13 -49.42 43.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-O 120.579 0.228 . . . . 0.0 111.247 -177.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 67.4 m -70.27 -34.45 72.81 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.73 -178.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -69.47 -27.51 65.28 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 119.447 -0.311 . . . . 0.0 111.293 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt -78.12 -45.99 21.87 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 117.992 0.36 . . . . 0.0 110.041 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -64.7 -38.87 92.48 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.587 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 54.3 t60 -66.12 -41.41 90.58 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.096 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.2 tp -71.61 -42.22 67.95 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.132 -178.204 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -65.09 -35.83 82.39 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.865 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 11.2 ttt180 -77.14 -28.48 54.28 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.722 178.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -76.83 -35.6 57.43 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.749 -0.205 . . . . 0.0 111.067 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -77.8 -22.51 49.95 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -178.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -57.9 -39.29 77.56 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -178.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.5 t -136.33 -56.01 0.75 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 120.498 0.189 . . . . 0.0 111.108 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 70.29 51.12 23.72 Favored Glycine 0 CA--C 1.528 0.856 0 N-CA-C 110.583 -1.007 . . . . 0.0 110.583 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -119.53 157.8 27.61 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.5 mtt -69.72 111.67 5.66 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.3 p -147.8 157.5 43.84 Favored Pre-proline 0 CA--C 1.534 0.361 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.004 -179.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -67.08 165.55 26.05 Favored 'Trans proline' 0 N--CA 1.498 1.74 0 C-N-CA 122.278 1.985 . . . . 0.0 112.189 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 9.9 ptt? -64.66 -33.58 76.27 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.97 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 88.77 -67.97 2.9 Favored Glycine 0 CA--C 1.526 0.729 0 N-CA-C 111.293 -0.723 . . . . 0.0 111.293 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.0 m -80.95 138.43 36.1 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.625 0.25 . . . . 0.0 110.86 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -74.89 161.69 29.3 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.404 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.8 t -86.38 -178.96 6.57 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.54 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 74.35 47.78 16.1 Favored Glycine 0 CA--C 1.528 0.856 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 88.1 p -86.93 -40.57 14.7 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.548 0.213 . . . . 0.0 110.453 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 58.2 m-80 -82.89 124.76 30.64 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.512 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 68.0 m -158.09 158.56 30.07 Favored Pre-proline 0 CA--C 1.533 0.325 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.445 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -56.58 138.53 85.01 Favored 'Trans proline' 0 N--CA 1.5 1.912 0 C-N-CA 122.341 2.027 . . . . 0.0 112.288 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 5.1 t . . . . . 0 C--O 1.22 -0.485 0 CA-C-O 117.982 -1.008 . . . . 0.0 110.619 -179.997 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.39 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.1 t -137.53 104.77 5.44 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 110.544 -0.169 . . . . 0.0 110.544 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 63.2 mtp -101.39 94.12 5.76 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.575 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -116.3 -35.55 4.29 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.255 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -67.18 -34.58 77.82 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.438 -179.371 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -96.37 53.08 1.29 Allowed 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.256 0.55 . . . . 0.0 111.14 -179.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 80.6 p -146.07 153.69 41.0 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.198 179.382 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -68.63 -49.88 55.73 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.216 179.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 21.3 pt20 -120.98 175.67 5.94 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.035 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 58.7 p -140.61 89.98 10.11 Favored Pre-proline 0 CA--C 1.538 0.489 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.592 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_exo -67.11 137.21 43.41 Favored 'Trans proline' 0 N--CA 1.498 1.766 0 C-N-CA 122.304 2.003 . . . . 0.0 111.781 179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 170.26 -57.92 0.19 Allowed Glycine 0 CA--C 1.534 1.247 0 N-CA-C 111.548 -0.621 . . . . 0.0 111.548 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -68.98 77.41 0.79 Allowed 'Trans proline' 0 N--CA 1.494 1.509 0 C-N-CA 121.983 1.789 . . . . 0.0 111.861 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 4.2 mmt -71.74 82.3 0.87 Allowed 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.308 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.1 tp -74.83 144.75 43.32 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.294 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.2 t -44.1 132.38 5.59 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -178.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.0 m -65.44 -32.89 74.75 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.332 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 73.8 p -72.65 -13.4 61.35 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.23 43.48 25.61 Favored Glycine 0 C--N 1.345 1.054 0 N-CA-C 111.771 -0.532 . . . . 0.0 111.771 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 29.2 p -85.38 -14.38 46.51 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.59 4.38 60.68 Favored Glycine 0 CA--C 1.536 1.406 0 C-N-CA 121.306 -0.473 . . . . 0.0 113.296 179.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -114.09 163.62 14.93 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-N 117.674 0.737 . . . . 0.0 110.561 -179.629 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -68.05 144.77 54.96 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.749 -179.016 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -110.13 161.19 13.03 Favored Glycine 0 CA--C 1.528 0.848 0 N-CA-C 110.777 -0.929 . . . . 0.0 110.777 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.412 ' HB3' HG23 ' A' ' 28' ' ' THR . 22.5 t30 -108.1 118.9 51.49 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-O 119.329 -0.367 . . . . 0.0 110.606 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -67.18 -18.91 51.13 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 C-N-CA 121.675 1.583 . . . . 0.0 112.154 179.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 60.9 mtp180 -75.36 -31.98 60.69 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 177.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.412 HG23 ' HB3' ' A' ' 25' ' ' ASN . 70.4 p -79.09 -153.44 0.07 Allowed 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.467 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -89.93 26.54 1.79 Allowed 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 118.204 0.456 . . . . 0.0 111.982 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.02 10.68 78.06 Favored Glycine 0 CA--C 1.536 1.391 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.75 161.8 21.96 Favored 'General case' 0 C--N 1.347 0.457 0 CA-C-N 117.249 0.524 . . . . 0.0 111.193 -178.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 31.1 p -72.25 -157.43 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.652 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.58 -49.26 19.11 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -178.503 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.4 t -69.68 -52.04 35.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -177.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 71.2 m -60.05 -36.15 76.7 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -178.4 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.445 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 14.5 t80 -58.87 -48.42 81.46 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 -178.797 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.1 pttt -72.32 -44.14 63.11 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -54.63 -39.61 68.13 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.179 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.445 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 0.8 OUTLIER -85.34 -33.33 22.08 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 120.425 -0.51 . . . . 0.0 111.753 -179.445 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 14.9 tp -62.47 -30.6 71.37 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.453 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -65.93 -39.29 90.38 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.379 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 70.0 mtt-85 -79.23 -30.86 43.41 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.572 -0.286 . . . . 0.0 111.229 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.9 tp60 -75.63 -37.77 59.45 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.076 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -73.64 -40.59 63.63 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.948 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 65.6 m-20 -66.53 -42.19 87.61 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.844 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.1 t -74.42 -63.84 1.15 Allowed 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.825 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 70.96 56.53 7.03 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 53.4 mmt-85 -125.06 -47.6 1.77 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.451 0.167 . . . . 0.0 110.566 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 42.2 mtm -100.97 113.2 25.97 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.373 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.0 m -90.61 166.38 19.59 Favored Pre-proline 0 CA--C 1.535 0.402 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.684 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -58.08 171.35 1.71 Allowed 'Trans proline' 0 N--CA 1.5 1.883 0 C-N-CA 122.294 1.996 . . . . 0.0 112.244 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 74.6 mmm -84.85 174.74 9.6 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.505 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 74.01 35.77 53.18 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.9 p -94.76 157.93 15.73 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.492 0.187 . . . . 0.0 110.565 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -86.26 139.75 30.74 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.494 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.9 t -81.0 174.25 11.8 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.58 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.89 78.1 1.39 Allowed Glycine 0 CA--C 1.527 0.789 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.0 t -122.29 36.19 4.69 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.007 0.432 . . . . 0.0 110.444 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -71.03 127.74 33.59 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.667 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.3 p -158.22 88.91 2.31 Favored Pre-proline 0 CA--C 1.538 0.497 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.414 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -80.24 -169.63 0.83 Allowed 'Trans proline' 0 N--CA 1.492 1.438 0 C-N-CA 122.396 2.064 . . . . 0.0 112.248 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 4.6 t . . . . . 0 C--O 1.22 -0.464 0 CA-C-O 118.061 -0.971 . . . . 0.0 110.577 -179.97 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.418 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.6 m -106.06 111.32 23.89 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 110.436 -0.209 . . . . 0.0 110.436 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 50.8 mtt -150.31 105.1 3.31 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.724 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -136.49 33.64 2.75 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.764 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -135.4 35.57 2.97 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 120.957 0.408 . . . . 0.0 110.723 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -133.6 104.26 6.29 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.475 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 16.9 p -80.4 150.18 29.9 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.595 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -105.0 -35.37 7.68 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.039 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -98.69 94.66 6.76 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.909 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.554 HG23 ' O ' ' A' ' 10' ' ' THR . 4.9 t -148.98 90.02 4.83 Favored Pre-proline 0 CA--C 1.54 0.594 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.575 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -57.85 140.24 93.09 Favored 'Trans proline' 0 N--CA 1.502 1.992 0 C-N-CA 122.359 2.04 . . . . 0.0 112.287 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.99 44.78 35.11 Favored Glycine 0 CA--C 1.542 1.762 0 CA-C-O 119.332 -0.704 . . . . 0.0 112.627 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.23 71.64 5.69 Favored 'Trans proline' 0 N--CA 1.498 1.755 0 C-N-CA 122.126 1.884 . . . . 0.0 112.365 -179.686 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 11.3 mmt -72.46 72.02 0.96 Allowed 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.313 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.448 HD23 ' HA ' ' A' ' 15' ' ' LEU . 18.2 mt -79.36 140.43 37.48 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.375 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.7 t -38.93 136.19 0.8 Allowed 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -177.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m -64.92 -29.33 70.26 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.534 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 44.0 p -82.23 -6.96 59.59 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 71.73 43.52 51.09 Favored Glycine 0 C--N 1.344 0.978 0 C-N-CA 121.24 -0.505 . . . . 0.0 112.085 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.4 p -82.29 -6.81 59.5 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.3 0.62 79.81 Favored Glycine 0 CA--C 1.54 1.614 0 CA-C-O 119.648 -0.529 . . . . 0.0 112.954 179.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -110.64 177.6 4.63 Favored 'General case' 0 C--N 1.344 0.363 0 CA-C-N 117.791 0.795 . . . . 0.0 111.151 -179.136 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -84.13 144.91 28.7 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.51 -178.687 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -114.25 159.59 13.63 Favored Glycine 0 CA--C 1.53 1.019 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 178.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -105.97 140.0 20.8 Favored Pre-proline 0 N--CA 1.468 0.428 0 CA-C-O 119.3 -0.381 . . . . 0.0 110.245 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -75.22 -23.15 13.72 Favored 'Trans proline' 0 N--CA 1.489 1.239 0 C-N-CA 121.746 1.63 . . . . 0.0 112.598 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 85.8 mtt-85 -75.33 -28.45 59.65 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 178.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 60.9 p -80.95 -151.29 0.08 Allowed 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 178.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -92.11 28.17 1.95 Allowed 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 117.984 0.356 . . . . 0.0 111.274 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 76.79 15.64 81.43 Favored Glycine 0 CA--C 1.536 1.349 0 N-CA-C 111.272 -0.731 . . . . 0.0 111.272 -178.686 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 40.2 mtt -123.65 169.76 11.15 Favored 'General case' 0 C--N 1.347 0.474 0 CA-C-N 117.389 0.594 . . . . 0.0 111.334 -179.32 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 22.4 p -79.08 -165.82 0.82 Allowed 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.781 -178.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.8 -41.98 51.29 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 13.9 t -68.27 -49.3 68.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -177.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 60.8 m -72.1 -34.64 68.79 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 -178.057 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -64.95 -27.03 68.56 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -178.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 55.2 tttt -75.94 -41.66 50.98 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -67.12 -45.8 76.05 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.458 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 42.3 t60 -57.56 -45.51 85.06 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 -178.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.0 mp -62.88 -29.12 70.52 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.958 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -66.79 -32.46 73.77 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 121.078 -0.249 . . . . 0.0 111.1 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -83.58 -33.59 25.35 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.672 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -78.67 -27.44 45.19 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.378 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -77.66 -41.98 36.31 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.425 -179.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -66.3 -41.1 90.24 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.733 -0.212 . . . . 0.0 110.788 -179.568 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 36.4 m -72.17 -64.47 0.94 Allowed 'General case' 0 C--O 1.233 0.225 0 N-CA-C 110.129 -0.322 . . . . 0.0 110.129 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.07 -55.59 3.65 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.496 -0.642 . . . . 0.0 111.496 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 21.8 ttm180 -135.13 -58.75 0.79 Allowed 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 121.305 -0.158 . . . . 0.0 111.262 -179.412 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 5.0 mmt -71.42 107.65 4.46 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.852 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 70.7 m -97.25 157.89 34.15 Favored Pre-proline 0 CA--C 1.533 0.325 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.141 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -77.48 -175.83 2.89 Favored 'Trans proline' 0 N--CA 1.493 1.481 0 C-N-CA 122.254 1.969 . . . . 0.0 112.112 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 45.4 mtm -88.59 -64.67 1.11 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.369 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 140.69 -59.87 0.56 Allowed Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.9 t -71.78 170.61 13.24 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 110.519 -0.178 . . . . 0.0 110.519 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -94.71 170.05 9.73 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.478 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.6 p -144.97 -56.74 0.34 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.465 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 90.28 53.05 2.4 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.5 m -146.09 -57.21 0.3 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.525 0.202 . . . . 0.0 110.586 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -95.05 146.47 24.25 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.631 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 35.7 m -86.62 153.6 55.65 Favored Pre-proline 0 CA--C 1.535 0.384 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.66 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -79.93 102.45 1.46 Allowed 'Trans proline' 0 N--CA 1.491 1.381 0 C-N-CA 122.335 2.023 . . . . 0.0 112.004 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 6.4 m . . . . . 0 C--O 1.219 -0.504 0 CA-C-O 118.022 -0.99 . . . . 0.0 110.592 -179.859 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.356 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.2 m -111.82 32.26 5.59 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 120.645 0.26 . . . . 0.0 110.872 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 61.7 mtt -69.07 -55.05 11.92 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.792 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -102.84 32.64 3.57 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.857 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -116.75 33.03 5.8 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.586 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -109.7 -178.53 3.56 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 120.748 0.308 . . . . 0.0 111.23 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.9 p -73.99 166.52 23.23 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.413 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -106.76 28.81 7.56 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.237 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.406 ' O ' HG23 ' A' ' 10' ' ' THR . 2.0 pt20 -137.44 76.97 1.61 Allowed 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.218 0.532 . . . . 0.0 110.056 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.406 HG23 ' O ' ' A' ' 9' ' ' GLN . 3.3 p -154.2 151.28 24.0 Favored Pre-proline 0 C--O 1.234 0.259 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.673 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -73.57 168.51 24.58 Favored 'Trans proline' 0 N--CA 1.493 1.498 0 C-N-CA 122.189 1.926 . . . . 0.0 112.064 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 143.31 -54.03 0.59 Allowed Glycine 0 CA--C 1.535 1.293 0 N-CA-C 111.445 -0.662 . . . . 0.0 111.445 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -79.72 95.15 1.03 Allowed 'Trans proline' 0 N--CA 1.493 1.477 0 C-N-CA 122.295 1.997 . . . . 0.0 112.78 -179.161 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -72.56 95.7 1.86 Allowed 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.757 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.462 HD13 ' O ' ' A' ' 22' ' ' PHE . 2.1 mm? -78.22 142.84 37.63 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.83 179.722 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.1 t -51.1 120.95 5.42 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 39.5 m -59.67 -25.36 64.67 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.429 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 66.7 p -72.04 -18.95 61.91 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.63 39.71 8.09 Favored Glycine 0 C--N 1.342 0.91 0 C-N-CA 121.194 -0.527 . . . . 0.0 111.988 178.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.5 p -89.28 -20.38 24.17 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 120.946 -0.301 . . . . 0.0 111.359 178.412 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 93.96 5.5 62.54 Favored Glycine 0 CA--C 1.538 1.514 0 CA-C-O 120.011 -0.327 . . . . 0.0 113.248 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.462 ' O ' HD13 ' A' ' 15' ' ' LEU . 18.7 m-85 -103.14 -177.57 3.41 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-N 117.444 0.622 . . . . 0.0 110.937 -179.125 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.7 t80 -89.01 134.03 34.13 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.299 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -107.95 165.38 12.9 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.876 -179.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -114.92 134.89 22.41 Favored Pre-proline 0 CA--C 1.541 0.631 0 CA-C-O 119.523 -0.275 . . . . 0.0 111.419 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -76.55 -26.39 8.57 Favored 'Trans proline' 0 N--CA 1.496 1.638 0 C-N-CA 122.386 2.057 . . . . 0.0 112.228 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 36.3 mtt-85 -71.14 -33.33 69.97 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.153 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 45.9 p -77.52 -154.0 0.06 Allowed 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -91.58 27.65 1.95 Allowed 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.322 0.51 . . . . 0.0 111.466 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.88 15.3 79.44 Favored Glycine 0 CA--C 1.534 1.244 0 N-CA-C 112.315 -0.314 . . . . 0.0 112.315 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -118.89 164.18 15.81 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 117.195 0.498 . . . . 0.0 110.706 -179.144 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 31.2 p -76.26 -157.57 0.08 Allowed 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.549 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.78 -50.4 20.75 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -179.114 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 21.3 t -67.36 -55.8 15.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -177.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 91.1 m -55.73 -36.62 67.44 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -178.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 35.3 t80 -59.62 -43.18 93.86 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.1 ttpt -73.32 -46.37 49.84 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.724 0.297 . . . . 0.0 110.385 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -54.85 -39.4 68.58 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.376 -178.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -85.98 -33.28 21.14 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 120.309 -0.557 . . . . 0.0 112.212 -179.238 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 17.5 tp -63.98 -33.4 75.64 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.555 0.217 . . . . 0.0 111.057 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -69.12 -38.75 79.04 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.864 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 45.7 mtp180 -72.8 -32.35 65.49 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.179 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -76.51 -36.11 57.96 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.734 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 65.0 mt-30 -75.6 -37.18 60.03 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.654 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -67.58 -37.33 82.46 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.719 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 39.0 m -77.33 -50.28 13.14 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.494 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 68.03 48.05 56.13 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.923 -0.871 . . . . 0.0 110.923 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -98.01 -61.55 1.37 Allowed 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.427 0.156 . . . . 0.0 110.68 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 8.7 tpt -105.1 103.89 13.52 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.509 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 97.2 p -162.68 155.83 16.95 Favored Pre-proline 0 CA--C 1.535 0.37 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.58 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -75.43 -36.03 2.53 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 122.298 1.999 . . . . 0.0 112.051 179.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 12.1 mmt -138.72 -62.93 0.55 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.483 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 100.12 -35.94 4.45 Favored Glycine 0 CA--C 1.527 0.788 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 40.8 p -124.75 155.18 39.75 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.575 0.226 . . . . 0.0 110.551 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -89.38 117.66 28.48 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.504 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 45.4 m -88.69 176.1 7.24 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.559 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 87.68 77.68 1.27 Allowed Glycine 0 CA--C 1.526 0.749 0 N-CA-C 111.11 -0.796 . . . . 0.0 111.11 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.3 m -145.22 33.67 1.09 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 120.815 0.34 . . . . 0.0 110.815 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -76.28 152.94 36.33 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.674 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 39.9 t -136.72 149.01 65.73 Favored Pre-proline 0 CA--C 1.536 0.428 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.475 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -56.62 145.09 83.28 Favored 'Trans proline' 0 N--CA 1.501 1.957 0 C-N-CA 122.247 1.965 . . . . 0.0 112.414 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 3.5 m . . . . . 0 C--O 1.22 -0.481 0 CA-C-O 118.049 -0.977 . . . . 0.0 110.629 179.964 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.271 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.8 m -136.84 140.83 42.71 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 38.9 mtt -148.35 179.81 7.51 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.713 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -91.78 -39.41 11.8 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.796 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -99.21 30.27 3.55 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.169 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -77.45 113.98 15.81 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.519 179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.1 t -85.73 162.92 18.52 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.455 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -129.99 34.46 4.25 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.821 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -101.5 172.48 6.94 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.665 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 4.5 t -160.62 143.87 9.94 Favored Pre-proline 0 CA--C 1.54 0.575 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.443 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -75.59 167.0 27.39 Favored 'Trans proline' 0 N--CA 1.493 1.495 0 C-N-CA 122.139 1.893 . . . . 0.0 112.176 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 133.6 -62.59 0.63 Allowed Glycine 0 CA--C 1.536 1.39 0 N-CA-C 110.622 -0.991 . . . . 0.0 110.622 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -69.89 73.82 1.4 Allowed 'Trans proline' 0 N--CA 1.5 1.868 0 C-N-CA 122.419 2.079 . . . . 0.0 112.899 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 3.6 mmt -71.54 83.77 0.84 Allowed 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.346 179.233 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.96 144.99 40.68 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.5 t -46.3 134.03 9.11 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -178.184 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.9 m -67.92 -24.56 65.21 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 114.869 -1.06 . . . . 0.0 112.153 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.62 HG23 ' SD ' ' A' ' 31' ' ' MET . 76.9 p -81.53 -16.91 50.33 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -179.241 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.21 34.41 14.61 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 121.007 -0.616 . . . . 0.0 112.19 178.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 27.2 p -77.74 -18.54 56.41 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.841 178.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 91.62 9.8 62.47 Favored Glycine 0 CA--C 1.534 1.248 0 CA-C-O 119.982 -0.343 . . . . 0.0 112.759 179.297 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -105.8 -171.05 1.83 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 117.485 0.643 . . . . 0.0 110.602 -179.163 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -97.46 143.57 28.05 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.66 0.267 . . . . 0.0 111.106 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -113.36 170.85 13.54 Favored Glycine 0 CA--C 1.528 0.856 0 N-CA-C 110.297 -1.121 . . . . 0.0 110.297 179.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -122.82 140.57 33.49 Favored Pre-proline 0 CA--C 1.538 0.513 0 CA-C-O 119.467 -0.301 . . . . 0.0 110.561 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -75.63 -17.36 18.27 Favored 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 121.835 1.69 . . . . 0.0 112.677 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.1 mmt180 -78.26 -34.24 49.19 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 40.7 p -77.63 -151.31 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 178.555 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -88.94 29.36 1.05 Allowed 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 118.534 0.607 . . . . 0.0 111.2 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 74.39 15.39 80.3 Favored Glycine 0 CA--C 1.535 1.301 0 N-CA-C 111.993 -0.443 . . . . 0.0 111.993 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.62 ' SD ' HG23 ' A' ' 18' ' ' THR . 10.9 mtt -129.04 176.57 7.78 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 117.416 0.608 . . . . 0.0 109.979 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 14.6 p -77.37 -169.31 1.37 Allowed 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.306 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -74.85 -47.21 31.5 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -177.62 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 20.2 t -68.27 -52.49 37.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 120.999 -0.281 . . . . 0.0 111.3 -178.165 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 79.2 m -60.73 -36.99 80.24 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.146 -179.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.446 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 29.2 t80 -57.82 -33.21 68.37 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.517 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.4 mtpt -77.02 -45.86 25.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.804 0.335 . . . . 0.0 110.101 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -58.68 -41.3 85.88 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.671 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.446 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.3 p-80 -82.11 -36.13 27.85 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 120.21 -0.596 . . . . 0.0 111.697 -178.817 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.9 tp -62.02 -28.81 69.85 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.576 0.227 . . . . 0.0 110.877 179.122 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -61.82 -38.69 89.09 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.643 179.314 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 60.2 mtt180 -77.11 -29.45 54.79 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.55 178.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -73.84 -36.22 64.88 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.689 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -72.77 -22.98 60.76 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -51.57 -42.15 61.67 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.246 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.8 p -89.76 -51.71 5.36 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.75 -0.205 . . . . 0.0 110.882 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.23 -54.32 2.84 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 111.042 -0.823 . . . . 0.0 111.042 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.5 ttt85 -129.69 97.69 4.59 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.565 0.221 . . . . 0.0 110.555 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 11.2 ttt -120.43 -62.75 1.43 Allowed 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.235 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 10.6 m -100.72 160.04 27.93 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.787 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -54.15 126.49 22.29 Favored 'Trans proline' 0 N--CA 1.501 1.948 0 C-N-CA 122.547 2.165 . . . . 0.0 112.663 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 15.0 ttt -103.31 -41.43 6.04 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.709 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 100.01 -51.83 1.03 Allowed Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.716 -0.954 . . . . 0.0 110.716 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.1 m -90.81 142.54 27.66 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 110.446 -0.205 . . . . 0.0 110.446 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -133.38 -51.03 0.87 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.499 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.8 t -85.87 -37.74 18.83 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.676 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 100.82 39.69 3.08 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.966 -0.854 . . . . 0.0 110.966 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.6 m -84.76 -58.89 2.53 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.514 0.197 . . . . 0.0 110.709 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -91.11 135.25 33.89 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.681 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.6 t -154.06 88.07 3.55 Favored Pre-proline 0 CA--C 1.538 0.492 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.536 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_exo -58.24 150.91 63.4 Favored 'Trans proline' 0 N--CA 1.5 1.868 0 C-N-CA 122.351 2.034 . . . . 0.0 112.18 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 30.9 p . . . . . 0 C--O 1.219 -0.53 0 CA-C-O 118.047 -0.978 . . . . 0.0 110.521 179.9 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.427 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.3 m -82.77 119.82 24.83 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.622 0.249 . . . . 0.0 110.57 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 17.5 ptm -150.94 33.49 0.6 Allowed 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.869 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -102.88 31.59 4.11 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.031 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -101.72 -46.89 4.79 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.555 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -109.93 127.87 55.02 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.736 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.7 t -114.19 159.15 20.43 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.428 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 34.1 m120 -101.09 33.56 2.81 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.684 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -89.88 112.19 23.47 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.815 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 16.4 p -87.57 146.87 40.35 Favored Pre-proline 0 CA--C 1.535 0.383 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.159 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -76.48 142.5 23.6 Favored 'Trans proline' 0 N--CA 1.495 1.607 0 C-N-CA 122.206 1.937 . . . . 0.0 111.829 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 175.9 -62.32 0.1 Allowed Glycine 0 CA--C 1.535 1.319 0 N-CA-C 111.43 -0.668 . . . . 0.0 111.43 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -84.18 70.39 5.98 Favored 'Trans proline' 0 N--CA 1.49 1.307 0 C-N-CA 122.43 2.087 . . . . 0.0 112.286 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 19.1 mtt -70.01 96.84 1.08 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.42 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.438 HD13 ' O ' ' A' ' 22' ' ' PHE . 0.9 OUTLIER -73.77 140.97 46.27 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.255 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.2 t -39.67 137.06 0.92 Allowed 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -178.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 57.8 m -61.65 -25.41 67.36 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.197 -179.353 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 68.1 p -90.76 -5.58 55.49 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -178.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.35 41.38 85.69 Favored Glycine 0 C--N 1.341 0.841 0 N-CA-C 111.482 -0.647 . . . . 0.0 111.482 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 15.2 p -86.58 -13.23 46.37 Favored 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.2 -7.48 54.51 Favored Glycine 0 CA--C 1.542 1.765 0 CA-C-O 119.746 -0.474 . . . . 0.0 113.539 178.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.438 ' O ' HD13 ' A' ' 15' ' ' LEU . 11.4 m-85 -91.41 178.91 5.82 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 117.627 0.714 . . . . 0.0 110.895 -178.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -89.71 135.62 33.51 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.336 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -100.78 140.18 14.76 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 111.069 -0.813 . . . . 0.0 111.069 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -99.89 135.47 20.45 Favored Pre-proline 0 CA--C 1.538 0.491 0 CA-C-O 119.446 -0.312 . . . . 0.0 110.253 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -74.79 -21.78 16.0 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 121.791 1.66 . . . . 0.0 112.863 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -75.3 -31.75 60.77 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 178.404 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 54.0 p -79.59 -153.27 0.08 Allowed 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 178.278 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -91.45 27.34 2.0 Allowed 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 118.331 0.514 . . . . 0.0 111.046 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.35 17.25 76.57 Favored Glycine 0 CA--C 1.539 1.593 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -178.231 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 28.5 mtt -120.58 160.5 23.1 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-O 121.097 0.475 . . . . 0.0 111.571 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 22.4 p -73.88 -161.62 0.12 Allowed 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.888 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.42 -43.21 51.09 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.846 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.6 t -69.97 -45.89 75.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.9 m -73.53 -36.22 65.66 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -177.765 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -63.38 -37.3 86.72 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -178.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.76 -43.0 48.78 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.28 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 62.2 mm-40 -62.79 -47.76 82.09 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.541 179.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -58.49 -46.25 87.06 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.986 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.1 mp -60.96 -26.65 67.69 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.881 -179.008 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -55.24 -36.26 65.84 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-O 120.752 0.31 . . . . 0.0 111.354 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 11.1 mtm105 -83.87 -29.08 27.51 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.083 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -66.06 -40.53 90.98 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.767 -0.197 . . . . 0.0 110.988 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -66.68 -39.03 87.97 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.852 -178.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -75.34 -45.43 39.53 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 121.029 -0.268 . . . . 0.0 110.82 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 44.4 t -70.85 -56.46 6.23 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.615 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.29 -52.36 0.84 Allowed Glycine 0 CA--C 1.526 0.735 0 N-CA-C 110.867 -0.893 . . . . 0.0 110.867 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -139.33 95.3 2.91 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 7.3 ttt -83.26 -64.17 1.22 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.387 -179.419 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 66.2 m -89.75 155.32 48.01 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.993 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -74.18 179.73 5.51 Favored 'Trans proline' 0 N--CA 1.494 1.546 0 C-N-CA 122.248 1.965 . . . . 0.0 111.737 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.04 172.6 12.46 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.74 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 145.43 -50.11 0.64 Allowed Glycine 0 CA--C 1.527 0.791 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 43.4 p -145.41 114.71 7.1 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.508 0.194 . . . . 0.0 110.661 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -114.53 84.54 2.08 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.411 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 77.3 p -152.26 -50.29 0.11 Allowed 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.498 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.3 59.75 1.35 Allowed Glycine 0 CA--C 1.527 0.803 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 66.2 m -83.29 -61.18 1.92 Allowed 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.536 0.208 . . . . 0.0 110.721 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 26.2 m120 -80.42 113.77 18.84 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.777 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.8 t -79.16 148.46 71.29 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.468 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -79.81 155.41 23.65 Favored 'Trans proline' 0 N--CA 1.492 1.416 0 C-N-CA 122.319 2.013 . . . . 0.0 112.129 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 16.7 p . . . . . 0 C--O 1.219 -0.55 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.62 -179.88 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.268 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.2 m -87.02 -57.93 2.78 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 8.7 ptp -98.34 159.65 14.8 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.313 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -101.75 36.31 2.1 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 120.985 0.421 . . . . 0.0 110.654 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -109.39 -38.33 5.51 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.661 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -76.85 137.36 39.13 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.475 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.5 p -82.39 176.19 9.63 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.843 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -76.4 -52.58 9.6 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.388 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -82.99 105.84 14.32 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.558 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 6.2 m -156.08 136.81 9.03 Favored Pre-proline 0 CA--C 1.537 0.465 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.963 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -73.14 123.97 9.2 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 121.866 1.711 . . . . 0.0 111.538 179.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 167.68 -55.82 0.22 Allowed Glycine 0 CA--C 1.536 1.351 0 N-CA-C 111.202 -0.759 . . . . 0.0 111.202 -179.555 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -72.02 67.05 3.31 Favored 'Trans proline' 0 N--CA 1.497 1.691 0 C-N-CA 122.086 1.858 . . . . 0.0 111.76 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 13.4 mtt -72.02 83.54 0.97 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.394 -179.603 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.3 mt -74.49 148.7 40.77 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.509 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 10.0 t -44.82 132.95 6.4 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -178.622 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m -61.61 -29.07 69.8 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.796 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.556 HG23 ' SD ' ' A' ' 31' ' ' MET . 71.2 p -78.89 -9.75 59.59 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.652 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 71.94 33.23 62.86 Favored Glycine 0 C--N 1.342 0.888 0 N-CA-C 111.26 -0.736 . . . . 0.0 111.26 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.5 p -71.83 -19.14 62.02 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.37 4.28 53.19 Favored Glycine 0 CA--C 1.539 1.557 0 CA-C-O 119.569 -0.573 . . . . 0.0 113.481 178.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -115.53 164.09 14.81 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 117.944 0.872 . . . . 0.0 111.038 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -69.21 146.55 52.29 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.571 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -109.68 166.89 12.63 Favored Glycine 0 CA--C 1.527 0.794 0 N-CA-C 110.216 -1.153 . . . . 0.0 110.216 178.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -114.93 135.96 22.51 Favored Pre-proline 0 N--CA 1.467 0.416 0 N-CA-C 109.948 -0.389 . . . . 0.0 109.948 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -74.82 -23.46 14.19 Favored 'Trans proline' 0 N--CA 1.495 1.58 0 C-N-CA 122.022 1.814 . . . . 0.0 112.928 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -75.67 -36.81 60.0 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.2 p -70.87 -154.93 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -89.76 29.21 1.2 Allowed 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.681 0.673 . . . . 0.0 111.031 179.235 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.44 16.27 78.33 Favored Glycine 0 CA--C 1.534 1.24 0 CA-C-O 119.872 -0.404 . . . . 0.0 112.465 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.556 ' SD ' HG23 ' A' ' 18' ' ' THR . 9.4 mtt -131.2 176.56 8.17 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 117.616 0.708 . . . . 0.0 111.213 -178.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 18.9 p -77.22 -167.15 0.84 Allowed 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.677 -179.209 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.51 -48.83 30.11 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -177.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.1 t -65.68 -57.74 9.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -177.293 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 73.2 m -57.51 -35.38 70.18 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 111.641 0.237 . . . . 0.0 111.641 -178.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.46 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 41.1 t80 -57.42 -41.45 80.42 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.216 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -74.29 -45.09 49.8 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -56.69 -39.76 74.37 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -179.235 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.46 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.6 p-80 -84.46 -33.24 23.68 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 120.006 -0.677 . . . . 0.0 111.675 -179.131 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 15.7 tp -62.33 -30.39 71.13 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.254 179.303 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -65.11 -39.47 93.16 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.662 0.268 . . . . 0.0 111.0 -179.797 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 61.9 mtm180 -76.11 -30.53 58.29 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.344 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.74 -38.21 54.61 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.792 -179.683 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -75.26 -31.78 60.88 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 123.231 0.332 . . . . 0.0 110.776 179.779 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -55.65 -29.38 59.16 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 111.738 0.274 . . . . 0.0 111.738 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 20.2 m -60.47 -64.25 1.02 Allowed 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.358 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 67.87 62.33 4.34 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 110.989 -0.844 . . . . 0.0 110.989 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 72.7 mtt180 -72.27 154.67 40.86 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 10.0 mtt -112.16 96.77 6.22 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.716 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -161.29 159.0 23.95 Favored Pre-proline 0 CA--C 1.537 0.453 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.186 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -57.1 -171.83 0.04 OUTLIER 'Trans proline' 0 N--CA 1.502 1.992 0 C-N-CA 122.338 2.025 . . . . 0.0 112.09 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 14.3 ptp -111.2 150.66 29.23 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.497 179.659 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 78.1 36.45 31.5 Favored Glycine 0 CA--C 1.527 0.81 0 N-CA-C 111.085 -0.806 . . . . 0.0 111.085 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.3 m -101.57 131.45 47.74 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.554 0.216 . . . . 0.0 110.576 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -80.97 88.46 5.92 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.718 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.3 t -152.72 -177.53 6.31 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.341 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.03 80.19 1.42 Allowed Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.5 t -144.91 33.51 1.12 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 120.743 0.306 . . . . 0.0 110.877 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -100.37 146.97 26.34 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.665 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 87.4 p -149.09 153.63 38.32 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.504 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -77.18 142.8 21.93 Favored 'Trans proline' 0 N--CA 1.495 1.581 0 C-N-CA 122.407 2.071 . . . . 0.0 111.99 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 72.9 p . . . . . 0 C--O 1.22 -0.485 0 CA-C-O 118.041 -0.98 . . . . 0.0 110.59 -179.894 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.178 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.0 p -94.96 -50.26 5.19 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.521 0.201 . . . . 0.0 110.52 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.31 87.58 1.82 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.725 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -93.12 -38.32 11.66 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.621 179.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -85.56 -52.72 5.64 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.717 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -80.69 94.85 6.43 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.038 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.7 p -104.98 137.7 42.33 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.147 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -89.55 -66.13 0.95 Allowed 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.624 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -91.26 149.86 21.58 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.282 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.529 HG23 ' O ' ' A' ' 10' ' ' THR . 3.9 t -166.8 101.06 0.66 Allowed Pre-proline 0 CA--C 1.538 0.509 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.505 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -74.28 164.62 33.73 Favored 'Trans proline' 0 N--CA 1.492 1.429 0 C-N-CA 121.943 1.762 . . . . 0.0 111.611 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 155.74 -52.61 0.43 Allowed Glycine 0 CA--C 1.535 1.304 0 N-CA-C 111.249 -0.74 . . . . 0.0 111.249 -179.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -76.48 81.47 2.5 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 122.011 1.807 . . . . 0.0 112.236 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 18.7 mmt -71.78 93.85 1.34 Allowed 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.954 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.463 HD13 ' HA ' ' A' ' 15' ' ' LEU . 2.5 mm? -79.83 139.65 37.12 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.0 t -42.22 121.5 1.9 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 -178.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.1 m -55.94 -22.58 26.99 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.318 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 60.9 p -81.18 -9.64 59.76 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 179.321 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 74.49 40.24 39.84 Favored Glycine 0 C--N 1.344 1.023 0 C-N-CA 121.457 -0.401 . . . . 0.0 112.357 179.344 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 24.2 p -86.62 -9.16 56.65 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 117.012 0.406 . . . . 0.0 112.066 179.339 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.21 -2.74 85.44 Favored Glycine 0 CA--C 1.537 1.441 0 CA-C-O 119.777 -0.457 . . . . 0.0 113.394 178.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.428 ' O ' HD13 ' A' ' 15' ' ' LEU . 67.2 m-85 -100.79 171.95 7.36 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 117.788 0.794 . . . . 0.0 110.533 -179.607 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -80.31 139.06 36.78 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.568 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -111.78 155.24 16.3 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 109.874 -1.291 . . . . 0.0 109.874 178.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.495 ' HB3' HG23 ' A' ' 28' ' ' THR . 1.9 t-20 -101.38 137.46 19.65 Favored Pre-proline 0 CA--C 1.537 0.47 0 CA-C-O 119.499 -0.286 . . . . 0.0 110.822 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -73.13 -27.28 14.01 Favored 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 121.848 1.699 . . . . 0.0 112.294 179.303 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.4 mmt180 -74.08 -26.9 60.63 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 123.041 0.213 . . . . 0.0 110.526 178.515 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.495 HG23 ' HB3' ' A' ' 25' ' ' ASN . 68.8 p -82.11 -150.49 0.09 Allowed 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 178.535 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 54.1 m-20 -91.21 28.3 1.67 Allowed 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 118.375 0.534 . . . . 0.0 110.891 178.681 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 76.01 17.51 80.0 Favored Glycine 0 CA--C 1.537 1.444 0 N-CA-C 111.702 -0.559 . . . . 0.0 111.702 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 48.6 mtt -123.16 170.34 10.33 Favored 'General case' 0 C--N 1.347 0.491 0 CA-C-N 117.291 0.546 . . . . 0.0 111.419 -179.538 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 31.2 p -77.62 -167.79 1.04 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.639 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.24 -44.41 59.54 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.672 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 18.1 t -62.78 -51.22 74.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -178.55 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 68.5 m -70.62 -34.55 72.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.944 -178.351 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.437 ' CE1' HD13 ' A' ' 40' ' ' LEU . 38.9 t80 -64.83 -32.92 74.84 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.46 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -77.87 -43.05 31.39 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.906 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -63.64 -45.21 91.24 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 120.869 0.366 . . . . 0.0 110.106 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 39.6 t60 -59.94 -44.86 94.12 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.701 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.437 HD13 ' CE1' ' A' ' 36' ' ' TYR . 1.0 OUTLIER -65.33 -29.33 70.05 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.634 -178.798 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -71.99 -31.48 66.28 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 120.934 -0.307 . . . . 0.0 110.315 179.302 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 39.2 ttt-85 -75.21 -31.44 60.89 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.172 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -73.02 -25.53 60.99 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.235 179.534 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.2 mm-40 -79.43 -22.04 44.76 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -64.24 -36.27 83.55 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -178.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.0 p -73.56 -62.65 1.41 Allowed 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 58.88 57.36 20.29 Favored Glycine 0 CA--C 1.53 1.01 0 CA-C-N 116.19 -0.459 . . . . 0.0 112.684 178.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 2.5 mpp_? -82.63 171.36 14.12 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 179.104 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 31.2 mtt -109.09 40.27 1.86 Allowed 'General case' 0 C--O 1.236 0.363 0 CA-C-O 120.861 0.362 . . . . 0.0 110.983 -179.492 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 38.8 m -98.61 155.15 37.08 Favored Pre-proline 0 CA--C 1.533 0.309 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.327 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -82.16 176.67 7.92 Favored 'Trans proline' 0 N--CA 1.489 1.207 0 C-N-CA 122.357 2.038 . . . . 0.0 111.834 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.73 177.82 6.63 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.472 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 84.67 35.96 12.68 Favored Glycine 0 CA--C 1.527 0.787 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.0 m -117.82 109.5 16.65 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 110.396 -0.224 . . . . 0.0 110.396 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -95.82 -43.34 7.9 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.592 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.0 m -77.25 156.82 31.17 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.393 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 85.19 58.46 2.08 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.1 m -152.64 -61.27 0.15 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.504 0.192 . . . . 0.0 110.513 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 13.3 p-10 -86.71 131.68 34.07 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.692 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 44.9 t -160.9 86.2 1.79 Allowed Pre-proline 0 CA--C 1.538 0.513 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.551 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -59.47 161.3 17.64 Favored 'Trans proline' 0 N--CA 1.498 1.789 0 C-N-CA 122.274 1.982 . . . . 0.0 112.026 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 6.5 t . . . . . 0 C--O 1.221 -0.433 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.601 179.973 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.367 0 N-CA-C 109.661 -1.375 . . . . 0.0 109.661 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.0 t -114.36 122.69 47.43 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.438 0.161 . . . . 0.0 110.588 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 64.8 mtt -89.67 -179.99 5.89 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.628 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -138.19 34.32 2.33 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.933 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -119.11 35.49 4.8 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.557 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -74.61 148.96 40.28 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.871 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.4 t -77.93 150.98 33.94 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.746 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -130.49 35.08 4.08 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.612 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -72.14 121.8 19.91 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.864 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 3.2 p -149.82 161.73 30.45 Favored Pre-proline 0 CA--C 1.536 0.439 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.926 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -56.74 103.93 0.13 Allowed 'Trans proline' 0 N--CA 1.5 1.87 0 C-N-CA 122.079 1.852 . . . . 0.0 112.073 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -159.83 45.79 0.42 Allowed Glycine 0 CA--C 1.542 1.756 0 CA-C-O 119.199 -0.778 . . . . 0.0 111.982 -179.439 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -67.68 71.99 0.69 Allowed 'Trans proline' 0 N--CA 1.503 2.043 0 C-N-CA 122.193 1.929 . . . . 0.0 112.361 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 14.8 mmt -72.87 97.6 2.29 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.832 -179.504 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mp -76.65 144.28 39.57 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.254 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.5 t -48.79 123.71 7.37 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.9 m -65.32 -30.57 71.43 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.015 -179.335 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 51.0 p -64.81 -23.03 67.11 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -178.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 91.05 36.93 6.47 Favored Glycine 0 CA--C 1.526 0.76 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.132 179.066 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.9 p -84.81 -16.44 41.4 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 117.034 0.417 . . . . 0.0 110.91 178.442 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.49 12.68 66.72 Favored Glycine 0 C--N 1.349 1.298 0 CA-C-O 119.747 -0.474 . . . . 0.0 113.097 178.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -114.37 176.71 4.93 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 117.633 0.717 . . . . 0.0 111.833 -179.103 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 8.1 t80 -81.21 140.82 34.7 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.101 -0.954 . . . . 0.0 111.025 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -124.7 -176.51 14.62 Favored Glycine 0 CA--C 1.53 1.008 0 N-CA-C 111.054 -0.819 . . . . 0.0 111.054 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -130.13 139.25 35.08 Favored Pre-proline 0 N--CA 1.47 0.536 0 CA-C-O 119.548 -0.263 . . . . 0.0 111.389 -179.739 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -77.07 -14.89 16.64 Favored 'Trans proline' 0 N--CA 1.49 1.273 0 C-N-CA 121.994 1.796 . . . . 0.0 112.949 178.63 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -77.6 -35.87 52.41 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 178.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 66.6 p -72.52 -154.77 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 177.478 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -90.77 26.02 2.19 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.574 0.624 . . . . 0.0 111.622 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 84.31 8.27 83.75 Favored Glycine 0 CA--C 1.538 1.484 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.8 163.31 16.35 Favored 'General case' 0 C--N 1.346 0.413 0 CA-C-N 117.146 0.473 . . . . 0.0 110.987 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 30.8 p -76.04 -157.71 0.08 Allowed 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -74.77 -48.3 26.28 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -179.061 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.2 t -69.03 -55.69 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 -178.185 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 77.7 m -57.19 -35.47 69.65 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -178.395 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.429 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 30.5 t80 -59.03 -40.44 85.04 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 111.833 0.309 . . . . 0.0 111.833 -179.127 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.6 tttm -74.37 -45.39 47.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.825 0.345 . . . . 0.0 110.347 -179.233 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -56.25 -38.51 71.23 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -178.609 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.429 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.6 p-80 -86.4 -33.4 20.49 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 120.191 -0.603 . . . . 0.0 112.155 -178.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.0 tt -65.91 -30.63 71.25 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.804 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -58.77 -40.53 84.18 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.393 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -84.79 -29.56 25.33 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.894 179.144 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -69.83 -44.19 70.47 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.96 0.409 . . . . 0.0 110.089 179.282 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -67.63 -26.83 66.42 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.973 -179.565 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -63.17 -47.51 82.31 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 120.495 0.188 . . . . 0.0 111.32 -179.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 12.3 p -100.77 -64.79 1.01 Allowed 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 179.469 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 79.06 34.81 32.37 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 111.488 -0.645 . . . . 0.0 111.488 179.429 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 -104.41 160.65 14.74 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 109.948 -0.389 . . . . 0.0 109.948 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 38.9 mtt -101.89 -36.2 8.73 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.558 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.6 p -133.01 157.62 77.9 Favored Pre-proline 0 CA--C 1.535 0.398 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.685 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -73.21 114.4 4.03 Favored 'Trans proline' 0 N--CA 1.494 1.554 0 C-N-CA 122.43 2.086 . . . . 0.0 112.289 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -85.78 -40.66 15.81 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.419 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 95.18 35.82 5.64 Favored Glycine 0 CA--C 1.527 0.836 0 N-CA-C 111.314 -0.714 . . . . 0.0 111.314 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.2 m -107.08 147.7 29.68 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.47 -177.82 2.35 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.485 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 5.4 m -69.33 -42.04 75.86 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.365 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 106.78 80.05 1.28 Allowed Glycine 0 CA--C 1.526 0.753 0 N-CA-C 111.11 -0.796 . . . . 0.0 111.11 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 35.2 p -124.54 33.73 5.18 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.828 0.347 . . . . 0.0 110.768 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -92.41 131.77 37.31 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.754 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 13.1 m -91.6 158.18 40.82 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.687 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_endo -79.38 138.04 13.65 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 122.311 2.007 . . . . 0.0 112.066 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 5.2 t . . . . . 0 C--O 1.219 -0.526 0 CA-C-O 118.059 -0.972 . . . . 0.0 110.51 -179.875 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.377 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.6 m -137.78 135.17 36.06 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.526 0.203 . . . . 0.0 110.68 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 56.3 mtm -143.47 123.55 13.65 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.622 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -126.46 33.28 5.03 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.791 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.0 tp60 -80.6 -60.11 2.44 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.408 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -103.75 111.03 23.36 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.413 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.4 m -86.77 119.34 26.89 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.449 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -90.81 -54.07 4.13 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.764 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -89.72 152.43 21.34 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.612 179.902 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.3 p -92.48 158.32 38.77 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.953 -179.691 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -76.11 159.58 37.2 Favored 'Trans proline' 0 N--CA 1.497 1.682 0 C-N-CA 122.406 2.071 . . . . 0.0 112.567 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.541 ' O ' HD23 ' A' ' 15' ' ' LEU . . . 67.06 44.01 89.13 Favored Glycine 0 CA--C 1.542 1.764 0 CA-C-O 119.125 -0.819 . . . . 0.0 112.71 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 12' ' ' GLY . 51.1 Cg_endo -71.41 -83.99 0.01 OUTLIER 'Trans proline' 0 N--CA 1.498 1.781 0 CA-C-N 119.802 1.801 . . . . 0.0 113.956 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 1.5 mtt -71.44 78.42 0.77 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.068 0.461 . . . . 0.0 112.173 -178.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.541 HD23 ' O ' ' A' ' 12' ' ' GLY . 2.0 mm? -71.27 148.36 47.24 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.139 179.018 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 11.2 t -41.34 140.66 0.82 Allowed 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -179.035 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 68.7 m -63.81 -29.19 70.42 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.824 -179.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.5 p -88.17 -5.19 58.55 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -179.174 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 71.03 38.71 63.81 Favored Glycine 0 C--N 1.343 0.972 0 CA-C-O 119.931 -0.372 . . . . 0.0 113.099 178.437 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 32.0 p -78.68 -17.78 55.41 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 117.179 0.489 . . . . 0.0 111.887 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 105.03 1.26 41.9 Favored Glycine 0 CA--C 1.54 1.621 0 CA-C-O 119.711 -0.494 . . . . 0.0 113.243 179.291 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 67.1 m-85 -109.01 156.74 19.39 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 117.767 0.783 . . . . 0.0 110.685 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 26.4 t80 -65.25 146.17 55.29 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.289 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -109.04 163.43 12.59 Favored Glycine 0 CA--C 1.529 0.932 0 N-CA-C 110.257 -1.137 . . . . 0.0 110.257 179.131 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -113.21 136.22 21.8 Favored Pre-proline 0 CA--C 1.541 0.608 0 CA-C-O 119.276 -0.392 . . . . 0.0 110.098 -179.574 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -76.59 -22.73 11.88 Favored 'Trans proline' 0 N--CA 1.494 1.525 0 C-N-CA 122.052 1.835 . . . . 0.0 112.313 179.408 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 61.7 mtp180 -74.53 -33.57 62.8 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 178.016 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.8 p -82.12 -155.42 0.14 Allowed 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 178.156 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -89.56 24.94 2.12 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 118.623 0.647 . . . . 0.0 111.825 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.42 17.75 75.31 Favored Glycine 0 CA--C 1.54 1.604 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 -179.187 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 16.9 mtt -120.33 155.38 33.46 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-N 117.152 0.476 . . . . 0.0 110.772 -179.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 29.3 p -66.38 -162.72 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.105 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -74.12 -48.36 30.0 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -178.835 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 17.5 t -62.61 -56.63 16.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 116.301 -0.409 . . . . 0.0 112.053 -178.253 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.6 m -60.39 -33.49 72.56 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -178.269 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 30.2 t80 -65.25 -34.87 79.38 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -178.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 39.3 tttt -77.26 -47.86 19.02 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.159 -179.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -66.1 -42.98 88.52 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.421 -179.002 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -59.39 -49.27 78.44 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.877 -178.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.76 -29.27 70.5 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 -178.516 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -57.96 -40.65 81.09 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.47 0.176 . . . . 0.0 111.195 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.6 ptp180 -82.17 -30.84 30.77 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.952 179.44 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -70.69 -52.44 21.07 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.475 -179.303 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -58.15 -34.28 70.11 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.662 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -65.63 -55.98 14.65 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.993 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.2 m -124.66 -64.68 1.09 Allowed 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.518 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 73.32 33.53 58.78 Favored Glycine 0 CA--C 1.528 0.886 0 N-CA-C 111.243 -0.743 . . . . 0.0 111.243 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -132.81 -65.01 0.73 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.483 0.182 . . . . 0.0 110.764 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 39.7 mtm -120.93 -60.09 1.68 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.836 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.7 p -156.6 159.49 31.33 Favored Pre-proline 0 CA--C 1.537 0.454 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.934 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -76.24 -49.16 0.13 Allowed 'Trans proline' 0 N--CA 1.495 1.569 0 C-N-CA 122.452 2.101 . . . . 0.0 112.518 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -93.41 -44.32 8.33 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.757 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 99.77 -59.98 0.76 Allowed Glycine 0 CA--C 1.527 0.783 0 N-CA-C 111.03 -0.828 . . . . 0.0 111.03 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 21.0 p -92.46 173.92 7.55 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.486 0.184 . . . . 0.0 110.584 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -76.67 127.93 33.72 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.547 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 21.4 m -150.8 178.9 8.68 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.618 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.87 51.51 1.37 Allowed Glycine 0 CA--C 1.526 0.723 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 77.4 p -148.81 34.67 0.76 Allowed 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.995 0.426 . . . . 0.0 110.828 179.812 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -106.19 130.75 54.01 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.611 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 22.7 t -86.08 149.13 49.49 Favored Pre-proline 0 CA--C 1.536 0.435 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.403 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -55.08 132.62 53.4 Favored 'Trans proline' 0 N--CA 1.502 1.985 0 C-N-CA 122.364 2.043 . . . . 0.0 112.573 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 4.9 m . . . . . 0 N--CA 1.471 0.589 0 CA-C-O 117.966 -1.016 . . . . 0.0 111.188 179.909 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.247 0 N-CA-C 109.641 -1.383 . . . . 0.0 109.641 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.6 t -84.41 116.59 23.14 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.542 0.211 . . . . 0.0 110.583 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 10.3 ptp -142.34 32.85 1.5 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.083 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -77.76 -50.67 11.9 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.571 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -73.07 -45.32 58.03 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.542 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -85.72 111.44 20.12 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.533 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.5 m -140.75 155.38 46.45 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.648 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -91.7 -39.96 11.53 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.909 -179.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -79.16 176.33 9.76 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.027 -179.559 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 13.5 m -153.94 106.29 2.48 Favored Pre-proline 0 CA--C 1.541 0.596 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.395 -179.699 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -87.39 130.6 2.86 Favored 'Trans proline' 0 N--CA 1.492 1.386 0 C-N-CA 122.408 2.072 . . . . 0.0 112.528 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.411 ' N ' ' CD ' ' A' ' 13' ' ' PRO . . . 65.21 43.87 94.72 Favored Glycine 0 CA--C 1.543 1.803 0 CA-C-O 119.111 -0.827 . . . . 0.0 112.856 179.638 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.411 ' CD ' ' N ' ' A' ' 12' ' ' GLY . 56.1 Cg_endo -71.88 87.07 0.86 Allowed 'Trans proline' 0 N--CA 1.498 1.779 0 C-N-CA 121.992 1.795 . . . . 0.0 112.373 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.04 78.51 0.93 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.427 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.549 HD23 ' O ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -79.19 145.21 33.78 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 179.864 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.7 t -51.29 124.26 11.38 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -178.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.8 m -64.6 -22.03 66.87 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.525 -0.761 . . . . 0.0 112.11 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 58.0 p -76.7 -19.54 57.59 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.65 43.19 6.56 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 121.168 -0.539 . . . . 0.0 112.081 179.412 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.9 p -88.37 -22.6 23.71 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 116.958 0.379 . . . . 0.0 111.706 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 98.65 6.94 56.13 Favored Glycine 0 CA--C 1.539 1.531 0 CA-C-O 119.707 -0.496 . . . . 0.0 113.6 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.549 ' O ' HD23 ' A' ' 15' ' ' LEU . 63.8 m-85 -108.36 -170.34 1.66 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 117.819 0.809 . . . . 0.0 111.13 -179.265 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -96.7 141.21 30.2 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.201 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -111.08 172.59 15.22 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 111.049 -0.821 . . . . 0.0 111.049 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -124.92 138.11 30.85 Favored Pre-proline 0 CA--C 1.54 0.571 0 CA-C-O 119.501 -0.285 . . . . 0.0 110.821 -179.558 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -75.79 -19.16 16.49 Favored 'Trans proline' 0 N--CA 1.498 1.748 0 C-N-CA 122.269 1.979 . . . . 0.0 112.488 178.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.0 mtt180 -75.96 -34.95 59.83 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 70.1 p -77.77 -154.41 0.07 Allowed 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.253 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -90.57 27.62 1.69 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.364 0.529 . . . . 0.0 111.718 179.825 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.26 10.88 85.59 Favored Glycine 0 CA--C 1.535 1.288 0 N-CA-C 111.6 -0.6 . . . . 0.0 111.6 -179.386 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.07 169.81 9.6 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 117.332 0.566 . . . . 0.0 111.097 -178.818 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 22.0 p -78.89 -162.03 0.35 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.124 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.76 -45.92 40.65 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -178.684 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.7 t -69.35 -56.82 10.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -178.175 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 72.3 m -56.77 -35.43 68.65 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.448 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -57.94 -37.91 74.98 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.778 -0.192 . . . . 0.0 111.166 -179.444 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.6 tttt -77.65 -45.48 24.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.897 0.379 . . . . 0.0 110.129 179.19 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -57.2 -40.86 78.26 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.878 0.695 . . . . 0.0 112.878 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 1.2 p80 -82.14 -33.85 29.41 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 120.102 -0.639 . . . . 0.0 111.398 -179.085 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.5 tp -64.28 -29.27 70.37 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.582 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -61.94 -40.95 97.3 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.605 0.24 . . . . 0.0 111.289 -179.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 36.9 ttt85 -84.13 -31.38 25.26 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.495 -179.675 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 -73.1 -48.18 37.93 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.575 0.226 . . . . 0.0 111.061 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -63.82 -21.89 66.65 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 116.286 -0.416 . . . . 0.0 112.083 -179.508 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -57.42 -31.63 66.07 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 2.7 t -59.85 -66.85 0.45 Allowed 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.438 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 66.25 63.04 4.2 Favored Glycine 0 CA--C 1.528 0.878 0 N-CA-C 111.027 -0.829 . . . . 0.0 111.027 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.2 ptt180 -94.67 64.75 3.02 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.22 0.533 . . . . 0.0 110.768 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 5.4 tpt -87.22 -61.58 1.69 Allowed 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.044 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.2 t -91.8 153.76 43.73 Favored Pre-proline 0 CA--C 1.534 0.355 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.83 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -57.43 -41.93 67.04 Favored 'Trans proline' 0 N--CA 1.501 1.924 0 C-N-CA 122.16 1.906 . . . . 0.0 112.135 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 56.1 mtt -73.22 -62.72 1.37 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.351 179.753 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 135.3 -41.74 1.41 Allowed Glycine 0 CA--C 1.527 0.805 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 179.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 37.2 p -128.93 126.08 38.91 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 110.474 -0.195 . . . . 0.0 110.474 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -91.27 173.32 7.98 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.55 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.6 m -148.45 177.08 9.76 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.611 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 74.49 68.55 1.54 Allowed Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.006 -0.838 . . . . 0.0 111.006 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 28.4 p -149.88 32.69 0.68 Allowed 'General case' 0 C--O 1.236 0.352 0 CA-C-O 120.772 0.32 . . . . 0.0 110.906 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -97.24 127.41 43.18 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.564 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.4 m -155.32 158.25 31.91 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.537 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -74.91 153.29 42.12 Favored 'Trans proline' 0 N--CA 1.495 1.596 0 C-N-CA 122.317 2.012 . . . . 0.0 111.933 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 32.4 p . . . . . 0 C--O 1.219 -0.518 0 CA-C-O 118.018 -0.992 . . . . 0.0 110.513 -179.984 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.34 0 N-CA-C 109.589 -1.404 . . . . 0.0 109.589 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.7 m -88.53 137.73 32.06 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.552 0.215 . . . . 0.0 110.608 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 33.0 ttp -101.41 35.33 2.3 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.248 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -112.27 -33.92 6.07 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.175 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -96.88 43.28 1.07 Allowed 'General case' 0 C--O 1.238 0.466 0 CA-C-O 120.948 0.404 . . . . 0.0 111.029 -179.447 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -134.37 49.03 2.27 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.205 0.526 . . . . 0.0 110.333 179.55 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.0 p -144.11 168.46 19.98 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.572 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -72.42 -36.14 68.53 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.949 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -96.88 131.05 44.03 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.376 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.547 HG23 ' O ' ' A' ' 10' ' ' THR . 5.0 t -135.73 96.56 13.26 Favored Pre-proline 0 CA--C 1.541 0.632 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.657 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -78.66 -174.88 2.45 Favored 'Trans proline' 0 N--CA 1.498 1.753 0 C-N-CA 122.357 2.038 . . . . 0.0 112.569 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 156.94 -55.37 0.39 Allowed Glycine 0 CA--C 1.535 1.33 0 N-CA-C 111.106 -0.798 . . . . 0.0 111.106 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -84.46 100.09 0.77 Allowed 'Trans proline' 0 N--CA 1.488 1.171 0 C-N-CA 122.442 2.095 . . . . 0.0 112.195 -179.584 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 6.7 mmt -70.81 82.64 0.64 Allowed 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.63 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.07 146.75 41.23 Favored 'General case' 0 N--CA 1.461 0.086 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.8 t -48.96 124.59 8.95 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -178.593 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.5 m -62.68 -27.13 69.03 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.758 179.719 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 68.4 p -71.04 -20.88 62.33 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 84.8 34.09 16.65 Favored Glycine 0 C--N 1.342 0.899 0 N-CA-C 111.855 -0.498 . . . . 0.0 111.855 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.4 p -78.85 -17.12 56.17 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 179.573 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.53 6.34 59.76 Favored Glycine 0 CA--C 1.538 1.511 0 CA-C-O 119.678 -0.512 . . . . 0.0 113.708 178.542 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -116.45 167.64 10.86 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 117.936 0.868 . . . . 0.0 111.313 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -69.46 143.99 53.38 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.713 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -114.79 171.09 13.53 Favored Glycine 0 CA--C 1.531 1.041 0 N-CA-C 110.836 -0.905 . . . . 0.0 110.836 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -118.27 139.35 26.66 Favored Pre-proline 0 N--CA 1.471 0.608 0 CA-C-N 116.642 0.221 . . . . 0.0 111.265 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -78.68 -25.31 6.61 Favored 'Trans proline' 0 N--CA 1.489 1.245 0 C-N-CA 122.191 1.927 . . . . 0.0 113.195 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 33.1 mmt180 -74.15 -33.03 63.38 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 178.521 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 71.0 p -74.57 -155.92 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 177.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -90.01 26.07 1.95 Allowed 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 118.2 0.454 . . . . 0.0 111.446 179.641 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 81.83 10.91 83.5 Favored Glycine 0 CA--C 1.539 1.537 0 N-CA-C 111.429 -0.668 . . . . 0.0 111.429 -179.258 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.95 163.32 17.76 Favored 'General case' 0 C--N 1.346 0.436 0 CA-C-N 117.335 0.568 . . . . 0.0 110.538 -179.185 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 28.3 p -74.7 -158.59 0.08 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.773 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -75.36 -47.03 29.48 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.752 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 16.3 t -69.58 -51.03 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 CA-C-O 120.749 0.309 . . . . 0.0 111.311 -178.13 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.1 m -62.88 -37.75 88.14 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -178.405 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.433 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 26.1 t80 -59.22 -45.99 89.65 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -178.682 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 38.5 pttt -74.13 -44.08 55.12 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 120.479 -0.488 . . . . 0.0 110.206 -179.545 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -55.5 -36.51 66.75 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.433 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 0.7 OUTLIER -86.5 -33.79 20.22 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 120.161 -0.616 . . . . 0.0 112.361 -179.302 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 11.0 tp -62.51 -28.97 70.21 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 121.251 -0.18 . . . . 0.0 111.435 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -63.76 -38.74 92.25 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.407 -179.643 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 9.8 tpp180 -76.45 -29.35 56.92 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.701 179.039 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.47 -38.43 62.93 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.488 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -74.67 -42.93 57.56 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.104 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -61.46 -33.09 73.16 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.233 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.2 m -82.29 -65.82 0.96 Allowed 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.067 179.368 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.62 -56.19 4.15 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 111.529 -0.628 . . . . 0.0 111.529 179.326 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 56.5 mtp85 -140.02 -69.27 0.41 Allowed 'General case' 0 C--O 1.233 0.199 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 18.9 mtt -99.55 146.11 26.77 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.462 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 96.7 p -105.62 144.52 29.03 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.251 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -56.05 -63.39 0.18 Allowed 'Trans proline' 0 N--CA 1.503 2.049 0 C-N-CA 122.21 1.94 . . . . 0.0 112.558 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 11.7 ttt -101.77 -59.13 1.75 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.59 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.12 -55.63 0.59 Allowed Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.3 t -144.56 150.9 38.28 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.525 0.203 . . . . 0.0 110.521 179.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -141.47 119.48 11.99 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.629 -179.761 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 12.6 t -147.58 104.74 3.64 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.584 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 68.11 41.06 87.86 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.05 -0.82 . . . . 0.0 111.05 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.2 m -98.99 -62.59 1.21 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.544 0.212 . . . . 0.0 110.515 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 12.3 p-10 -96.43 125.23 40.77 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.685 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.5 t -154.18 90.77 3.2 Favored Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.602 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -82.12 155.83 17.24 Favored 'Trans proline' 0 N--CA 1.493 1.455 0 C-N-CA 122.286 1.99 . . . . 0.0 111.902 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 6.4 m . . . . . 0 C--O 1.221 -0.421 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.587 -179.945 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.308 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.0 p -91.45 136.35 33.18 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.579 0.228 . . . . 0.0 110.438 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 55.2 mtt -143.13 121.68 12.47 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.541 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -92.71 -35.13 13.64 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.908 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.5 tm0? -80.67 -39.19 27.7 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.537 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -69.9 152.74 44.16 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.351 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.3 m -67.32 101.23 0.91 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.595 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -93.91 -38.94 10.95 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.576 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -78.79 135.48 37.1 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.428 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.561 HG23 ' O ' ' A' ' 10' ' ' THR . 6.3 t -151.12 92.97 3.71 Favored Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 116.444 -0.343 . . . . 0.0 110.757 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_exo -58.7 100.68 0.12 Allowed 'Trans proline' 0 N--CA 1.501 1.945 0 C-N-CA 122.322 2.014 . . . . 0.0 112.179 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -114.82 -61.54 0.38 Allowed Glycine 0 CA--C 1.539 1.532 0 N-CA-C 111.709 -0.556 . . . . 0.0 111.709 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_exo -60.64 100.68 0.16 Allowed 'Trans proline' 0 N--CA 1.499 1.8 0 C-N-CA 122.164 1.909 . . . . 0.0 112.177 -179.51 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 3.7 mmt -71.86 83.27 0.92 Allowed 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.359 179.747 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.5 mp -74.17 146.78 43.17 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.233 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.3 t -46.6 131.53 11.22 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -179.228 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -61.55 -32.33 72.39 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.931 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 76.5 p -72.35 -13.98 61.62 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.242 178.555 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 74.59 42.4 32.87 Favored Glycine 0 C--N 1.345 1.081 0 N-CA-C 111.667 -0.573 . . . . 0.0 111.667 179.255 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 29.4 p -80.3 -15.87 55.93 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.914 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.3 2.72 61.88 Favored Glycine 0 CA--C 1.54 1.611 0 CA-C-O 119.971 -0.349 . . . . 0.0 113.073 179.291 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -102.96 -168.13 1.48 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 117.373 0.587 . . . . 0.0 109.837 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -98.9 142.01 30.95 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 110.755 -0.091 . . . . 0.0 110.755 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -108.2 164.56 12.77 Favored Glycine 0 CA--C 1.531 1.07 0 N-CA-C 111.414 -0.675 . . . . 0.0 111.414 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.492 ' HB3' HG23 ' A' ' 28' ' ' THR . 13.2 t-20 -119.22 122.72 29.29 Favored Pre-proline 0 CA--C 1.54 0.587 0 CA-C-O 119.195 -0.431 . . . . 0.0 111.135 -179.424 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -67.37 -16.35 47.68 Favored 'Trans proline' 0 N--CA 1.493 1.471 0 C-N-CA 121.775 1.65 . . . . 0.0 112.957 178.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -76.77 -35.58 57.61 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 177.759 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.492 HG23 ' HB3' ' A' ' 25' ' ' ASN . 46.6 p -72.08 -156.66 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 178.109 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -91.22 26.62 2.14 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 118.235 0.47 . . . . 0.0 112.09 179.507 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 90.15 8.74 66.3 Favored Glycine 0 CA--C 1.534 1.246 0 CA-C-O 119.793 -0.448 . . . . 0.0 112.104 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.64 165.68 18.12 Favored 'General case' 0 C--N 1.345 0.399 0 CA-C-N 117.697 0.749 . . . . 0.0 111.326 -179.097 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 24.3 p -73.22 -156.45 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.744 -178.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.3 -51.48 11.9 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -179.065 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.3 t -67.94 -56.6 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -177.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 81.8 m -58.39 -38.09 76.61 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -178.256 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -57.16 -39.71 75.8 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -178.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 9.6 ttpt -75.82 -45.07 37.98 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.121 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -55.11 -38.86 68.69 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -179.055 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -85.31 -32.38 22.52 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 120.136 -0.626 . . . . 0.0 111.278 -179.635 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 25.6 tp -61.53 -30.3 70.54 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.612 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 22.8 tt0 -56.57 -37.54 70.72 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 120.732 0.301 . . . . 0.0 111.183 -179.584 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 45.5 mmm-85 -79.04 -28.22 43.22 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.558 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -81.19 -32.67 33.42 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 123.051 0.219 . . . . 0.0 111.45 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -74.29 -25.49 59.61 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.66 -38.87 92.02 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.571 0.224 . . . . 0.0 110.905 -179.629 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 77.8 p -97.22 -44.65 6.84 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.0 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 68.15 43.7 79.52 Favored Glycine 0 CA--C 1.526 0.769 0 N-CA-C 110.461 -1.056 . . . . 0.0 110.461 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 26.6 mmt180 -75.69 142.1 42.58 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.835 0.35 . . . . 0.0 111.556 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -122.52 33.93 5.3 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.36 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.3 t -162.01 144.7 8.85 Favored Pre-proline 0 CA--C 1.538 0.514 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.919 -179.735 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -82.24 96.92 0.88 Allowed 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 122.467 2.111 . . . . 0.0 112.005 179.579 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 26.7 mmt -103.29 -51.7 3.18 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.604 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 74.21 36.38 50.91 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 111.327 -0.709 . . . . 0.0 111.327 179.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.7 m -96.15 118.32 32.49 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 110.385 -0.228 . . . . 0.0 110.385 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -89.95 103.47 16.13 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.538 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.7 t -145.02 102.58 3.78 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.694 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 74.65 43.54 28.96 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.241 -0.744 . . . . 0.0 111.241 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 66.1 p -85.3 -52.02 6.18 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.595 0.236 . . . . 0.0 110.394 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -86.58 110.75 20.02 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.676 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 22.8 p -85.93 158.72 55.75 Favored Pre-proline 0 CA--C 1.534 0.334 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.294 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -75.5 -178.68 4.44 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 122.248 1.965 . . . . 0.0 112.152 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 17.6 p . . . . . 0 C--O 1.221 -0.44 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.525 -179.96 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.1 m -92.46 98.47 11.49 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.611 0.243 . . . . 0.0 110.724 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 34.9 mtt -154.27 32.46 0.43 Allowed 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.752 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -111.69 35.07 3.81 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.845 0.355 . . . . 0.0 110.604 179.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -131.86 37.84 3.59 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.18 0.514 . . . . 0.0 110.589 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -98.28 -53.23 3.41 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.225 179.7 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.3 m -90.63 140.46 29.74 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.65 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -130.74 -50.42 1.05 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.693 179.474 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -91.12 139.3 30.89 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.061 179.281 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.6 m -150.85 91.34 4.04 Favored Pre-proline 0 CA--C 1.536 0.413 0 CA-C-N 116.226 -0.443 . . . . 0.0 109.856 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_exo -58.82 164.62 9.47 Favored 'Trans proline' 0 N--CA 1.497 1.734 0 C-N-CA 122.335 2.024 . . . . 0.0 112.671 -178.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.413 ' N ' ' CD ' ' A' ' 13' ' ' PRO . . . 77.01 44.5 13.8 Favored Glycine 0 CA--C 1.538 1.48 0 CA-C-O 119.277 -0.735 . . . . 0.0 111.742 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.413 ' CD ' ' N ' ' A' ' 12' ' ' GLY . 39.7 Cg_endo -67.91 90.89 0.36 Allowed 'Trans proline' 0 N--CA 1.494 1.53 0 CA-C-N 119.532 1.666 . . . . 0.0 111.535 -179.279 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 12.5 mmt -64.86 82.39 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.286 -179.382 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.7 mp -80.42 147.23 31.07 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 178.798 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.3 t -49.21 115.86 1.47 Allowed 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 121.24 0.543 . . . . 0.0 112.359 -178.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 66.8 m -60.52 -20.1 59.18 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.073 -0.967 . . . . 0.0 113.129 -178.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.42 HG23 ' SD ' ' A' ' 31' ' ' MET . 76.0 p -80.74 -11.96 59.54 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.828 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 97.98 40.42 3.55 Favored Glycine 0 C--N 1.346 1.093 0 C-N-CA 121.272 -0.489 . . . . 0.0 112.454 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.4 m -87.39 -28.55 22.09 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.808 0.304 . . . . 0.0 111.718 179.353 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.49 8.13 85.34 Favored Glycine 0 CA--C 1.541 1.675 0 N-CA-C 111.463 -0.655 . . . . 0.0 111.463 -177.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -106.24 -175.98 2.95 Favored 'General case' 0 C--N 1.346 0.435 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -94.03 142.01 27.88 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 120.887 0.375 . . . . 0.0 111.474 -179.752 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -113.18 169.46 12.95 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 109.967 -1.253 . . . . 0.0 109.967 179.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -112.66 138.65 22.13 Favored Pre-proline 0 CA--C 1.537 0.478 0 CA-C-O 119.646 -0.216 . . . . 0.0 110.577 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -73.48 -27.18 13.38 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 C-N-CA 122.019 1.813 . . . . 0.0 112.547 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 67.2 mtt180 -72.83 -36.07 67.41 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 178.272 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 60.3 p -75.66 -154.51 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.154 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.41 ' HB2' ' CD1' ' A' ' 36' ' ' TYR . 0.4 OUTLIER -90.37 29.48 1.26 Allowed 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.256 0.48 . . . . 0.0 112.153 -179.697 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.25 17.0 65.54 Favored Glycine 0 CA--C 1.535 1.327 0 C-N-CA 121.126 -0.559 . . . . 0.0 112.374 179.708 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' MET . . . . . 0.42 ' SD ' HG23 ' A' ' 18' ' ' THR . 15.3 mtt -124.26 179.7 4.79 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 117.339 0.57 . . . . 0.0 109.79 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 20.2 p -83.63 -175.61 5.9 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 122.966 0.166 . . . . 0.0 110.591 -179.256 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.61 -45.61 78.57 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -177.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 6.4 t -66.28 -37.17 79.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 CA-C-O 120.76 0.314 . . . . 0.0 111.361 -178.415 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 21.7 m -73.49 -40.08 64.37 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.326 -178.707 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.43 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 18.4 t80 -61.82 -33.66 74.53 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -177.736 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.28 -45.85 18.92 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.472 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -62.88 -46.97 85.35 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -178.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' HIS . . . . . 0.43 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.7 p-80 -76.61 -40.5 49.23 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 119.964 -0.694 . . . . 0.0 112.375 -177.82 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 26.8 tp -60.45 -27.35 67.45 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 120.781 0.324 . . . . 0.0 110.827 178.32 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -66.77 -38.4 86.5 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.53 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -75.38 -30.09 60.06 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.741 -179.523 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -78.69 -34.88 45.78 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.502 0.191 . . . . 0.0 110.984 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -68.73 -43.23 76.35 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.721 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 -65.73 -20.69 66.37 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.783 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.3 t -60.75 -55.21 35.84 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.469 0.176 . . . . 0.0 111.324 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 146.13 68.5 0.01 OUTLIER Glycine 0 CA--C 1.526 0.763 0 N-CA-C 111.384 -0.686 . . . . 0.0 111.384 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.0 ttm180 -123.31 135.96 54.45 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 110.148 -0.315 . . . . 0.0 110.148 179.527 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 38.5 mtt -119.99 175.21 6.02 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.315 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.6 p -150.91 155.19 35.2 Favored Pre-proline 0 CA--C 1.535 0.37 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.457 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.04 -46.09 0.13 Allowed 'Trans proline' 0 N--CA 1.494 1.526 0 C-N-CA 122.341 2.028 . . . . 0.0 112.172 -179.621 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 10.2 ttp -111.48 146.0 38.03 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.231 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 92.27 36.41 6.27 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.3 p -79.65 114.22 18.41 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 110.494 -0.187 . . . . 0.0 110.494 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -81.54 177.01 9.2 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.598 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.4 t -142.05 170.74 15.14 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.401 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 109.6 -38.18 3.44 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.818 -0.913 . . . . 0.0 110.818 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.5 m -74.25 -47.39 35.45 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.546 0.212 . . . . 0.0 110.45 179.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -79.4 118.24 21.11 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.621 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.7 t -83.82 150.14 58.35 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.507 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -83.33 157.45 14.73 Favored 'Trans proline' 0 N--CA 1.492 1.417 0 C-N-CA 122.341 2.027 . . . . 0.0 112.148 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 40.5 p . . . . . 0 C--O 1.219 -0.541 0 CA-C-O 118.017 -0.992 . . . . 0.0 110.603 -179.89 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.303 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 52.3 p -136.73 -52.96 0.71 Allowed 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.545 0.212 . . . . 0.0 110.593 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 70.8 mtm -151.41 140.38 21.04 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.559 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -101.35 34.21 2.65 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.704 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -92.63 -35.98 13.23 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.743 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -74.5 169.35 17.91 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.452 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.3 m -72.62 110.04 6.69 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.565 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -70.86 -37.71 73.1 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.638 -179.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -72.38 127.62 33.11 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.729 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.2 p -148.66 109.1 3.56 Favored Pre-proline 0 CA--C 1.539 0.523 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.415 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -59.49 -178.88 0.17 Allowed 'Trans proline' 0 N--CA 1.498 1.763 0 C-N-CA 121.989 1.793 . . . . 0.0 112.11 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.433 ' N ' ' CD ' ' A' ' 13' ' ' PRO . . . 83.0 42.25 8.2 Favored Glycine 0 CA--C 1.542 1.757 0 CA-C-O 119.25 -0.75 . . . . 0.0 112.224 -179.568 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.433 ' CD ' ' N ' ' A' ' 12' ' ' GLY . 18.5 Cg_endo -58.71 -72.16 0.03 OUTLIER 'Trans proline' 0 N--CA 1.5 1.872 0 C-N-CA 122.098 1.865 . . . . 0.0 112.546 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.2 65.35 0.82 Allowed 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 120.667 0.27 . . . . 0.0 110.451 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.438 HD12 ' HA ' ' A' ' 15' ' ' LEU . 5.4 tp -79.56 144.8 33.56 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.948 -0.301 . . . . 0.0 110.338 -179.499 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.3 t -37.21 117.46 0.54 Allowed 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -179.193 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 49.0 m -58.91 -26.29 64.19 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.412 179.426 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 19.7 p -83.28 -8.43 59.45 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 73.59 43.24 37.32 Favored Glycine 0 C--N 1.347 1.14 0 C-N-CA 121.307 -0.473 . . . . 0.0 112.666 178.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.4 p -85.04 -14.32 47.71 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 117.119 0.46 . . . . 0.0 111.83 179.428 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 96.7 2.72 59.75 Favored Glycine 0 CA--C 1.538 1.493 0 CA-C-O 119.39 -0.672 . . . . 0.0 113.901 178.341 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -105.91 -171.24 1.87 Allowed 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.304 1.052 . . . . 0.0 110.539 -178.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -96.71 143.73 27.38 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.873 0.368 . . . . 0.0 111.436 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -111.35 161.15 12.87 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 110.199 -1.16 . . . . 0.0 110.199 179.044 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.412 ' HB3' HG23 ' A' ' 28' ' ' THR . 24.7 t30 -107.33 137.33 19.59 Favored Pre-proline 0 CA--C 1.535 0.368 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.672 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -72.73 -28.05 14.3 Favored 'Trans proline' 0 N--CA 1.491 1.382 0 C-N-CA 121.754 1.636 . . . . 0.0 111.957 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -71.92 -31.69 66.62 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.234 178.515 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.412 HG23 ' HB3' ' A' ' 25' ' ' ASN . 68.5 p -77.1 -150.81 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 178.21 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -90.53 29.58 1.27 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.724 0.693 . . . . 0.0 111.121 179.362 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 73.74 18.22 79.46 Favored Glycine 0 CA--C 1.533 1.187 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -178.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 10.7 mtt -128.84 172.36 11.38 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-N 116.905 0.353 . . . . 0.0 110.398 -179.256 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 57.9 m -60.89 172.26 1.01 Allowed 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.115 -179.145 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 35.6 m -72.01 -46.32 57.6 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 179.379 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 16.0 t -70.4 -36.72 67.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 116.097 -0.502 . . . . 0.0 109.89 179.516 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 80.2 m -72.19 -37.24 69.34 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.654 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -58.1 -33.13 68.77 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.736 -179.617 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.9 tttt -77.96 -44.15 27.65 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.037 0.446 . . . . 0.0 110.173 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -56.57 -40.83 75.87 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.844 -178.542 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 3.6 p80 -85.01 -33.63 22.51 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 120.321 -0.551 . . . . 0.0 112.162 -178.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.3 tp -60.79 -30.79 70.26 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 122.922 0.139 . . . . 0.0 111.219 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -68.64 -35.39 77.21 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.766 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.1 mmm-85 -71.68 -29.94 65.15 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.616 -179.477 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 -77.11 -31.06 55.57 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 121.254 -0.178 . . . . 0.0 111.375 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -77.24 -48.7 16.85 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.789 0.328 . . . . 0.0 110.483 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -62.7 -17.49 60.8 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.92 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.6 m -58.95 -60.76 3.35 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 111.616 0.228 . . . . 0.0 111.616 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 139.96 69.27 0.04 OUTLIER Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.728 -0.949 . . . . 0.0 110.728 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.1 ttt180 -58.56 -36.33 73.76 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 111.364 0.135 . . . . 0.0 111.364 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 10.9 mtp -82.51 -49.62 9.71 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.179 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.1 p -145.41 94.31 5.22 Favored Pre-proline 0 CA--C 1.538 0.487 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.68 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -56.07 -61.98 0.29 Allowed 'Trans proline' 0 N--CA 1.501 1.927 0 C-N-CA 122.212 1.941 . . . . 0.0 112.234 179.592 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -125.08 -50.48 1.69 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.19 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 144.3 -37.23 1.41 Allowed Glycine 0 CA--C 1.525 0.718 0 N-CA-C 111.026 -0.83 . . . . 0.0 111.026 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.5 t -133.42 148.13 51.77 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.59 0.233 . . . . 0.0 110.639 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -145.28 148.66 33.7 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.591 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 13.0 m -150.15 153.14 35.82 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.692 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 120.65 72.62 0.33 Allowed Glycine 0 CA--C 1.526 0.771 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 74.4 m -104.27 34.84 2.91 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 120.849 0.357 . . . . 0.0 110.709 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 15.6 p30 -70.48 147.41 49.43 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.687 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.4 p -86.99 158.31 53.21 Favored Pre-proline 0 CA--C 1.535 0.387 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.623 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -73.51 118.59 5.55 Favored 'Trans proline' 0 N--CA 1.495 1.595 0 C-N-CA 122.221 1.947 . . . . 0.0 112.189 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 59.2 p . . . . . 0 N--CA 1.476 0.827 0 CA-C-O 118.216 -0.897 . . . . 0.0 112.039 179.959 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.241 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.5 m -84.77 165.96 17.37 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.544 0.211 . . . . 0.0 110.884 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.8 ptt? -77.09 142.41 39.79 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.605 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -137.39 -63.01 0.6 Allowed 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.376 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -103.11 33.43 3.29 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.762 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -81.87 -41.94 20.27 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.475 179.596 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.0 p -74.13 105.34 5.3 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.863 -179.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -107.1 -39.89 5.59 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.547 -179.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -92.82 161.83 14.35 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.947 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' THR . . . . . 0.56 HG23 ' O ' ' A' ' 10' ' ' THR . 5.0 t -156.19 94.86 2.38 Favored Pre-proline 0 CA--C 1.544 0.726 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.273 179.48 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -80.65 117.24 3.32 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 C-N-CA 122.216 1.944 . . . . 0.0 112.113 -179.672 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -175.48 -62.42 0.06 OUTLIER Glycine 0 CA--C 1.535 1.311 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -80.72 85.38 1.82 Allowed 'Trans proline' 0 N--CA 1.494 1.525 0 C-N-CA 122.373 2.049 . . . . 0.0 111.997 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 6.8 mmt -71.4 81.63 0.77 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.805 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -78.52 146.16 34.49 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.688 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.3 t -42.64 117.98 1.13 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -178.817 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.34 -23.68 50.41 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.72 179.285 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 46.4 p -81.33 -12.22 59.09 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -179.351 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.11 43.4 10.8 Favored Glycine 0 C--N 1.344 1.003 0 C-N-CA 121.255 -0.498 . . . . 0.0 112.58 178.757 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 3.7 p -87.44 -15.56 37.37 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 117.252 0.526 . . . . 0.0 111.989 179.391 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 92.71 4.35 65.58 Favored Glycine 0 CA--C 1.54 1.623 0 CA-C-O 119.639 -0.534 . . . . 0.0 114.071 178.144 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 36.7 m-85 -106.12 -169.53 1.59 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 117.944 0.872 . . . . 0.0 110.062 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -96.45 141.38 29.81 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.143 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -116.52 171.92 13.99 Favored Glycine 0 CA--C 1.529 0.956 0 N-CA-C 110.554 -1.019 . . . . 0.0 110.554 179.011 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -122.53 143.12 38.98 Favored Pre-proline 0 CA--C 1.538 0.497 0 CA-C-N 116.82 0.31 . . . . 0.0 111.181 -179.029 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -77.01 -21.76 11.97 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 C-N-CA 122.122 1.881 . . . . 0.0 113.122 179.302 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 5.9 mpt_? -73.98 -34.94 64.4 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 64.4 p -74.25 -156.69 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 178.027 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -91.52 25.5 2.62 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 118.379 0.536 . . . . 0.0 111.596 179.589 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.63 13.64 69.68 Favored Glycine 0 CA--C 1.538 1.476 0 N-CA-C 112.041 -0.424 . . . . 0.0 112.041 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.51 165.91 17.62 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-N 117.483 0.642 . . . . 0.0 111.387 -179.25 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 60.7 m -57.34 178.2 0.08 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.788 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 13.2 m -71.76 -43.0 66.53 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 16.2 t -73.98 -37.49 47.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.733 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 71.2 m -72.03 -38.14 69.62 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.715 -179.348 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -55.93 -38.68 70.61 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-O 120.625 0.25 . . . . 0.0 111.072 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.9 tttt -76.96 -43.9 33.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.955 -179.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -55.95 -40.01 72.57 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.744 -178.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -84.02 -32.73 24.75 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 120.087 -0.645 . . . . 0.0 111.414 -179.529 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 15.1 tp -60.21 -26.46 66.4 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.747 -0.206 . . . . 0.0 111.392 179.589 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -69.51 -37.81 77.34 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.461 0.172 . . . . 0.0 110.665 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.7 -32.27 60.02 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.7 179.812 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -70.62 -43.09 69.99 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.985 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 -57.68 -26.13 61.27 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.755 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -61.32 -19.68 62.07 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 123.039 0.212 . . . . 0.0 111.423 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 10.8 t -59.61 -36.65 76.74 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.582 0.23 . . . . 0.0 111.169 -179.812 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.7 -41.93 2.02 Favored Glycine 0 CA--C 1.524 0.638 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -78.34 134.08 37.51 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.537 0.208 . . . . 0.0 110.844 -179.774 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.8 mtt -95.8 164.73 12.62 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.428 179.791 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.7 t -162.28 93.89 1.27 Allowed Pre-proline 0 CA--C 1.539 0.532 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.778 179.839 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -73.54 -35.77 4.46 Favored 'Trans proline' 0 N--CA 1.497 1.734 0 C-N-CA 122.263 1.976 . . . . 0.0 112.488 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.64 -175.4 3.44 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.79 0.328 . . . . 0.0 110.257 -179.683 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 137.64 -53.93 0.72 Allowed Glycine 0 CA--C 1.527 0.794 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 77.4 p -74.19 134.0 42.75 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.476 0.179 . . . . 0.0 110.617 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -69.57 134.75 49.17 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.584 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.1 t -76.59 112.79 13.51 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.531 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 86.75 52.13 3.23 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 111.01 -0.836 . . . . 0.0 111.01 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.1 t -80.33 -43.91 20.41 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.593 0.235 . . . . 0.0 110.516 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -78.23 149.73 33.58 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.745 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.1 t -139.22 90.84 11.54 Favored Pre-proline 0 CA--C 1.539 0.527 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.23 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -58.4 157.43 26.6 Favored 'Trans proline' 0 N--CA 1.498 1.768 0 C-N-CA 122.301 2.001 . . . . 0.0 112.163 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 39.8 p . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.465 -179.941 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 4.5 mmt . . . . . 0 CA--C 1.536 0.408 0 CA-C-O 120.916 0.389 . . . . 0.0 110.372 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -75.02 144.92 42.85 Favored 'General case' 0 CA--C 1.527 0.094 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 8.7 t -49.78 128.06 17.34 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 112.27 0.471 . . . . 0.0 112.27 -179.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 28.5 m -63.71 -30.21 71.34 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.822 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 80.5 p -73.61 -19.01 60.98 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.03 43.12 6.82 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 121.216 -0.516 . . . . 0.0 112.863 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.8 p -85.7 -22.35 27.87 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 117.286 0.543 . . . . 0.0 111.108 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.28 8.08 50.77 Favored Glycine 0 CA--C 1.537 1.433 0 CA-C-O 119.85 -0.417 . . . . 0.0 113.165 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -114.3 159.37 20.28 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 117.673 0.737 . . . . 0.0 110.425 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.7 t80 -67.57 146.66 53.68 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.98 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -118.43 -179.08 17.07 Favored Glycine 0 CA--C 1.53 0.975 0 N-CA-C 110.526 -1.029 . . . . 0.0 110.526 179.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.3 t30 -126.94 138.88 33.57 Favored Pre-proline 0 N--CA 1.47 0.568 0 CA-C-O 119.466 -0.302 . . . . 0.0 110.528 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -77.11 -22.65 11.12 Favored 'Trans proline' 0 N--CA 1.489 1.206 0 C-N-CA 121.922 1.748 . . . . 0.0 112.53 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 28.2 mtm180 -71.17 -34.14 70.65 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 67.2 p -74.55 -157.49 0.06 Allowed 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 107.594 -1.262 . . . . 0.0 107.594 177.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -90.94 25.41 2.42 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 118.333 0.515 . . . . 0.0 111.208 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 82.52 10.6 83.18 Favored Glycine 0 CA--C 1.541 1.676 0 N-CA-C 111.65 -0.58 . . . . 0.0 111.65 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 3.0 mpp? -115.24 156.42 25.41 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 117.195 0.498 . . . . 0.0 110.448 -179.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 22.9 p -69.98 -160.63 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.036 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.47 -48.3 28.18 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -178.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 8.3 t -68.81 -56.92 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 N-CA-C 111.727 0.269 . . . . 0.0 111.727 -177.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 81.2 m -57.82 -35.32 70.71 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -178.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -62.96 -31.09 72.12 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 121.347 -0.141 . . . . 0.0 111.295 -179.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.7 tttt -75.67 -48.61 21.33 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.72 0.295 . . . . 0.0 110.717 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -63.31 -42.34 99.02 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.138 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 63.9 t60 -63.95 -48.37 76.79 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.621 -179.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 tp -63.63 -30.4 71.51 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 111.627 0.232 . . . . 0.0 111.627 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -65.03 -40.95 95.58 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 120.85 0.357 . . . . 0.0 110.329 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.87 -31.46 64.74 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.117 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 . . . . . 0 N--CA 1.464 0.275 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.573 -179.626 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.323 0 N-CA-C 110.17 -0.307 . . . . 0.0 110.17 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.2 mp -75.05 146.58 41.42 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.193 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.2 t -46.7 137.08 7.29 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -179.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.5 m -65.95 -33.94 76.96 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.008 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 79.8 p -70.19 -13.43 62.18 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.309 -0.405 . . . . 0.0 112.084 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.26 25.61 63.4 Favored Glycine 0 CA--C 1.531 1.039 0 N-CA-C 112.133 -0.387 . . . . 0.0 112.133 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.7 p -65.91 -19.3 65.82 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 117.277 0.538 . . . . 0.0 111.832 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.45 8.06 58.8 Favored Glycine 0 CA--C 1.538 1.477 0 CA-C-O 119.863 -0.409 . . . . 0.0 112.967 179.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 44.4 m-85 -104.39 -173.07 2.22 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 117.506 0.653 . . . . 0.0 110.628 -179.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -97.05 142.33 29.12 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.78 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -113.89 176.13 16.9 Favored Glycine 0 CA--C 1.531 1.046 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -126.02 141.28 39.11 Favored Pre-proline 0 CA--C 1.54 0.586 0 CA-C-O 119.488 -0.291 . . . . 0.0 110.903 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -75.22 -24.16 12.74 Favored 'Trans proline' 0 N--CA 1.496 1.626 0 C-N-CA 122.234 1.956 . . . . 0.0 112.787 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 28.5 mtt-85 -72.59 -32.01 65.64 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 178.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.4 p -81.03 -152.98 0.09 Allowed 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 177.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -92.33 28.5 1.92 Allowed 'General case' 0 C--O 1.236 0.382 0 CA-C-N 118.166 0.439 . . . . 0.0 111.53 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 76.34 12.72 84.01 Favored Glycine 0 CA--C 1.537 1.452 0 C-N-CA 121.094 -0.574 . . . . 0.0 111.837 -179.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 14.7 mtt -118.33 168.31 10.74 Favored 'General case' 0 C--N 1.347 0.484 0 CA-C-N 117.568 0.684 . . . . 0.0 111.168 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 20.7 p -78.43 -164.1 0.52 Allowed 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.392 -178.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.27 -45.39 48.04 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -178.474 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 21.3 t -70.71 -57.19 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 83.5 m -58.99 -35.16 72.76 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -178.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -66.74 -29.88 69.96 Favored 'General case' 0 N--CA 1.467 0.417 0 O-C-N 123.074 0.234 . . . . 0.0 111.602 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.5 tttt -76.0 -48.04 22.58 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.594 0.235 . . . . 0.0 110.641 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -62.46 -37.78 87.24 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.741 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 32.4 t60 -61.05 -49.02 79.07 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.281 -179.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.3 mp -59.45 -27.99 66.57 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.668 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 4.5 tp60 -60.02 -43.01 95.55 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 120.367 0.127 . . . . 0.0 111.336 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -69.24 -29.63 67.6 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.219 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 . . . . . 0 N--CA 1.467 0.415 0 CA-C-O 120.567 0.222 . . . . 0.0 111.233 179.886 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 14.9 mtt . . . . . 0 CA--C 1.535 0.401 0 CA-C-O 121.029 0.442 . . . . 0.0 110.509 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.514 HD13 ' O ' ' A' ' 22' ' ' PHE . 2.6 mm? -74.21 146.07 43.65 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.627 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.8 t -45.53 137.81 4.82 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -179.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 66.6 m -69.95 -24.53 63.36 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.811 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 75.0 p -80.48 -17.99 49.98 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.43 31.14 22.85 Favored Glycine 0 C--N 1.34 0.762 0 C-N-CA 121.117 -0.564 . . . . 0.0 112.401 179.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.5 p -72.96 -19.79 61.17 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.904 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 97.17 10.46 54.51 Favored Glycine 0 CA--C 1.538 1.491 0 CA-C-O 119.778 -0.457 . . . . 0.0 113.035 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.514 ' O ' HD13 ' A' ' 15' ' ' LEU . 75.8 m-85 -117.06 166.0 12.72 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 117.707 0.753 . . . . 0.0 111.335 -179.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -67.48 145.74 54.66 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.303 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -110.58 163.72 12.3 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.498 ' HB3' HG23 ' A' ' 28' ' ' THR . 22.7 t30 -113.06 126.45 28.21 Favored Pre-proline 0 CA--C 1.539 0.556 0 CA-C-O 119.379 -0.343 . . . . 0.0 110.236 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.08 -16.63 28.67 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 121.825 1.684 . . . . 0.0 113.073 179.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 50.0 mtt180 -76.89 -35.01 57.71 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 177.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.498 HG23 ' HB3' ' A' ' 25' ' ' ASN . 42.9 p -73.03 -154.77 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 178.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -90.83 27.52 1.77 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.17 0.441 . . . . 0.0 111.253 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 84.94 10.89 77.84 Favored Glycine 0 CA--C 1.537 1.418 0 N-CA-C 111.714 -0.554 . . . . 0.0 111.714 -179.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.92 163.49 19.18 Favored 'General case' 0 C--N 1.344 0.336 0 CA-C-N 117.039 0.419 . . . . 0.0 110.645 -179.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 23.9 p -72.16 -158.31 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.71 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.21 -51.49 11.99 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -178.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 10.8 t -66.2 -54.83 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 N-CA-C 111.56 0.208 . . . . 0.0 111.56 -178.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 75.9 m -58.35 -36.14 73.0 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -178.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.405 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 20.0 t80 -57.39 -41.36 80.12 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 111.512 0.19 . . . . 0.0 111.512 -179.161 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.6 ttpt -75.14 -45.45 40.78 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.918 0.39 . . . . 0.0 110.343 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 -54.75 -39.76 68.64 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.802 -0.635 . . . . 0.0 112.525 -179.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.405 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.0 OUTLIER -84.6 -32.74 23.58 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.358 -179.897 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.0 tp -61.69 -27.28 68.58 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.889 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -69.08 -38.94 79.27 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 26.5 mtt-85 -70.83 -30.71 67.21 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.82 179.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 . . . . . 0 C--O 1.232 0.168 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.803 179.89 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 29.7 mmm . . . . . 0 C--O 1.235 0.312 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.7 mp -79.31 145.43 33.48 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.717 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 8.8 t -45.34 131.54 8.1 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -178.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.0 m -62.59 -24.84 67.77 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.215 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 33.7 p -81.2 -10.62 59.59 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -178.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 78.12 25.48 61.76 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.53 179.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.6 p -67.45 -15.57 63.74 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-N 117.324 0.562 . . . . 0.0 111.279 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.15 8.87 68.18 Favored Glycine 0 CA--C 1.535 1.321 0 CA-C-O 119.997 -0.335 . . . . 0.0 113.206 179.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -106.15 -173.6 2.34 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 117.31 0.555 . . . . 0.0 110.303 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -93.14 141.71 28.12 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.865 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -112.75 169.32 12.94 Favored Glycine 0 CA--C 1.528 0.887 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 179.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -115.61 138.42 23.82 Favored Pre-proline 0 CA--C 1.541 0.632 0 CA-C-O 119.65 -0.214 . . . . 0.0 110.673 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -76.65 -25.92 8.9 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 122.49 2.126 . . . . 0.0 112.588 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 13.9 mtt-85 -73.84 -29.26 62.03 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.194 178.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 67.9 p -85.49 -150.43 0.13 Allowed 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 177.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -91.7 28.08 1.87 Allowed 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 118.791 0.723 . . . . 0.0 111.623 179.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 74.56 16.41 80.12 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 121.255 -0.498 . . . . 0.0 111.972 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 35.0 mtt -117.45 163.81 15.83 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 117.339 0.57 . . . . 0.0 109.903 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 31.3 p -73.76 -163.82 0.19 Allowed 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.774 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.47 -41.97 62.5 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.315 0.857 . . . . 0.0 113.315 -178.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 10.1 t -72.52 -49.81 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-O 120.785 0.326 . . . . 0.0 110.869 -178.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 72.5 m -65.41 -36.2 83.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.538 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -65.76 -36.8 84.58 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.12 -44.62 46.03 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.266 -0.574 . . . . 0.0 109.716 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -65.35 -43.26 91.39 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 123.146 0.279 . . . . 0.0 111.24 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -59.52 -49.25 78.49 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -178.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.04 -25.94 65.73 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.005 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -64.41 -39.64 94.23 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 111.566 0.21 . . . . 0.0 111.566 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 10.4 mtt-85 -74.85 -30.51 61.37 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.15 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 . . . . . 0 N--CA 1.463 0.205 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.537 179.966 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 12.3 mmt . . . . . 0 CA--C 1.533 0.305 0 CA-C-O 120.988 0.423 . . . . 0.0 111.24 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mp -76.11 143.56 41.19 Favored 'General case' 0 C--O 1.232 0.144 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.5 t -40.05 131.48 1.99 Allowed 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 -178.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 47.7 m -65.36 -26.2 67.92 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.16 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 51.9 p -78.96 -12.91 60.05 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 121.186 -0.206 . . . . 0.0 111.377 179.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 78.38 37.13 28.57 Favored Glycine 0 C--N 1.349 1.292 0 CA-C-O 119.808 -0.44 . . . . 0.0 113.375 178.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 29.1 p -77.56 -7.98 57.14 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 117.258 0.529 . . . . 0.0 111.801 178.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 85.4 5.94 84.43 Favored Glycine 0 CA--C 1.538 1.507 0 CA-C-O 119.774 -0.459 . . . . 0.0 113.207 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -109.79 172.02 7.1 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 117.679 0.739 . . . . 0.0 109.995 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -78.49 145.7 34.81 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.155 -178.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -118.59 169.35 13.43 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -112.27 141.81 25.77 Favored Pre-proline 0 N--CA 1.471 0.597 0 CA-C-N 116.73 0.265 . . . . 0.0 110.774 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.0 -29.35 6.78 Favored 'Trans proline' 0 N--CA 1.495 1.565 0 C-N-CA 122.082 1.854 . . . . 0.0 112.307 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -71.72 -27.28 62.91 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 178.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 71.0 p -83.6 -152.74 0.13 Allowed 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -90.87 26.72 2.0 Allowed 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 118.236 0.471 . . . . 0.0 111.238 179.32 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 72.97 15.53 78.41 Favored Glycine 0 CA--C 1.536 1.4 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 -177.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.7 mtp -121.65 163.41 19.02 Favored 'General case' 0 C--N 1.347 0.491 0 CA-C-N 117.085 0.443 . . . . 0.0 109.94 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 29.9 p -74.57 -167.39 0.55 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.911 -178.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.15 -37.68 61.24 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 -177.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.0 t -72.13 -49.42 43.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-O 120.579 0.228 . . . . 0.0 111.247 -177.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 67.4 m -70.27 -34.45 72.81 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.73 -178.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -69.47 -27.51 65.28 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 119.447 -0.311 . . . . 0.0 111.293 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt -78.12 -45.99 21.87 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 117.992 0.36 . . . . 0.0 110.041 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -64.7 -38.87 92.48 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.587 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 54.3 t60 -66.12 -41.41 90.58 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.096 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.2 tp -71.61 -42.22 67.95 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.132 -178.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -65.09 -35.83 82.39 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.865 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 11.2 ttt180 -77.14 -28.48 54.28 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.722 178.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 . . . . . 0 CA--C 1.535 0.389 0 CA-C-N 116.749 -0.205 . . . . 0.0 111.067 179.557 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 4.2 mmt . . . . . 0 C--O 1.234 0.245 0 CA-C-O 121.102 0.477 . . . . 0.0 110.308 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.1 tp -74.83 144.75 43.32 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.294 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.2 t -44.1 132.38 5.59 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -178.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.0 m -65.44 -32.89 74.75 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.332 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 73.8 p -72.65 -13.4 61.35 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.23 43.48 25.61 Favored Glycine 0 C--N 1.345 1.054 0 N-CA-C 111.771 -0.532 . . . . 0.0 111.771 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 29.2 p -85.38 -14.38 46.51 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.59 4.38 60.68 Favored Glycine 0 CA--C 1.536 1.406 0 C-N-CA 121.306 -0.473 . . . . 0.0 113.296 179.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -114.09 163.62 14.93 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-N 117.674 0.737 . . . . 0.0 110.561 -179.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -68.05 144.77 54.96 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.749 -179.016 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -110.13 161.19 13.03 Favored Glycine 0 CA--C 1.528 0.848 0 N-CA-C 110.777 -0.929 . . . . 0.0 110.777 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.412 ' HB3' HG23 ' A' ' 28' ' ' THR . 22.5 t30 -108.1 118.9 51.49 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-O 119.329 -0.367 . . . . 0.0 110.606 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -67.18 -18.91 51.13 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 C-N-CA 121.675 1.583 . . . . 0.0 112.154 179.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 60.9 mtp180 -75.36 -31.98 60.69 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 177.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.412 HG23 ' HB3' ' A' ' 25' ' ' ASN . 70.4 p -79.09 -153.44 0.07 Allowed 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -89.93 26.54 1.79 Allowed 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 118.204 0.456 . . . . 0.0 111.982 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.02 10.68 78.06 Favored Glycine 0 CA--C 1.536 1.391 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.75 161.8 21.96 Favored 'General case' 0 C--N 1.347 0.457 0 CA-C-N 117.249 0.524 . . . . 0.0 111.193 -178.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 31.1 p -72.25 -157.43 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.652 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.58 -49.26 19.11 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -178.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.4 t -69.68 -52.04 35.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -177.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 71.2 m -60.05 -36.15 76.7 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -178.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.445 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 14.5 t80 -58.87 -48.42 81.46 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 -178.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.1 pttt -72.32 -44.14 63.11 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -54.63 -39.61 68.13 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.179 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.445 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 0.8 OUTLIER -85.34 -33.33 22.08 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 120.425 -0.51 . . . . 0.0 111.753 -179.445 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 14.9 tp -62.47 -30.6 71.37 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.453 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -65.93 -39.29 90.38 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.379 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 70.0 mtt-85 -79.23 -30.86 43.41 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.572 -0.286 . . . . 0.0 111.229 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.9 tp60 . . . . . 0 CA--C 1.531 0.243 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.076 179.609 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 11.3 mmt . . . . . 0 C--O 1.237 0.444 0 CA-C-O 120.797 0.332 . . . . 0.0 110.313 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.448 HD23 ' HA ' ' A' ' 15' ' ' LEU . 18.2 mt -79.36 140.43 37.48 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.375 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.7 t -38.93 136.19 0.8 Allowed 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -177.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m -64.92 -29.33 70.26 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.534 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 44.0 p -82.23 -6.96 59.59 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 71.73 43.52 51.09 Favored Glycine 0 C--N 1.344 0.978 0 C-N-CA 121.24 -0.505 . . . . 0.0 112.085 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.4 p -82.29 -6.81 59.5 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.3 0.62 79.81 Favored Glycine 0 CA--C 1.54 1.614 0 CA-C-O 119.648 -0.529 . . . . 0.0 112.954 179.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -110.64 177.6 4.63 Favored 'General case' 0 C--N 1.344 0.363 0 CA-C-N 117.791 0.795 . . . . 0.0 111.151 -179.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -84.13 144.91 28.7 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.51 -178.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -114.25 159.59 13.63 Favored Glycine 0 CA--C 1.53 1.019 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 178.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -105.97 140.0 20.8 Favored Pre-proline 0 N--CA 1.468 0.428 0 CA-C-O 119.3 -0.381 . . . . 0.0 110.245 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -75.22 -23.15 13.72 Favored 'Trans proline' 0 N--CA 1.489 1.239 0 C-N-CA 121.746 1.63 . . . . 0.0 112.598 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 85.8 mtt-85 -75.33 -28.45 59.65 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 178.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 60.9 p -80.95 -151.29 0.08 Allowed 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 178.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -92.11 28.17 1.95 Allowed 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 117.984 0.356 . . . . 0.0 111.274 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 76.79 15.64 81.43 Favored Glycine 0 CA--C 1.536 1.349 0 N-CA-C 111.272 -0.731 . . . . 0.0 111.272 -178.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 40.2 mtt -123.65 169.76 11.15 Favored 'General case' 0 C--N 1.347 0.474 0 CA-C-N 117.389 0.594 . . . . 0.0 111.334 -179.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 22.4 p -79.08 -165.82 0.82 Allowed 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.781 -178.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.8 -41.98 51.29 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 13.9 t -68.27 -49.3 68.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -177.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 60.8 m -72.1 -34.64 68.79 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 -178.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -64.95 -27.03 68.56 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -178.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 55.2 tttt -75.94 -41.66 50.98 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -67.12 -45.8 76.05 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.458 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 42.3 t60 -57.56 -45.51 85.06 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 -178.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.0 mp -62.88 -29.12 70.52 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.958 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -66.79 -32.46 73.77 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 121.078 -0.249 . . . . 0.0 111.1 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -83.58 -33.59 25.35 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.672 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 . . . . . 0 CA--C 1.535 0.373 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.378 179.643 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 1.2 mpt? . . . . . 0 C--O 1.233 0.229 0 CA-C-O 120.539 0.209 . . . . 0.0 110.757 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.462 HD13 ' O ' ' A' ' 22' ' ' PHE . 2.1 mm? -78.22 142.84 37.63 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.83 179.722 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.1 t -51.1 120.95 5.42 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 39.5 m -59.67 -25.36 64.67 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.429 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 66.7 p -72.04 -18.95 61.91 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.63 39.71 8.09 Favored Glycine 0 C--N 1.342 0.91 0 C-N-CA 121.194 -0.527 . . . . 0.0 111.988 178.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.5 p -89.28 -20.38 24.17 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 120.946 -0.301 . . . . 0.0 111.359 178.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 93.96 5.5 62.54 Favored Glycine 0 CA--C 1.538 1.514 0 CA-C-O 120.011 -0.327 . . . . 0.0 113.248 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.462 ' O ' HD13 ' A' ' 15' ' ' LEU . 18.7 m-85 -103.14 -177.57 3.41 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-N 117.444 0.622 . . . . 0.0 110.937 -179.125 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.7 t80 -89.01 134.03 34.13 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.299 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -107.95 165.38 12.9 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.876 -179.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -114.92 134.89 22.41 Favored Pre-proline 0 CA--C 1.541 0.631 0 CA-C-O 119.523 -0.275 . . . . 0.0 111.419 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -76.55 -26.39 8.57 Favored 'Trans proline' 0 N--CA 1.496 1.638 0 C-N-CA 122.386 2.057 . . . . 0.0 112.228 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 36.3 mtt-85 -71.14 -33.33 69.97 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 45.9 p -77.52 -154.0 0.06 Allowed 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -91.58 27.65 1.95 Allowed 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.322 0.51 . . . . 0.0 111.466 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.88 15.3 79.44 Favored Glycine 0 CA--C 1.534 1.244 0 N-CA-C 112.315 -0.314 . . . . 0.0 112.315 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -118.89 164.18 15.81 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 117.195 0.498 . . . . 0.0 110.706 -179.144 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 31.2 p -76.26 -157.57 0.08 Allowed 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.549 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.78 -50.4 20.75 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -179.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 21.3 t -67.36 -55.8 15.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -177.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 91.1 m -55.73 -36.62 67.44 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -178.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.464 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 35.3 t80 -59.62 -43.18 93.86 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.1 ttpt -73.32 -46.37 49.84 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.724 0.297 . . . . 0.0 110.385 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -54.85 -39.4 68.58 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.376 -178.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.464 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 0.8 OUTLIER -85.98 -33.28 21.14 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 120.309 -0.557 . . . . 0.0 112.212 -179.238 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 17.5 tp -63.98 -33.4 75.64 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.555 0.217 . . . . 0.0 111.057 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -69.12 -38.75 79.04 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.864 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 45.7 mtp180 -72.8 -32.35 65.49 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.179 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 . . . . . 0 N--CA 1.465 0.303 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.734 -179.725 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 3.6 mmt . . . . . 0 C--O 1.235 0.331 0 CA-C-O 120.888 0.375 . . . . 0.0 110.346 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.96 144.99 40.68 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.5 t -46.3 134.03 9.11 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -178.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.9 m -67.92 -24.56 65.21 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 114.869 -1.06 . . . . 0.0 112.153 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.62 HG23 ' SD ' ' A' ' 31' ' ' MET . 76.9 p -81.53 -16.91 50.33 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -179.241 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.21 34.41 14.61 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 121.007 -0.616 . . . . 0.0 112.19 178.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 27.2 p -77.74 -18.54 56.41 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.841 178.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 91.62 9.8 62.47 Favored Glycine 0 CA--C 1.534 1.248 0 CA-C-O 119.982 -0.343 . . . . 0.0 112.759 179.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -105.8 -171.05 1.83 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 117.485 0.643 . . . . 0.0 110.602 -179.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -97.46 143.57 28.05 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.66 0.267 . . . . 0.0 111.106 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -113.36 170.85 13.54 Favored Glycine 0 CA--C 1.528 0.856 0 N-CA-C 110.297 -1.121 . . . . 0.0 110.297 179.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -122.82 140.57 33.49 Favored Pre-proline 0 CA--C 1.538 0.513 0 CA-C-O 119.467 -0.301 . . . . 0.0 110.561 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -75.63 -17.36 18.27 Favored 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 121.835 1.69 . . . . 0.0 112.677 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.1 mmt180 -78.26 -34.24 49.19 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 40.7 p -77.63 -151.31 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 178.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -88.94 29.36 1.05 Allowed 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 118.534 0.607 . . . . 0.0 111.2 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 74.39 15.39 80.3 Favored Glycine 0 CA--C 1.535 1.301 0 N-CA-C 111.993 -0.443 . . . . 0.0 111.993 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.62 ' SD ' HG23 ' A' ' 18' ' ' THR . 10.9 mtt -129.04 176.57 7.78 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 117.416 0.608 . . . . 0.0 109.979 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 14.6 p -77.37 -169.31 1.37 Allowed 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.306 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -74.85 -47.21 31.5 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -177.62 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 20.2 t -68.27 -52.49 37.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 120.999 -0.281 . . . . 0.0 111.3 -178.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 79.2 m -60.73 -36.99 80.24 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.146 -179.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.446 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 29.2 t80 -57.82 -33.21 68.37 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.517 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.4 mtpt -77.02 -45.86 25.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.804 0.335 . . . . 0.0 110.101 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -58.68 -41.3 85.88 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.446 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.3 p-80 -82.11 -36.13 27.85 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 120.21 -0.596 . . . . 0.0 111.697 -178.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.9 tp -62.02 -28.81 69.85 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.576 0.227 . . . . 0.0 110.877 179.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -61.82 -38.69 89.09 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.643 179.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 60.2 mtt180 -77.11 -29.45 54.79 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.55 178.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 . . . . . 0 CA--C 1.533 0.289 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.689 179.497 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 19.1 mtt . . . . . 0 N--CA 1.465 0.292 0 CA-C-O 120.521 0.201 . . . . 0.0 111.42 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.438 HD13 ' O ' ' A' ' 22' ' ' PHE . 0.9 OUTLIER -73.77 140.97 46.27 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.255 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.2 t -39.67 137.06 0.92 Allowed 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -178.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 57.8 m -61.65 -25.41 67.36 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.197 -179.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 68.1 p -90.76 -5.58 55.49 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -178.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.35 41.38 85.69 Favored Glycine 0 C--N 1.341 0.841 0 N-CA-C 111.482 -0.647 . . . . 0.0 111.482 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 15.2 p -86.58 -13.23 46.37 Favored 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.2 -7.48 54.51 Favored Glycine 0 CA--C 1.542 1.765 0 CA-C-O 119.746 -0.474 . . . . 0.0 113.539 178.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.438 ' O ' HD13 ' A' ' 15' ' ' LEU . 11.4 m-85 -91.41 178.91 5.82 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 117.627 0.714 . . . . 0.0 110.895 -178.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -89.71 135.62 33.51 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.336 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -100.78 140.18 14.76 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 111.069 -0.813 . . . . 0.0 111.069 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -99.89 135.47 20.45 Favored Pre-proline 0 CA--C 1.538 0.491 0 CA-C-O 119.446 -0.312 . . . . 0.0 110.253 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -74.79 -21.78 16.0 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 121.791 1.66 . . . . 0.0 112.863 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -75.3 -31.75 60.77 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 178.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 54.0 p -79.59 -153.27 0.08 Allowed 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 178.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -91.45 27.34 2.0 Allowed 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 118.331 0.514 . . . . 0.0 111.046 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.35 17.25 76.57 Favored Glycine 0 CA--C 1.539 1.593 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -178.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 28.5 mtt -120.58 160.5 23.1 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-O 121.097 0.475 . . . . 0.0 111.571 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 22.4 p -73.88 -161.62 0.12 Allowed 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.888 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.42 -43.21 51.09 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.6 t -69.97 -45.89 75.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.9 m -73.53 -36.22 65.66 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -177.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -63.38 -37.3 86.72 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -178.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.76 -43.0 48.78 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.28 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 62.2 mm-40 -62.79 -47.76 82.09 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.541 179.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -58.49 -46.25 87.06 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.986 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.1 mp -60.96 -26.65 67.69 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.881 -179.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -55.24 -36.26 65.84 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-O 120.752 0.31 . . . . 0.0 111.354 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 11.1 mtm105 -83.87 -29.08 27.51 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.083 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 . . . . . 0 CA--C 1.535 0.366 0 CA-C-N 116.767 -0.197 . . . . 0.0 110.988 179.67 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 13.4 mtt . . . . . 0 CA--C 1.535 0.396 0 CA-C-O 120.825 0.345 . . . . 0.0 111.394 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.3 mt -74.49 148.7 40.77 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.509 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 10.0 t -44.82 132.95 6.4 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -178.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m -61.61 -29.07 69.8 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.796 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.556 HG23 ' SD ' ' A' ' 31' ' ' MET . 71.2 p -78.89 -9.75 59.59 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.652 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 71.94 33.23 62.86 Favored Glycine 0 C--N 1.342 0.888 0 N-CA-C 111.26 -0.736 . . . . 0.0 111.26 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.5 p -71.83 -19.14 62.02 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.37 4.28 53.19 Favored Glycine 0 CA--C 1.539 1.557 0 CA-C-O 119.569 -0.573 . . . . 0.0 113.481 178.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -115.53 164.09 14.81 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 117.944 0.872 . . . . 0.0 111.038 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -69.21 146.55 52.29 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.571 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -109.68 166.89 12.63 Favored Glycine 0 CA--C 1.527 0.794 0 N-CA-C 110.216 -1.153 . . . . 0.0 110.216 178.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -114.93 135.96 22.51 Favored Pre-proline 0 N--CA 1.467 0.416 0 N-CA-C 109.948 -0.389 . . . . 0.0 109.948 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -74.82 -23.46 14.19 Favored 'Trans proline' 0 N--CA 1.495 1.58 0 C-N-CA 122.022 1.814 . . . . 0.0 112.928 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -75.67 -36.81 60.0 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.2 p -70.87 -154.93 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -89.76 29.21 1.2 Allowed 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.681 0.673 . . . . 0.0 111.031 179.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.44 16.27 78.33 Favored Glycine 0 CA--C 1.534 1.24 0 CA-C-O 119.872 -0.404 . . . . 0.0 112.465 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.556 ' SD ' HG23 ' A' ' 18' ' ' THR . 9.4 mtt -131.2 176.56 8.17 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 117.616 0.708 . . . . 0.0 111.213 -178.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 18.9 p -77.22 -167.15 0.84 Allowed 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.677 -179.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.51 -48.83 30.11 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -177.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.1 t -65.68 -57.74 9.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -177.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 73.2 m -57.51 -35.38 70.18 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 111.641 0.237 . . . . 0.0 111.641 -178.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.46 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 41.1 t80 -57.42 -41.45 80.42 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.216 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -74.29 -45.09 49.8 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -56.69 -39.76 74.37 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -179.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.46 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.6 p-80 -84.46 -33.24 23.68 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 120.006 -0.677 . . . . 0.0 111.675 -179.131 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 15.7 tp -62.33 -30.39 71.13 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.254 179.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -65.11 -39.47 93.16 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.662 0.268 . . . . 0.0 111.0 -179.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 61.9 mtm180 -76.11 -30.53 58.29 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.344 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.236 0.358 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.792 -179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 18.7 mmt . . . . . 0 C--O 1.235 0.297 0 CA-C-O 120.526 0.203 . . . . 0.0 110.954 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.463 ' HA ' HD13 ' A' ' 15' ' ' LEU . 2.5 mm? -79.83 139.65 37.12 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.0 t -42.22 121.5 1.9 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 -178.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.1 m -55.94 -22.58 26.99 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.318 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 60.9 p -81.18 -9.64 59.76 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 179.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 74.49 40.24 39.84 Favored Glycine 0 C--N 1.344 1.023 0 C-N-CA 121.457 -0.401 . . . . 0.0 112.357 179.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 24.2 p -86.62 -9.16 56.65 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 117.012 0.406 . . . . 0.0 112.066 179.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.21 -2.74 85.44 Favored Glycine 0 CA--C 1.537 1.441 0 CA-C-O 119.777 -0.457 . . . . 0.0 113.394 178.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.428 ' O ' HD13 ' A' ' 15' ' ' LEU . 67.2 m-85 -100.79 171.95 7.36 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 117.788 0.794 . . . . 0.0 110.533 -179.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -80.31 139.06 36.78 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.568 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -111.78 155.24 16.3 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 109.874 -1.291 . . . . 0.0 109.874 178.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.495 ' HB3' HG23 ' A' ' 28' ' ' THR . 1.9 t-20 -101.38 137.46 19.65 Favored Pre-proline 0 CA--C 1.537 0.47 0 CA-C-O 119.499 -0.286 . . . . 0.0 110.822 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -73.13 -27.28 14.01 Favored 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 121.848 1.699 . . . . 0.0 112.294 179.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.4 mmt180 -74.08 -26.9 60.63 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 123.041 0.213 . . . . 0.0 110.526 178.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.495 HG23 ' HB3' ' A' ' 25' ' ' ASN . 68.8 p -82.11 -150.49 0.09 Allowed 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 178.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 54.1 m-20 -91.21 28.3 1.67 Allowed 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 118.375 0.534 . . . . 0.0 110.891 178.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 76.01 17.51 80.0 Favored Glycine 0 CA--C 1.537 1.444 0 N-CA-C 111.702 -0.559 . . . . 0.0 111.702 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 48.6 mtt -123.16 170.34 10.33 Favored 'General case' 0 C--N 1.347 0.491 0 CA-C-N 117.291 0.546 . . . . 0.0 111.419 -179.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 31.2 p -77.62 -167.79 1.04 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.639 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.24 -44.41 59.54 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 18.1 t -62.78 -51.22 74.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -178.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 68.5 m -70.62 -34.55 72.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.944 -178.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.437 ' CE1' HD13 ' A' ' 40' ' ' LEU . 38.9 t80 -64.83 -32.92 74.84 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -77.87 -43.05 31.39 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.906 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -63.64 -45.21 91.24 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 120.869 0.366 . . . . 0.0 110.106 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 39.6 t60 -59.94 -44.86 94.12 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.701 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.437 HD13 ' CE1' ' A' ' 36' ' ' TYR . 1.0 OUTLIER -65.33 -29.33 70.05 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.634 -178.798 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -71.99 -31.48 66.28 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 120.934 -0.307 . . . . 0.0 110.315 179.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 39.2 ttt-85 -75.21 -31.44 60.89 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.172 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 . . . . . 0 CA--C 1.531 0.234 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.235 179.534 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 14.8 mmt . . . . . 0 C--O 1.233 0.213 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mp -76.65 144.28 39.57 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.5 t -48.79 123.71 7.37 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.9 m -65.32 -30.57 71.43 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.015 -179.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 51.0 p -64.81 -23.03 67.11 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -178.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 91.05 36.93 6.47 Favored Glycine 0 CA--C 1.526 0.76 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.132 179.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.9 p -84.81 -16.44 41.4 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 117.034 0.417 . . . . 0.0 110.91 178.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.49 12.68 66.72 Favored Glycine 0 C--N 1.349 1.298 0 CA-C-O 119.747 -0.474 . . . . 0.0 113.097 178.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -114.37 176.71 4.93 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 117.633 0.717 . . . . 0.0 111.833 -179.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 8.1 t80 -81.21 140.82 34.7 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.101 -0.954 . . . . 0.0 111.025 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -124.7 -176.51 14.62 Favored Glycine 0 CA--C 1.53 1.008 0 N-CA-C 111.054 -0.819 . . . . 0.0 111.054 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -130.13 139.25 35.08 Favored Pre-proline 0 N--CA 1.47 0.536 0 CA-C-O 119.548 -0.263 . . . . 0.0 111.389 -179.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -77.07 -14.89 16.64 Favored 'Trans proline' 0 N--CA 1.49 1.273 0 C-N-CA 121.994 1.796 . . . . 0.0 112.949 178.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -77.6 -35.87 52.41 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 178.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 66.6 p -72.52 -154.77 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 177.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -90.77 26.02 2.19 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.574 0.624 . . . . 0.0 111.622 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 84.31 8.27 83.75 Favored Glycine 0 CA--C 1.538 1.484 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.8 163.31 16.35 Favored 'General case' 0 C--N 1.346 0.413 0 CA-C-N 117.146 0.473 . . . . 0.0 110.987 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 30.8 p -76.04 -157.71 0.08 Allowed 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -74.77 -48.3 26.28 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -179.061 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.2 t -69.03 -55.69 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 -178.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 77.7 m -57.19 -35.47 69.65 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -178.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.429 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 30.5 t80 -59.03 -40.44 85.04 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 111.833 0.309 . . . . 0.0 111.833 -179.127 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.6 tttm -74.37 -45.39 47.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.825 0.345 . . . . 0.0 110.347 -179.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -56.25 -38.51 71.23 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -178.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.429 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.6 p-80 -86.4 -33.4 20.49 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 120.191 -0.603 . . . . 0.0 112.155 -178.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.0 tt -65.91 -30.63 71.25 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.804 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -58.77 -40.53 84.18 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.393 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -84.79 -29.56 25.33 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.894 179.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 . . . . . 0 N--CA 1.464 0.228 0 CA-C-O 120.96 0.409 . . . . 0.0 110.089 179.282 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 1.5 mtt . . . . . 0 CA--C 1.536 0.417 0 CA-C-O 121.068 0.461 . . . . 0.0 112.173 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -71.27 148.36 47.24 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.139 179.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 11.2 t -41.34 140.66 0.82 Allowed 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -179.035 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 68.7 m -63.81 -29.19 70.42 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.824 -179.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.5 p -88.17 -5.19 58.55 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -179.174 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 71.03 38.71 63.81 Favored Glycine 0 C--N 1.343 0.972 0 CA-C-O 119.931 -0.372 . . . . 0.0 113.099 178.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 32.0 p -78.68 -17.78 55.41 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 117.179 0.489 . . . . 0.0 111.887 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 105.03 1.26 41.9 Favored Glycine 0 CA--C 1.54 1.621 0 CA-C-O 119.711 -0.494 . . . . 0.0 113.243 179.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 67.1 m-85 -109.01 156.74 19.39 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 117.767 0.783 . . . . 0.0 110.685 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 26.4 t80 -65.25 146.17 55.29 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.289 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -109.04 163.43 12.59 Favored Glycine 0 CA--C 1.529 0.932 0 N-CA-C 110.257 -1.137 . . . . 0.0 110.257 179.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -113.21 136.22 21.8 Favored Pre-proline 0 CA--C 1.541 0.608 0 CA-C-O 119.276 -0.392 . . . . 0.0 110.098 -179.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -76.59 -22.73 11.88 Favored 'Trans proline' 0 N--CA 1.494 1.525 0 C-N-CA 122.052 1.835 . . . . 0.0 112.313 179.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 61.7 mtp180 -74.53 -33.57 62.8 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 178.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.8 p -82.12 -155.42 0.14 Allowed 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 178.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -89.56 24.94 2.12 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 118.623 0.647 . . . . 0.0 111.825 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.42 17.75 75.31 Favored Glycine 0 CA--C 1.54 1.604 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 -179.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 16.9 mtt -120.33 155.38 33.46 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-N 117.152 0.476 . . . . 0.0 110.772 -179.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 29.3 p -66.38 -162.72 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.105 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -74.12 -48.36 30.0 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -178.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 17.5 t -62.61 -56.63 16.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 116.301 -0.409 . . . . 0.0 112.053 -178.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.6 m -60.39 -33.49 72.56 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -178.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 30.2 t80 -65.25 -34.87 79.38 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -178.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 39.3 tttt -77.26 -47.86 19.02 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.159 -179.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -66.1 -42.98 88.52 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.421 -179.002 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -59.39 -49.27 78.44 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.877 -178.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.76 -29.27 70.5 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 -178.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -57.96 -40.65 81.09 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.47 0.176 . . . . 0.0 111.195 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.6 ptp180 -82.17 -30.84 30.77 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.952 179.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 . . . . . 0 N--CA 1.463 0.183 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.475 -179.303 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.389 0 CA-C-O 120.801 0.334 . . . . 0.0 110.427 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.549 HD23 ' O ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -79.19 145.21 33.78 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 179.864 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.7 t -51.29 124.26 11.38 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -178.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.8 m -64.6 -22.03 66.87 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.525 -0.761 . . . . 0.0 112.11 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 58.0 p -76.7 -19.54 57.59 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.65 43.19 6.56 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 121.168 -0.539 . . . . 0.0 112.081 179.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.9 p -88.37 -22.6 23.71 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 116.958 0.379 . . . . 0.0 111.706 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 98.65 6.94 56.13 Favored Glycine 0 CA--C 1.539 1.531 0 CA-C-O 119.707 -0.496 . . . . 0.0 113.6 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.549 ' O ' HD23 ' A' ' 15' ' ' LEU . 63.8 m-85 -108.36 -170.34 1.66 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 117.819 0.809 . . . . 0.0 111.13 -179.265 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -96.7 141.21 30.2 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.201 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -111.08 172.59 15.22 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 111.049 -0.821 . . . . 0.0 111.049 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -124.92 138.11 30.85 Favored Pre-proline 0 CA--C 1.54 0.571 0 CA-C-O 119.501 -0.285 . . . . 0.0 110.821 -179.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -75.79 -19.16 16.49 Favored 'Trans proline' 0 N--CA 1.498 1.748 0 C-N-CA 122.269 1.979 . . . . 0.0 112.488 178.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.0 mtt180 -75.96 -34.95 59.83 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 70.1 p -77.77 -154.41 0.07 Allowed 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -90.57 27.62 1.69 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.364 0.529 . . . . 0.0 111.718 179.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.26 10.88 85.59 Favored Glycine 0 CA--C 1.535 1.288 0 N-CA-C 111.6 -0.6 . . . . 0.0 111.6 -179.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.07 169.81 9.6 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 117.332 0.566 . . . . 0.0 111.097 -178.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 22.0 p -78.89 -162.03 0.35 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.124 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.76 -45.92 40.65 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -178.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.7 t -69.35 -56.82 10.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -178.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 72.3 m -56.77 -35.43 68.65 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.444 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 31.7 t80 -57.94 -37.91 74.98 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.778 -0.192 . . . . 0.0 111.166 -179.444 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.6 tttt -77.65 -45.48 24.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.897 0.379 . . . . 0.0 110.129 179.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -57.2 -40.86 78.26 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.878 0.695 . . . . 0.0 112.878 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.444 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.1 p-80 -82.14 -33.85 29.41 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 120.102 -0.639 . . . . 0.0 111.398 -179.085 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.5 tp -64.28 -29.27 70.37 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.582 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -61.94 -40.95 97.3 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.605 0.24 . . . . 0.0 111.289 -179.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 36.9 ttt85 -84.13 -31.38 25.26 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.495 -179.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 . . . . . 0 N--CA 1.465 0.287 0 CA-C-O 120.575 0.226 . . . . 0.0 111.061 -179.68 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 6.7 mmt . . . . . 0 CA--C 1.532 0.27 0 CA-C-O 120.998 0.428 . . . . 0.0 110.63 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.07 146.75 41.23 Favored 'General case' 0 N--CA 1.461 0.086 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.8 t -48.96 124.59 8.95 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -178.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.5 m -62.68 -27.13 69.03 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.758 179.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 68.4 p -71.04 -20.88 62.33 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 84.8 34.09 16.65 Favored Glycine 0 C--N 1.342 0.899 0 N-CA-C 111.855 -0.498 . . . . 0.0 111.855 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.4 p -78.85 -17.12 56.17 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 179.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.53 6.34 59.76 Favored Glycine 0 CA--C 1.538 1.511 0 CA-C-O 119.678 -0.512 . . . . 0.0 113.708 178.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -116.45 167.64 10.86 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 117.936 0.868 . . . . 0.0 111.313 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -69.46 143.99 53.38 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.713 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -114.79 171.09 13.53 Favored Glycine 0 CA--C 1.531 1.041 0 N-CA-C 110.836 -0.905 . . . . 0.0 110.836 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -118.27 139.35 26.66 Favored Pre-proline 0 N--CA 1.471 0.608 0 CA-C-N 116.642 0.221 . . . . 0.0 111.265 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -78.68 -25.31 6.61 Favored 'Trans proline' 0 N--CA 1.489 1.245 0 C-N-CA 122.191 1.927 . . . . 0.0 113.195 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 33.1 mmt180 -74.15 -33.03 63.38 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 178.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 71.0 p -74.57 -155.92 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 177.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -90.01 26.07 1.95 Allowed 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 118.2 0.454 . . . . 0.0 111.446 179.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 81.83 10.91 83.5 Favored Glycine 0 CA--C 1.539 1.537 0 N-CA-C 111.429 -0.668 . . . . 0.0 111.429 -179.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.95 163.32 17.76 Favored 'General case' 0 C--N 1.346 0.436 0 CA-C-N 117.335 0.568 . . . . 0.0 110.538 -179.185 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 28.3 p -74.7 -158.59 0.08 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.773 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -75.36 -47.03 29.48 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 16.3 t -69.58 -51.03 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 CA-C-O 120.749 0.309 . . . . 0.0 111.311 -178.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.1 m -62.88 -37.75 88.14 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -178.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.433 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 26.1 t80 -59.22 -45.99 89.65 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -178.682 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 38.5 pttt -74.13 -44.08 55.12 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 120.479 -0.488 . . . . 0.0 110.206 -179.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -55.5 -36.51 66.75 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.433 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 0.7 OUTLIER -86.5 -33.79 20.22 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 120.161 -0.616 . . . . 0.0 112.361 -179.302 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 11.0 tp -62.51 -28.97 70.21 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 121.251 -0.18 . . . . 0.0 111.435 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -63.76 -38.74 92.25 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.407 -179.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 9.8 tpp180 -76.45 -29.35 56.92 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.701 179.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.533 0.315 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.488 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 3.7 mmt . . . . . 0 C--O 1.234 0.28 0 CA-C-O 120.859 0.361 . . . . 0.0 110.359 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.5 mp -74.17 146.78 43.17 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.233 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.3 t -46.6 131.53 11.22 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -179.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -61.55 -32.33 72.39 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.931 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 76.5 p -72.35 -13.98 61.62 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.242 178.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 74.59 42.4 32.87 Favored Glycine 0 C--N 1.345 1.081 0 N-CA-C 111.667 -0.573 . . . . 0.0 111.667 179.255 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 29.4 p -80.3 -15.87 55.93 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.914 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.3 2.72 61.88 Favored Glycine 0 CA--C 1.54 1.611 0 CA-C-O 119.971 -0.349 . . . . 0.0 113.073 179.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -102.96 -168.13 1.48 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 117.373 0.587 . . . . 0.0 109.837 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -98.9 142.01 30.95 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 110.755 -0.091 . . . . 0.0 110.755 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -108.2 164.56 12.77 Favored Glycine 0 CA--C 1.531 1.07 0 N-CA-C 111.414 -0.675 . . . . 0.0 111.414 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.492 ' HB3' HG23 ' A' ' 28' ' ' THR . 13.2 t-20 -119.22 122.72 29.29 Favored Pre-proline 0 CA--C 1.54 0.587 0 CA-C-O 119.195 -0.431 . . . . 0.0 111.135 -179.424 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -67.37 -16.35 47.68 Favored 'Trans proline' 0 N--CA 1.493 1.471 0 C-N-CA 121.775 1.65 . . . . 0.0 112.957 178.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -76.77 -35.58 57.61 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 177.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.492 HG23 ' HB3' ' A' ' 25' ' ' ASN . 46.6 p -72.08 -156.66 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 178.109 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -91.22 26.62 2.14 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 118.235 0.47 . . . . 0.0 112.09 179.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 90.15 8.74 66.3 Favored Glycine 0 CA--C 1.534 1.246 0 CA-C-O 119.793 -0.448 . . . . 0.0 112.104 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.64 165.68 18.12 Favored 'General case' 0 C--N 1.345 0.399 0 CA-C-N 117.697 0.749 . . . . 0.0 111.326 -179.097 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 24.3 p -73.22 -156.45 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.744 -178.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.3 -51.48 11.9 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -179.065 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.3 t -67.94 -56.6 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -177.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 81.8 m -58.39 -38.09 76.61 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -178.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.435 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 5.3 t80 -57.16 -39.71 75.8 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -178.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 9.6 ttpt -75.82 -45.07 37.98 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.121 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -55.11 -38.86 68.69 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -179.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.435 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 2.2 p-80 -85.31 -32.38 22.52 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 120.136 -0.626 . . . . 0.0 111.278 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 25.6 tp -61.53 -30.3 70.54 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.612 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 22.8 tt0 -56.57 -37.54 70.72 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 120.732 0.301 . . . . 0.0 111.183 -179.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 45.5 mmm-85 -79.04 -28.22 43.22 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.558 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 . . . . . 0 N--CA 1.466 0.336 0 O-C-N 123.051 0.219 . . . . 0.0 111.45 -179.748 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 12.5 mmt . . . . . 0 CA--C 1.534 0.353 0 CA-C-O 120.823 0.344 . . . . 0.0 111.286 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.7 mp -80.42 147.23 31.07 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 178.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.3 t -49.21 115.86 1.47 Allowed 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 121.24 0.543 . . . . 0.0 112.359 -178.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 66.8 m -60.52 -20.1 59.18 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.073 -0.967 . . . . 0.0 113.129 -178.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.42 HG23 ' SD ' ' A' ' 31' ' ' MET . 76.0 p -80.74 -11.96 59.54 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 97.98 40.42 3.55 Favored Glycine 0 C--N 1.346 1.093 0 C-N-CA 121.272 -0.489 . . . . 0.0 112.454 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.4 m -87.39 -28.55 22.09 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.808 0.304 . . . . 0.0 111.718 179.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.49 8.13 85.34 Favored Glycine 0 CA--C 1.541 1.675 0 N-CA-C 111.463 -0.655 . . . . 0.0 111.463 -177.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -106.24 -175.98 2.95 Favored 'General case' 0 C--N 1.346 0.435 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -94.03 142.01 27.88 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 120.887 0.375 . . . . 0.0 111.474 -179.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -113.18 169.46 12.95 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 109.967 -1.253 . . . . 0.0 109.967 179.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -112.66 138.65 22.13 Favored Pre-proline 0 CA--C 1.537 0.478 0 CA-C-O 119.646 -0.216 . . . . 0.0 110.577 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -73.48 -27.18 13.38 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 C-N-CA 122.019 1.813 . . . . 0.0 112.547 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 67.2 mtt180 -72.83 -36.07 67.41 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 178.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 60.3 p -75.66 -154.51 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.154 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.41 ' HB2' ' CD1' ' A' ' 36' ' ' TYR . 0.4 OUTLIER -90.37 29.48 1.26 Allowed 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.256 0.48 . . . . 0.0 112.153 -179.697 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.25 17.0 65.54 Favored Glycine 0 CA--C 1.535 1.327 0 C-N-CA 121.126 -0.559 . . . . 0.0 112.374 179.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . 0.42 ' SD ' HG23 ' A' ' 18' ' ' THR . 15.3 mtt -124.26 179.7 4.79 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 117.339 0.57 . . . . 0.0 109.79 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 20.2 p -83.63 -175.61 5.9 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 122.966 0.166 . . . . 0.0 110.591 -179.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.61 -45.61 78.57 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -177.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 6.4 t -66.28 -37.17 79.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 CA-C-O 120.76 0.314 . . . . 0.0 111.361 -178.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 21.7 m -73.49 -40.08 64.37 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.326 -178.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.43 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 18.4 t80 -61.82 -33.66 74.53 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -177.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.28 -45.85 18.92 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.472 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -62.88 -46.97 85.35 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -178.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.43 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.7 p-80 -76.61 -40.5 49.23 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 119.964 -0.694 . . . . 0.0 112.375 -177.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 26.8 tp -60.45 -27.35 67.45 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 120.781 0.324 . . . . 0.0 110.827 178.32 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -66.77 -38.4 86.5 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.53 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -75.38 -30.09 60.06 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.741 -179.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 . . . . . 0 N--CA 1.465 0.278 0 CA-C-O 120.502 0.191 . . . . 0.0 110.984 179.745 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.536 0.404 0 CA-C-O 120.667 0.27 . . . . 0.0 110.451 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.438 HD12 ' HA ' ' A' ' 15' ' ' LEU . 5.4 tp -79.56 144.8 33.56 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.948 -0.301 . . . . 0.0 110.338 -179.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.3 t -37.21 117.46 0.54 Allowed 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -179.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 49.0 m -58.91 -26.29 64.19 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.412 179.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 19.7 p -83.28 -8.43 59.45 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 73.59 43.24 37.32 Favored Glycine 0 C--N 1.347 1.14 0 C-N-CA 121.307 -0.473 . . . . 0.0 112.666 178.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.4 p -85.04 -14.32 47.71 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 117.119 0.46 . . . . 0.0 111.83 179.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 96.7 2.72 59.75 Favored Glycine 0 CA--C 1.538 1.493 0 CA-C-O 119.39 -0.672 . . . . 0.0 113.901 178.341 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -105.91 -171.24 1.87 Allowed 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.304 1.052 . . . . 0.0 110.539 -178.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -96.71 143.73 27.38 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.873 0.368 . . . . 0.0 111.436 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -111.35 161.15 12.87 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 110.199 -1.16 . . . . 0.0 110.199 179.044 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.412 ' HB3' HG23 ' A' ' 28' ' ' THR . 24.7 t30 -107.33 137.33 19.59 Favored Pre-proline 0 CA--C 1.535 0.368 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.672 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -72.73 -28.05 14.3 Favored 'Trans proline' 0 N--CA 1.491 1.382 0 C-N-CA 121.754 1.636 . . . . 0.0 111.957 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -71.92 -31.69 66.62 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.234 178.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.412 HG23 ' HB3' ' A' ' 25' ' ' ASN . 68.5 p -77.1 -150.81 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 178.21 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -90.53 29.58 1.27 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.724 0.693 . . . . 0.0 111.121 179.362 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 73.74 18.22 79.46 Favored Glycine 0 CA--C 1.533 1.187 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -178.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 10.7 mtt -128.84 172.36 11.38 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-N 116.905 0.353 . . . . 0.0 110.398 -179.256 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 57.9 m -60.89 172.26 1.01 Allowed 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.115 -179.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 35.6 m -72.01 -46.32 57.6 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 179.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 16.0 t -70.4 -36.72 67.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 116.097 -0.502 . . . . 0.0 109.89 179.516 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 80.2 m -72.19 -37.24 69.34 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.654 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.447 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 25.8 t80 -58.1 -33.13 68.77 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.736 -179.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.9 tttt -77.96 -44.15 27.65 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.037 0.446 . . . . 0.0 110.173 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -56.57 -40.83 75.87 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.844 -178.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.447 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.9 p-80 -85.01 -33.63 22.51 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 120.321 -0.551 . . . . 0.0 112.162 -178.579 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.3 tp -60.79 -30.79 70.26 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 122.922 0.139 . . . . 0.0 111.219 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -68.64 -35.39 77.21 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.766 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.1 mmm-85 -71.68 -29.94 65.15 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.616 -179.477 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 . . . . . 0 N--CA 1.466 0.335 0 C-N-CA 121.254 -0.178 . . . . 0.0 111.375 -179.681 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 6.8 mmt . . . . . 0 CA--C 1.534 0.334 0 CA-C-O 120.87 0.367 . . . . 0.0 110.805 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -78.52 146.16 34.49 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.3 t -42.64 117.98 1.13 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -178.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.34 -23.68 50.41 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.72 179.285 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 46.4 p -81.33 -12.22 59.09 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -179.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.11 43.4 10.8 Favored Glycine 0 C--N 1.344 1.003 0 C-N-CA 121.255 -0.498 . . . . 0.0 112.58 178.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 3.7 p -87.44 -15.56 37.37 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 117.252 0.526 . . . . 0.0 111.989 179.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 92.71 4.35 65.58 Favored Glycine 0 CA--C 1.54 1.623 0 CA-C-O 119.639 -0.534 . . . . 0.0 114.071 178.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 36.7 m-85 -106.12 -169.53 1.59 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 117.944 0.872 . . . . 0.0 110.062 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -96.45 141.38 29.81 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.143 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -116.52 171.92 13.99 Favored Glycine 0 CA--C 1.529 0.956 0 N-CA-C 110.554 -1.019 . . . . 0.0 110.554 179.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -122.53 143.12 38.98 Favored Pre-proline 0 CA--C 1.538 0.497 0 CA-C-N 116.82 0.31 . . . . 0.0 111.181 -179.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -77.01 -21.76 11.97 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 C-N-CA 122.122 1.881 . . . . 0.0 113.122 179.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 5.9 mpt_? -73.98 -34.94 64.4 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 64.4 p -74.25 -156.69 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 178.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -91.52 25.5 2.62 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 118.379 0.536 . . . . 0.0 111.596 179.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.63 13.64 69.68 Favored Glycine 0 CA--C 1.538 1.476 0 N-CA-C 112.041 -0.424 . . . . 0.0 112.041 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.51 165.91 17.62 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-N 117.483 0.642 . . . . 0.0 111.387 -179.25 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 60.7 m -57.34 178.2 0.08 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.788 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 13.2 m -71.76 -43.0 66.53 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 16.2 t -73.98 -37.49 47.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.733 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 71.2 m -72.03 -38.14 69.62 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.715 -179.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' TYR . . . . . 0.402 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 18.3 t80 -55.93 -38.68 70.61 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-O 120.625 0.25 . . . . 0.0 111.072 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.9 tttt -76.96 -43.9 33.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.955 -179.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -55.95 -40.01 72.57 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.744 -178.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' HIS . . . . . 0.402 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.7 p-80 -84.02 -32.73 24.75 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 120.087 -0.645 . . . . 0.0 111.414 -179.529 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 15.1 tp -60.21 -26.46 66.4 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.747 -0.206 . . . . 0.0 111.392 179.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -69.51 -37.81 77.34 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.461 0.172 . . . . 0.0 110.665 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.7 -32.27 60.02 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.7 179.812 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 . . . . . 0 C--O 1.232 0.176 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.985 -179.959 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.303 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 9.8 m -83.1 -53.81 5.52 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-O 120.612 0.244 . . . . 0.0 110.538 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 10.6 ptt? -69.83 156.09 39.57 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.806 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -128.58 32.69 4.78 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.734 179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -110.92 33.27 4.69 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.986 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -105.67 97.76 7.55 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.658 179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.0 m -97.91 122.63 41.25 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.406 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 10.0 p-10 -115.41 -44.83 2.95 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.648 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 35.6 mt-30 -139.43 153.71 47.64 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.331 179.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 6.8 t -95.86 145.78 30.16 Favored Pre-proline 0 CA--C 1.537 0.466 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.584 179.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 85.7 Cg_endo -90.86 160.18 4.06 Favored 'Trans proline' 0 N--CA 1.483 0.873 0 C-N-CA 122.531 2.154 . . . . 0.0 111.379 179.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.407 ' N ' ' CD ' ' A' ' 13' ' ' PRO . . . 83.72 44.11 6.97 Favored Glycine 0 CA--C 1.538 1.51 0 CA-C-O 119.252 -0.749 . . . . 0.0 112.393 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.407 ' CD ' ' N ' ' A' ' 12' ' ' GLY . 58.7 Cg_endo -72.49 84.42 1.19 Allowed 'Trans proline' 0 N--CA 1.494 1.538 0 CA-C-N 119.702 1.751 . . . . 0.0 111.099 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 4.5 mmt -71.7 66.04 0.52 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.372 -179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -75.02 144.92 42.85 Favored 'General case' 0 CA--C 1.527 0.094 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 8.7 t -49.78 128.06 17.34 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 112.27 0.471 . . . . 0.0 112.27 -179.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 28.5 m -63.71 -30.21 71.34 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.822 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 80.5 p -73.61 -19.01 60.98 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.03 43.12 6.82 Favored Glycine 0 CA--C 1.53 0.988 0 C-N-CA 121.216 -0.516 . . . . 0.0 112.863 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.8 p -85.7 -22.35 27.87 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 117.286 0.543 . . . . 0.0 111.108 178.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 100.28 8.08 50.77 Favored Glycine 0 CA--C 1.537 1.433 0 CA-C-O 119.85 -0.417 . . . . 0.0 113.165 178.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 39.2 m-85 -114.3 159.37 20.28 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 117.673 0.737 . . . . 0.0 110.425 -179.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.7 t80 -67.57 146.66 53.68 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.98 179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -118.43 -179.08 17.07 Favored Glycine 0 CA--C 1.53 0.975 0 N-CA-C 110.526 -1.029 . . . . 0.0 110.526 179.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.3 t30 -126.94 138.88 33.57 Favored Pre-proline 0 N--CA 1.47 0.568 0 CA-C-O 119.466 -0.302 . . . . 0.0 110.528 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -77.11 -22.65 11.12 Favored 'Trans proline' 0 N--CA 1.489 1.206 0 C-N-CA 121.922 1.748 . . . . 0.0 112.53 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 28.2 mtm180 -71.17 -34.14 70.65 Favored 'General case' 0 N--CA 1.465 0.292 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 177.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 67.2 p -74.55 -157.49 0.06 Allowed 'General case' 0 CA--C 1.537 0.479 0 N-CA-C 107.594 -1.262 . . . . 0.0 107.594 177.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -90.94 25.41 2.42 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 118.333 0.515 . . . . 0.0 111.208 178.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 82.52 10.6 83.18 Favored Glycine 0 CA--C 1.541 1.676 0 N-CA-C 111.65 -0.58 . . . . 0.0 111.65 -179.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 3.0 mpp? -115.24 156.42 25.41 Favored 'General case' 0 C--N 1.345 0.391 0 CA-C-N 117.195 0.498 . . . . 0.0 110.448 -179.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 22.9 p -69.98 -160.63 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.036 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.47 -48.3 28.18 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -178.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 8.3 t -68.81 -56.92 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 N-CA-C 111.727 0.269 . . . . 0.0 111.727 -177.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 81.2 m -57.82 -35.32 70.71 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 112.416 0.524 . . . . 0.0 112.416 -178.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -62.96 -31.09 72.12 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 121.347 -0.141 . . . . 0.0 111.295 -179.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.7 tttt -75.67 -48.61 21.33 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.72 0.295 . . . . 0.0 110.717 -179.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -63.31 -42.34 99.02 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.138 -179.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 63.9 t60 -63.95 -48.37 76.79 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.621 -179.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.2 tp -63.63 -30.4 71.51 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 111.627 0.232 . . . . 0.0 111.627 -178.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.2 tp-100 -65.03 -40.95 95.58 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 120.85 0.357 . . . . 0.0 110.329 179.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.87 -31.46 64.74 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.117 -179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -75.29 -39.4 59.69 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.573 -179.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -66.61 -38.02 86.11 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.212 -179.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -62.96 -27.82 69.66 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 116.374 -0.375 . . . . 0.0 111.656 -179.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 6.8 t -67.56 -63.03 1.14 Allowed 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.72 -0.218 . . . . 0.0 110.724 179.861 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.99 -56.3 4.04 Favored Glycine 0 CA--C 1.527 0.838 0 N-CA-C 110.947 -0.861 . . . . 0.0 110.947 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 26.9 mmt180 -88.76 76.82 7.96 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 120.93 0.395 . . . . 0.0 110.458 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 17.8 ptt? -84.89 118.67 24.66 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.708 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.8 m -157.19 94.27 2.21 Favored Pre-proline 0 CA--C 1.536 0.442 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.676 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -82.99 84.19 1.79 Allowed 'Trans proline' 0 N--CA 1.489 1.243 0 C-N-CA 122.402 2.068 . . . . 0.0 112.115 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 25.2 tpp -143.09 39.46 1.46 Allowed 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.419 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 83.56 -67.06 3.8 Favored Glycine 0 CA--C 1.527 0.836 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.0 t -109.86 166.91 10.56 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 120.684 0.278 . . . . 0.0 110.436 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -144.67 137.67 26.77 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.425 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 40.8 t -83.14 151.42 25.72 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.591 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 81.32 79.66 0.92 Allowed Glycine 0 CA--C 1.526 0.762 0 N-CA-C 110.877 -0.889 . . . . 0.0 110.877 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.1 t -139.99 34.5 1.95 Allowed 'General case' 0 C--O 1.236 0.39 0 CA-C-O 120.825 0.345 . . . . 0.0 110.712 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -83.57 152.26 24.95 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.522 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.0 t -145.93 86.86 6.98 Favored Pre-proline 0 CA--C 1.538 0.511 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.558 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_exo -59.91 148.19 89.65 Favored 'Trans proline' 0 N--CA 1.499 1.844 0 C-N-CA 122.281 1.987 . . . . 0.0 111.936 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 7.7 p . . . . . 0 C--O 1.221 -0.43 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.516 -179.885 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.304 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 3.7 p -80.89 139.85 35.68 Favored 'General case' 0 C--O 1.233 0.202 0 N-CA-C 110.412 -0.218 . . . . 0.0 110.412 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 25.9 mmt -92.18 87.06 5.96 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.652 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -137.04 32.03 2.66 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.888 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.5 tp-100 -122.15 32.83 5.67 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 120.879 0.371 . . . . 0.0 110.654 179.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -71.5 -179.26 2.45 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.648 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.2 p -83.26 121.99 27.84 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.37 179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -97.64 -30.28 12.93 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.303 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.465 ' O ' HG23 ' A' ' 10' ' ' THR . 15.0 mm100 -64.24 97.57 0.19 Allowed 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.762 -0.199 . . . . 0.0 110.704 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.465 HG23 ' O ' ' A' ' 9' ' ' GLN . 2.8 p -155.99 157.32 31.26 Favored Pre-proline 0 CA--C 1.537 0.453 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.643 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -60.53 151.76 73.07 Favored 'Trans proline' 0 N--CA 1.501 1.944 0 C-N-CA 122.497 2.131 . . . . 0.0 112.178 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 169.08 -59.21 0.2 Allowed Glycine 0 CA--C 1.536 1.374 0 CA-C-O 119.362 -0.688 . . . . 0.0 111.769 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -59.33 84.53 0.06 OUTLIER 'Trans proline' 0 N--CA 1.503 2.05 0 C-N-CA 122.229 1.953 . . . . 0.0 112.888 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.04 89.51 0.81 Allowed 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.17 179.494 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.2 mp -75.05 146.58 41.42 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.193 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.2 t -46.7 137.08 7.29 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 -179.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 1.5 m -65.95 -33.94 76.96 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.008 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 79.8 p -70.19 -13.43 62.18 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 116.309 -0.405 . . . . 0.0 112.084 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 77.26 25.61 63.4 Favored Glycine 0 CA--C 1.531 1.039 0 N-CA-C 112.133 -0.387 . . . . 0.0 112.133 179.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.7 p -65.91 -19.3 65.82 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 117.277 0.538 . . . . 0.0 111.832 -179.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.45 8.06 58.8 Favored Glycine 0 CA--C 1.538 1.477 0 CA-C-O 119.863 -0.409 . . . . 0.0 112.967 179.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 44.4 m-85 -104.39 -173.07 2.22 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 117.506 0.653 . . . . 0.0 110.628 -179.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.1 t80 -97.05 142.33 29.12 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.78 179.54 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -113.89 176.13 16.9 Favored Glycine 0 CA--C 1.531 1.046 0 N-CA-C 110.903 -0.879 . . . . 0.0 110.903 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -126.02 141.28 39.11 Favored Pre-proline 0 CA--C 1.54 0.586 0 CA-C-O 119.488 -0.291 . . . . 0.0 110.903 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_endo -75.22 -24.16 12.74 Favored 'Trans proline' 0 N--CA 1.496 1.626 0 C-N-CA 122.234 1.956 . . . . 0.0 112.787 179.235 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 28.5 mtt-85 -72.59 -32.01 65.64 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 109.812 -0.44 . . . . 0.0 109.812 178.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 39.4 p -81.03 -152.98 0.09 Allowed 'General case' 0 CA--C 1.543 0.689 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 177.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -92.33 28.5 1.92 Allowed 'General case' 0 C--O 1.236 0.382 0 CA-C-N 118.166 0.439 . . . . 0.0 111.53 178.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 76.34 12.72 84.01 Favored Glycine 0 CA--C 1.537 1.452 0 C-N-CA 121.094 -0.574 . . . . 0.0 111.837 -179.245 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 14.7 mtt -118.33 168.31 10.74 Favored 'General case' 0 C--N 1.347 0.484 0 CA-C-N 117.568 0.684 . . . . 0.0 111.168 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 20.7 p -78.43 -164.1 0.52 Allowed 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.392 -178.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -74.27 -45.39 48.04 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -178.474 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 21.3 t -70.71 -57.19 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 83.5 m -58.99 -35.16 72.76 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -178.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -66.74 -29.88 69.96 Favored 'General case' 0 N--CA 1.467 0.417 0 O-C-N 123.074 0.234 . . . . 0.0 111.602 -179.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.5 tttt -76.0 -48.04 22.58 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.594 0.235 . . . . 0.0 110.641 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -62.46 -37.78 87.24 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.363 -0.38 . . . . 0.0 110.741 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 32.4 t60 -61.05 -49.02 79.07 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.281 -179.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.3 mp -59.45 -27.99 66.57 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.622 -0.263 . . . . 0.0 111.668 -178.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 4.5 tp60 -60.02 -43.01 95.55 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 120.367 0.127 . . . . 0.0 111.336 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -69.24 -29.63 67.6 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.219 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -65.27 -41.66 94.0 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 120.567 0.222 . . . . 0.0 111.233 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -83.71 17.74 2.18 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.576 0.954 . . . . 0.0 113.576 -178.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -58.72 -33.39 70.15 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 118.403 0.547 . . . . 0.0 110.85 179.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 32.7 t -83.57 -62.2 1.64 Allowed 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.448 179.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 96.02 -48.84 1.77 Allowed Glycine 0 CA--C 1.528 0.862 0 N-CA-C 112.003 -0.439 . . . . 0.0 112.003 179.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 68.2 mtm180 -78.05 171.49 14.94 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.587 0.232 . . . . 0.0 110.753 -179.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 12.5 mtt -75.42 -43.88 47.49 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.202 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 10.5 p -131.89 154.38 81.72 Favored Pre-proline 0 CA--C 1.535 0.37 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.813 -179.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -80.11 -169.64 0.84 Allowed 'Trans proline' 0 N--CA 1.493 1.464 0 C-N-CA 122.432 2.088 . . . . 0.0 112.374 -179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 3.1 ttt -141.52 -55.68 0.47 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.716 -179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 135.62 -58.31 0.67 Allowed Glycine 0 CA--C 1.526 0.776 0 N-CA-C 110.81 -0.916 . . . . 0.0 110.81 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 3.9 m -144.46 160.39 41.16 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 110.45 -0.204 . . . . 0.0 110.45 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -82.07 113.77 20.17 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.502 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 57.1 p -119.17 -178.55 3.6 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.283 -180.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 94.09 58.85 1.2 Allowed Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.885 -0.886 . . . . 0.0 110.885 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 10.2 t -147.19 32.72 0.9 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 120.77 0.319 . . . . 0.0 110.912 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -103.8 152.23 22.13 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.457 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.4 m -126.09 91.12 48.74 Favored Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.416 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -81.13 120.19 3.67 Favored 'Trans proline' 0 N--CA 1.492 1.42 0 C-N-CA 122.374 2.049 . . . . 0.0 112.287 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 3.7 m . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.544 179.878 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.463 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 61.3 m -85.77 -36.74 19.93 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-O 120.453 0.168 . . . . 0.0 110.835 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 39.1 mtp -137.33 -54.81 0.69 Allowed 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.383 -0.371 . . . . 0.0 110.74 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -133.19 -62.41 0.8 Allowed 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.545 179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 14.0 tt0 -133.54 -56.2 0.89 Allowed 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.472 -179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -134.96 179.38 6.35 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.414 179.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -88.72 156.52 18.94 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.669 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 77.7 m-20 -106.26 28.51 7.65 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.382 -179.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -106.14 177.49 4.84 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.641 0.257 . . . . 0.0 110.888 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.2 t -149.69 147.0 21.6 Favored Pre-proline 0 CA--C 1.54 0.577 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.342 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -83.3 127.76 4.64 Favored 'Trans proline' 0 N--CA 1.491 1.361 0 C-N-CA 122.419 2.08 . . . . 0.0 112.313 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 83.07 45.44 6.63 Favored Glycine 0 CA--C 1.537 1.438 0 CA-C-O 119.105 -0.831 . . . . 0.0 112.288 179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.82 73.66 4.15 Favored 'Trans proline' 0 N--CA 1.494 1.527 0 CA-C-N 119.829 1.815 . . . . 0.0 111.141 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 14.9 mtt -70.11 73.73 0.47 Allowed 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.509 -179.482 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.514 HD13 ' O ' ' A' ' 22' ' ' PHE . 2.6 mm? -74.21 146.07 43.65 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.627 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.8 t -45.53 137.81 4.82 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 112.89 0.7 . . . . 0.0 112.89 -179.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 66.6 m -69.95 -24.53 63.36 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.811 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 75.0 p -80.48 -17.99 49.98 Favored 'General case' 0 CA--C 1.535 0.394 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -179.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.43 31.14 22.85 Favored Glycine 0 C--N 1.34 0.762 0 C-N-CA 121.117 -0.564 . . . . 0.0 112.401 179.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.5 p -72.96 -19.79 61.17 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.904 178.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 97.17 10.46 54.51 Favored Glycine 0 CA--C 1.538 1.491 0 CA-C-O 119.778 -0.457 . . . . 0.0 113.035 179.109 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.514 ' O ' HD13 ' A' ' 15' ' ' LEU . 75.8 m-85 -117.06 166.0 12.72 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 117.707 0.753 . . . . 0.0 111.335 -179.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 17.1 t80 -67.48 145.74 54.66 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.303 179.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -110.58 163.72 12.3 Favored Glycine 0 CA--C 1.527 0.796 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.498 ' HB3' HG23 ' A' ' 28' ' ' THR . 22.7 t30 -113.06 126.45 28.21 Favored Pre-proline 0 CA--C 1.539 0.556 0 CA-C-O 119.379 -0.343 . . . . 0.0 110.236 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -72.08 -16.63 28.67 Favored 'Trans proline' 0 N--CA 1.495 1.579 0 C-N-CA 121.825 1.684 . . . . 0.0 113.073 179.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 50.0 mtt180 -76.89 -35.01 57.71 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 109.365 -0.606 . . . . 0.0 109.365 177.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.498 HG23 ' HB3' ' A' ' 25' ' ' ASN . 42.9 p -73.03 -154.77 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 108.131 -1.063 . . . . 0.0 108.131 178.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -90.83 27.52 1.77 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.17 0.441 . . . . 0.0 111.253 179.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 84.94 10.89 77.84 Favored Glycine 0 CA--C 1.537 1.418 0 N-CA-C 111.714 -0.554 . . . . 0.0 111.714 -179.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.92 163.49 19.18 Favored 'General case' 0 C--N 1.344 0.336 0 CA-C-N 117.039 0.419 . . . . 0.0 110.645 -179.296 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 23.9 p -72.16 -158.31 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.71 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.21 -51.49 11.99 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.716 0.635 . . . . 0.0 112.716 -178.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 10.8 t -66.2 -54.83 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 N-CA-C 111.56 0.208 . . . . 0.0 111.56 -178.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 75.9 m -58.35 -36.14 73.0 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -178.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.405 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 20.0 t80 -57.39 -41.36 80.12 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 111.512 0.19 . . . . 0.0 111.512 -179.161 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.6 ttpt -75.14 -45.45 40.78 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.918 0.39 . . . . 0.0 110.343 -179.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 -54.75 -39.76 68.64 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.802 -0.635 . . . . 0.0 112.525 -179.034 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.405 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.0 OUTLIER -84.6 -32.74 23.58 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 120.296 -0.562 . . . . 0.0 111.358 -179.897 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.0 tp -61.69 -27.28 68.58 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 116.679 -0.237 . . . . 0.0 110.889 179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -69.08 -38.94 79.27 Favored 'General case' 0 N--CA 1.462 0.161 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 26.5 mtt-85 -70.83 -30.71 67.21 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.82 179.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.2 mt-30 -72.6 -34.23 67.25 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.803 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -76.31 -34.02 59.03 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.824 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -65.68 -17.94 64.97 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.7 m -67.37 -34.4 77.22 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 121.132 -0.227 . . . . 0.0 110.973 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 66.91 61.16 5.45 Favored Glycine 0 CA--C 1.528 0.863 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 74.5 mtm180 -87.94 -40.9 13.54 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.451 0.167 . . . . 0.0 111.033 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 8.7 ttt -112.8 35.3 3.94 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 120.858 0.361 . . . . 0.0 110.539 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 11.2 p -148.37 158.03 41.38 Favored Pre-proline 0 CA--C 1.536 0.414 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.521 -179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -77.62 150.96 28.27 Favored 'Trans proline' 0 N--CA 1.494 1.502 0 C-N-CA 122.291 1.994 . . . . 0.0 111.968 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -143.01 164.58 29.69 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.428 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 103.08 -59.98 0.51 Allowed Glycine 0 CA--C 1.527 0.818 0 N-CA-C 110.783 -0.927 . . . . 0.0 110.783 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 41.3 p -83.2 112.03 19.48 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 110.451 -0.203 . . . . 0.0 110.451 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -93.5 163.51 13.54 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.907 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 72.3 p -146.74 34.79 0.93 Allowed 'General case' 0 C--O 1.237 0.428 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.693 179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 84.61 48.55 4.95 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 110.69 -0.964 . . . . 0.0 110.69 179.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.1 p -149.2 33.93 0.73 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-O 120.793 0.33 . . . . 0.0 110.597 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -76.2 132.66 40.06 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.636 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.7 m -88.31 154.5 51.61 Favored Pre-proline 0 CA--C 1.533 0.317 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.263 179.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -76.55 157.75 36.23 Favored 'Trans proline' 0 N--CA 1.494 1.541 0 C-N-CA 122.283 1.988 . . . . 0.0 112.057 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 44.4 p . . . . . 0 C--O 1.22 -0.482 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.506 179.995 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.312 0 N-CA-C 109.408 -1.477 . . . . 0.0 109.408 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.2 t -85.33 -57.72 2.96 Favored 'General case' 0 C--O 1.232 0.169 0 N-CA-C 110.277 -0.268 . . . . 0.0 110.277 179.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 13.3 mmt -88.9 104.34 16.85 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.397 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -137.74 33.64 2.44 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.697 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -93.28 -55.18 3.4 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.397 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -76.79 175.47 9.4 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.478 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 41.1 p -91.83 -176.41 4.44 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.427 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -91.06 -46.03 8.36 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.187 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 42.0 tt0 -89.21 107.16 18.9 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.447 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.5 p -144.8 96.01 5.17 Favored Pre-proline 0 CA--C 1.536 0.439 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.163 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -58.26 107.99 0.36 Allowed 'Trans proline' 0 N--CA 1.5 1.87 0 C-N-CA 122.093 1.862 . . . . 0.0 111.987 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -161.68 -62.99 0.02 OUTLIER Glycine 0 CA--C 1.535 1.293 0 N-CA-C 110.908 -0.877 . . . . 0.0 110.908 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -60.03 87.97 0.07 OUTLIER 'Trans proline' 0 N--CA 1.5 1.875 0 C-N-CA 122.41 2.074 . . . . 0.0 112.104 179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 29.7 mmm -71.68 84.14 0.88 Allowed 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.7 mp -79.31 145.43 33.48 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.717 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 8.8 t -45.34 131.54 8.1 Favored 'General case' 0 N--CA 1.475 0.791 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -178.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 20.0 m -62.59 -24.84 67.77 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.215 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 33.7 p -81.2 -10.62 59.59 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -178.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 78.12 25.48 61.76 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 121.055 -0.593 . . . . 0.0 112.53 179.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.6 p -67.45 -15.57 63.74 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-N 117.324 0.562 . . . . 0.0 111.279 179.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.15 8.87 68.18 Favored Glycine 0 CA--C 1.535 1.321 0 CA-C-O 119.997 -0.335 . . . . 0.0 113.206 179.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 63.0 m-85 -106.15 -173.6 2.34 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 117.31 0.555 . . . . 0.0 110.303 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -93.14 141.71 28.12 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.865 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -112.75 169.32 12.94 Favored Glycine 0 CA--C 1.528 0.887 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 179.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.7 t30 -115.61 138.42 23.82 Favored Pre-proline 0 CA--C 1.541 0.632 0 CA-C-O 119.65 -0.214 . . . . 0.0 110.673 -179.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -76.65 -25.92 8.9 Favored 'Trans proline' 0 N--CA 1.496 1.654 0 C-N-CA 122.49 2.126 . . . . 0.0 112.588 179.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 13.9 mtt-85 -73.84 -29.26 62.03 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 116.521 -0.308 . . . . 0.0 110.194 178.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 67.9 p -85.49 -150.43 0.13 Allowed 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 177.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -91.7 28.08 1.87 Allowed 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 118.791 0.723 . . . . 0.0 111.623 179.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 74.56 16.41 80.12 Favored Glycine 0 CA--C 1.533 1.207 0 C-N-CA 121.255 -0.498 . . . . 0.0 111.972 -179.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 35.0 mtt -117.45 163.81 15.83 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 117.339 0.57 . . . . 0.0 109.903 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 31.3 p -73.76 -163.82 0.19 Allowed 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 116.152 -0.476 . . . . 0.0 109.774 -179.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.47 -41.97 62.5 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 113.315 0.857 . . . . 0.0 113.315 -178.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 10.1 t -72.52 -49.81 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-O 120.785 0.326 . . . . 0.0 110.869 -178.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 72.5 m -65.41 -36.2 83.22 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.538 -179.239 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 27.6 t80 -65.76 -36.8 84.58 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 111.966 0.358 . . . . 0.0 111.966 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.12 -44.62 46.03 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.266 -0.574 . . . . 0.0 109.716 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -65.35 -43.26 91.39 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 123.146 0.279 . . . . 0.0 111.24 179.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 60.8 t60 -59.52 -49.25 78.49 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.173 0.434 . . . . 0.0 112.173 -178.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.04 -25.94 65.73 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -179.005 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -64.41 -39.64 94.23 Favored 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 111.566 0.21 . . . . 0.0 111.566 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 10.4 mtt-85 -74.85 -30.51 61.37 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.15 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.2 tp-100 -71.03 -38.63 72.58 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.53 -0.304 . . . . 0.0 110.537 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.9 tt0 -72.37 -37.85 68.67 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.538 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 61.3 m-20 -80.15 -5.24 55.68 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 41.4 t -59.27 -53.7 55.28 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 117.768 0.258 . . . . 0.0 111.237 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 134.93 68.22 0.07 OUTLIER Glycine 0 CA--C 1.527 0.812 0 N-CA-C 111.14 -0.784 . . . . 0.0 111.14 179.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.3 mtt85 -106.52 37.33 2.34 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 120.969 0.414 . . . . 0.0 110.491 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 9.5 tpt -111.77 -55.98 2.44 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.857 -179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 4.9 m -92.49 165.19 20.0 Favored Pre-proline 0 CA--C 1.536 0.438 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.744 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_exo -57.57 -62.8 0.18 Allowed 'Trans proline' 0 N--CA 1.5 1.901 0 C-N-CA 122.305 2.003 . . . . 0.0 112.382 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 18.5 ttt -83.01 -62.85 1.49 Allowed 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.328 -0.397 . . . . 0.0 110.624 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 139.26 -67.68 0.51 Allowed Glycine 0 CA--C 1.526 0.744 0 N-CA-C 111.059 -0.817 . . . . 0.0 111.059 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.8 p -101.63 147.55 26.3 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.546 0.212 . . . . 0.0 110.58 -179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -85.41 -44.9 12.37 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.443 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.9 t -96.4 -41.01 8.82 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.466 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 70.22 73.99 0.71 Allowed Glycine 0 CA--C 1.526 0.745 0 N-CA-C 111.028 -0.829 . . . . 0.0 111.028 179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.0 m -103.73 34.51 2.96 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-O 120.86 0.362 . . . . 0.0 110.741 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 5.5 p30 -107.25 143.8 34.96 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.641 179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 13.5 p -160.65 159.78 25.61 Favored Pre-proline 0 CA--C 1.535 0.371 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.574 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -55.35 177.73 0.11 Allowed 'Trans proline' 0 N--CA 1.502 1.99 0 C-N-CA 122.396 2.064 . . . . 0.0 112.449 -179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 4.7 t . . . . . 0 C--O 1.22 -0.449 0 CA-C-O 117.954 -1.022 . . . . 0.0 110.575 179.995 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.316 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.5 t -84.8 127.69 34.25 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.592 0.234 . . . . 0.0 110.522 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 30.1 tpp -82.61 97.94 8.74 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.604 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -136.58 -62.72 0.64 Allowed 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.557 -179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -100.34 34.73 2.29 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.749 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -103.87 124.91 49.81 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.428 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 15.9 p -71.7 156.98 38.75 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.989 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -103.09 31.08 4.43 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.892 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -139.11 115.07 10.17 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.64 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 53.2 p -106.37 135.2 19.51 Favored Pre-proline 0 CA--C 1.539 0.525 0 CA-C-N 116.295 -0.411 . . . . 0.0 110.132 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -81.91 123.5 4.15 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 C-N-CA 122.254 1.969 . . . . 0.0 112.296 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 164.89 -54.96 0.27 Allowed Glycine 0 CA--C 1.535 1.334 0 C-N-CA 121.059 -0.591 . . . . 0.0 111.795 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -78.85 82.95 2.36 Favored 'Trans proline' 0 N--CA 1.496 1.632 0 C-N-CA 122.274 1.983 . . . . 0.0 112.497 -179.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 12.3 mmt -72.29 82.29 1.03 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.24 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mp -76.11 143.56 41.19 Favored 'General case' 0 C--O 1.232 0.144 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 179.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.5 t -40.05 131.48 1.99 Allowed 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 -178.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 47.7 m -65.36 -26.2 67.92 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.16 179.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 51.9 p -78.96 -12.91 60.05 Favored 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 121.186 -0.206 . . . . 0.0 111.377 179.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 78.38 37.13 28.57 Favored Glycine 0 C--N 1.349 1.292 0 CA-C-O 119.808 -0.44 . . . . 0.0 113.375 178.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 29.1 p -77.56 -7.98 57.14 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-N 117.258 0.529 . . . . 0.0 111.801 178.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 85.4 5.94 84.43 Favored Glycine 0 CA--C 1.538 1.507 0 CA-C-O 119.774 -0.459 . . . . 0.0 113.207 179.522 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -109.79 172.02 7.1 Favored 'General case' 0 C--O 1.232 0.142 0 CA-C-N 117.679 0.739 . . . . 0.0 109.995 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -78.49 145.7 34.81 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.155 -178.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -118.59 169.35 13.43 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 110.41 -1.076 . . . . 0.0 110.41 179.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -112.27 141.81 25.77 Favored Pre-proline 0 N--CA 1.471 0.597 0 CA-C-N 116.73 0.265 . . . . 0.0 110.774 -179.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -76.0 -29.35 6.78 Favored 'Trans proline' 0 N--CA 1.495 1.565 0 C-N-CA 122.082 1.854 . . . . 0.0 112.307 179.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -71.72 -27.28 62.91 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 109.736 -0.468 . . . . 0.0 109.736 178.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 71.0 p -83.6 -152.74 0.13 Allowed 'General case' 0 CA--C 1.542 0.661 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 178.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -90.87 26.72 2.0 Allowed 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 118.236 0.471 . . . . 0.0 111.238 179.32 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 72.97 15.53 78.41 Favored Glycine 0 CA--C 1.536 1.4 0 N-CA-C 110.805 -0.918 . . . . 0.0 110.805 -177.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 24.7 mtp -121.65 163.41 19.02 Favored 'General case' 0 C--N 1.347 0.491 0 CA-C-N 117.085 0.443 . . . . 0.0 109.94 -179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 29.9 p -74.57 -167.39 0.55 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.911 -178.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.15 -37.68 61.24 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 112.854 0.687 . . . . 0.0 112.854 -177.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.0 t -72.13 -49.42 43.73 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 CA-C-O 120.579 0.228 . . . . 0.0 111.247 -177.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 67.4 m -70.27 -34.45 72.81 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.73 -178.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -69.47 -27.51 65.28 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 119.447 -0.311 . . . . 0.0 111.293 -179.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.9 ttpt -78.12 -45.99 21.87 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 117.992 0.36 . . . . 0.0 110.041 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -64.7 -38.87 92.48 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.587 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 54.3 t60 -66.12 -41.41 90.58 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.096 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.2 tp -71.61 -42.22 67.95 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.132 -178.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 20.9 pt20 -65.09 -35.83 82.39 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.865 -179.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 11.2 ttt180 -77.14 -28.48 54.28 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.722 178.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -76.83 -35.6 57.43 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.749 -0.205 . . . . 0.0 111.067 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.8 pt20 -77.8 -22.51 49.95 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -178.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -57.9 -39.29 77.56 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -178.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.5 t -136.33 -56.01 0.75 Allowed 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 120.498 0.189 . . . . 0.0 111.108 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 70.29 51.12 23.72 Favored Glycine 0 CA--C 1.528 0.856 0 N-CA-C 110.583 -1.007 . . . . 0.0 110.583 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -119.53 157.8 27.61 Favored 'General case' 0 N--CA 1.466 0.336 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 65.5 mtt -69.72 111.67 5.66 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 34.3 p -147.8 157.5 43.84 Favored Pre-proline 0 CA--C 1.534 0.361 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.004 -179.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo -67.08 165.55 26.05 Favored 'Trans proline' 0 N--CA 1.498 1.74 0 C-N-CA 122.278 1.985 . . . . 0.0 112.189 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 9.9 ptt? -64.66 -33.58 76.27 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.97 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 88.77 -67.97 2.9 Favored Glycine 0 CA--C 1.526 0.729 0 N-CA-C 111.293 -0.723 . . . . 0.0 111.293 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.0 m -80.95 138.43 36.1 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.625 0.25 . . . . 0.0 110.86 -179.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -74.89 161.69 29.3 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.404 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 7.8 t -86.38 -178.96 6.57 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.54 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 74.35 47.78 16.1 Favored Glycine 0 CA--C 1.528 0.856 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 88.1 p -86.93 -40.57 14.7 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.548 0.213 . . . . 0.0 110.453 179.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 58.2 m-80 -82.89 124.76 30.64 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.512 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 68.0 m -158.09 158.56 30.07 Favored Pre-proline 0 CA--C 1.533 0.325 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.445 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -56.58 138.53 85.01 Favored 'Trans proline' 0 N--CA 1.5 1.912 0 C-N-CA 122.341 2.027 . . . . 0.0 112.288 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 5.1 t . . . . . 0 C--O 1.22 -0.485 0 CA-C-O 117.982 -1.008 . . . . 0.0 110.619 -179.997 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.39 0 N-CA-C 109.596 -1.402 . . . . 0.0 109.596 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.1 t -137.53 104.77 5.44 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 110.544 -0.169 . . . . 0.0 110.544 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 63.2 mtp -101.39 94.12 5.76 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.575 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -116.3 -35.55 4.29 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.255 -179.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 -67.18 -34.58 77.82 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.438 -179.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -96.37 53.08 1.29 Allowed 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 121.256 0.55 . . . . 0.0 111.14 -179.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 80.6 p -146.07 153.69 41.0 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.198 179.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -68.63 -49.88 55.73 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.216 179.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 21.3 pt20 -120.98 175.67 5.94 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.035 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 58.7 p -140.61 89.98 10.11 Favored Pre-proline 0 CA--C 1.538 0.489 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.592 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_exo -67.11 137.21 43.41 Favored 'Trans proline' 0 N--CA 1.498 1.766 0 C-N-CA 122.304 2.003 . . . . 0.0 111.781 179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 170.26 -57.92 0.19 Allowed Glycine 0 CA--C 1.534 1.247 0 N-CA-C 111.548 -0.621 . . . . 0.0 111.548 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -68.98 77.41 0.79 Allowed 'Trans proline' 0 N--CA 1.494 1.509 0 C-N-CA 121.983 1.789 . . . . 0.0 111.861 -179.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 4.2 mmt -71.74 82.3 0.87 Allowed 'General case' 0 C--O 1.234 0.245 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.308 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.1 tp -74.83 144.75 43.32 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.294 -179.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.2 t -44.1 132.38 5.59 Favored 'General case' 0 N--CA 1.477 0.885 0 N-CA-C 113.675 0.991 . . . . 0.0 113.675 -178.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 44.0 m -65.44 -32.89 74.75 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.042 -0.981 . . . . 0.0 111.332 -179.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 73.8 p -72.65 -13.4 61.35 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 75.23 43.48 25.61 Favored Glycine 0 C--N 1.345 1.054 0 N-CA-C 111.771 -0.532 . . . . 0.0 111.771 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 29.2 p -85.38 -14.38 46.51 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.59 4.38 60.68 Favored Glycine 0 CA--C 1.536 1.406 0 C-N-CA 121.306 -0.473 . . . . 0.0 113.296 179.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -114.09 163.62 14.93 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-N 117.674 0.737 . . . . 0.0 110.561 -179.629 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -68.05 144.77 54.96 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.749 -179.016 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -110.13 161.19 13.03 Favored Glycine 0 CA--C 1.528 0.848 0 N-CA-C 110.777 -0.929 . . . . 0.0 110.777 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.412 ' HB3' HG23 ' A' ' 28' ' ' THR . 22.5 t30 -108.1 118.9 51.49 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-O 119.329 -0.367 . . . . 0.0 110.606 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -67.18 -18.91 51.13 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 C-N-CA 121.675 1.583 . . . . 0.0 112.154 179.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 60.9 mtp180 -75.36 -31.98 60.69 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 109.762 -0.459 . . . . 0.0 109.762 177.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.412 HG23 ' HB3' ' A' ' 25' ' ' ASN . 70.4 p -79.09 -153.44 0.07 Allowed 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 178.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -89.93 26.54 1.79 Allowed 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 118.204 0.456 . . . . 0.0 111.982 -179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.02 10.68 78.06 Favored Glycine 0 CA--C 1.536 1.391 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -121.75 161.8 21.96 Favored 'General case' 0 C--N 1.347 0.457 0 CA-C-N 117.249 0.524 . . . . 0.0 111.193 -178.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 31.1 p -72.25 -157.43 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.652 179.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.58 -49.26 19.11 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 -178.503 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 9.4 t -69.68 -52.04 35.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -177.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 71.2 m -60.05 -36.15 76.7 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 -178.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.445 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 14.5 t80 -58.87 -48.42 81.46 Favored 'General case' 0 N--CA 1.471 0.611 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 -178.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 49.1 pttt -72.32 -44.14 63.11 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 110.061 -0.348 . . . . 0.0 110.061 -179.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 34.8 mm-40 -54.63 -39.61 68.13 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.179 -179.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.445 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 0.8 OUTLIER -85.34 -33.33 22.08 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 120.425 -0.51 . . . . 0.0 111.753 -179.445 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 14.9 tp -62.47 -30.6 71.37 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.453 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 33.4 mt-30 -65.93 -39.29 90.38 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.379 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 70.0 mtt-85 -79.23 -30.86 43.41 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-N 116.572 -0.286 . . . . 0.0 111.229 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.9 tp60 -75.63 -37.77 59.45 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.076 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 12.1 tt0 -73.64 -40.59 63.63 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.948 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 65.6 m-20 -66.53 -42.19 87.61 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.844 -179.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.1 t -74.42 -63.84 1.15 Allowed 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.825 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 70.96 56.53 7.03 Favored Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 -179.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 53.4 mmt-85 -125.06 -47.6 1.77 Allowed 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.451 0.167 . . . . 0.0 110.566 -179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 42.2 mtm -100.97 113.2 25.97 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.373 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.0 m -90.61 166.38 19.59 Favored Pre-proline 0 CA--C 1.535 0.402 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.684 -179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -58.08 171.35 1.71 Allowed 'Trans proline' 0 N--CA 1.5 1.883 0 C-N-CA 122.294 1.996 . . . . 0.0 112.244 179.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 74.6 mmm -84.85 174.74 9.6 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.505 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 74.01 35.77 53.18 Favored Glycine 0 CA--C 1.527 0.805 0 N-CA-C 111.103 -0.799 . . . . 0.0 111.103 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 14.9 p -94.76 157.93 15.73 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.492 0.187 . . . . 0.0 110.565 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -86.26 139.75 30.74 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.494 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.9 t -81.0 174.25 11.8 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.58 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.89 78.1 1.39 Allowed Glycine 0 CA--C 1.527 0.789 0 N-CA-C 111.013 -0.835 . . . . 0.0 111.013 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 2.0 t -122.29 36.19 4.69 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.007 0.432 . . . . 0.0 110.444 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -71.03 127.74 33.59 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.667 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.3 p -158.22 88.91 2.31 Favored Pre-proline 0 CA--C 1.538 0.497 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.414 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -80.24 -169.63 0.83 Allowed 'Trans proline' 0 N--CA 1.492 1.438 0 C-N-CA 122.396 2.064 . . . . 0.0 112.248 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 4.6 t . . . . . 0 C--O 1.22 -0.464 0 CA-C-O 118.061 -0.971 . . . . 0.0 110.577 -179.97 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.418 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.6 m -106.06 111.32 23.89 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 110.436 -0.209 . . . . 0.0 110.436 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 50.8 mtt -150.31 105.1 3.31 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.724 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -136.49 33.64 2.75 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.764 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -135.4 35.57 2.97 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 120.957 0.408 . . . . 0.0 110.723 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -133.6 104.26 6.29 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.475 179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 16.9 p -80.4 150.18 29.9 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.595 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -105.0 -35.37 7.68 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.388 -0.369 . . . . 0.0 111.039 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -98.69 94.66 6.76 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.909 -179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.554 ' O ' HG23 ' A' ' 10' ' ' THR . 4.9 t -148.98 90.02 4.83 Favored Pre-proline 0 CA--C 1.54 0.594 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.575 179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -57.85 140.24 93.09 Favored 'Trans proline' 0 N--CA 1.502 1.992 0 C-N-CA 122.359 2.04 . . . . 0.0 112.287 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 72.99 44.78 35.11 Favored Glycine 0 CA--C 1.542 1.762 0 CA-C-O 119.332 -0.704 . . . . 0.0 112.627 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -76.23 71.64 5.69 Favored 'Trans proline' 0 N--CA 1.498 1.755 0 C-N-CA 122.126 1.884 . . . . 0.0 112.365 -179.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 11.3 mmt -72.46 72.02 0.96 Allowed 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.313 179.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.448 HD23 ' HA ' ' A' ' 15' ' ' LEU . 18.2 mt -79.36 140.43 37.48 Favored 'General case' 0 N--CA 1.463 0.185 0 C-N-CA 120.642 -0.423 . . . . 0.0 110.375 -179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.7 t -38.93 136.19 0.8 Allowed 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 114.068 1.136 . . . . 0.0 114.068 -177.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.4 m -64.92 -29.33 70.26 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.534 -179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 44.0 p -82.23 -6.96 59.59 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 71.73 43.52 51.09 Favored Glycine 0 C--N 1.344 0.978 0 C-N-CA 121.24 -0.505 . . . . 0.0 112.085 178.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.4 p -82.29 -6.81 59.5 Favored 'General case' 0 CA--C 1.548 0.879 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.3 0.62 79.81 Favored Glycine 0 CA--C 1.54 1.614 0 CA-C-O 119.648 -0.529 . . . . 0.0 112.954 179.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -110.64 177.6 4.63 Favored 'General case' 0 C--N 1.344 0.363 0 CA-C-N 117.791 0.795 . . . . 0.0 111.151 -179.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -84.13 144.91 28.7 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 115.639 -0.709 . . . . 0.0 112.51 -178.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -114.25 159.59 13.63 Favored Glycine 0 CA--C 1.53 1.019 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 178.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -105.97 140.0 20.8 Favored Pre-proline 0 N--CA 1.468 0.428 0 CA-C-O 119.3 -0.381 . . . . 0.0 110.245 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 34.9 Cg_endo -75.22 -23.15 13.72 Favored 'Trans proline' 0 N--CA 1.489 1.239 0 C-N-CA 121.746 1.63 . . . . 0.0 112.598 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 85.8 mtt-85 -75.33 -28.45 59.65 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 110.168 -0.308 . . . . 0.0 110.168 178.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 60.9 p -80.95 -151.29 0.08 Allowed 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 178.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -92.11 28.17 1.95 Allowed 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 117.984 0.356 . . . . 0.0 111.274 178.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 76.79 15.64 81.43 Favored Glycine 0 CA--C 1.536 1.349 0 N-CA-C 111.272 -0.731 . . . . 0.0 111.272 -178.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 40.2 mtt -123.65 169.76 11.15 Favored 'General case' 0 C--N 1.347 0.474 0 CA-C-N 117.389 0.594 . . . . 0.0 111.334 -179.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 22.4 p -79.08 -165.82 0.82 Allowed 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.781 -178.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.8 -41.98 51.29 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.02 0.748 . . . . 0.0 113.02 -178.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 13.9 t -68.27 -49.3 68.16 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -177.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 60.8 m -72.1 -34.64 68.79 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 -178.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 54.6 t80 -64.95 -27.03 68.56 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 -178.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 55.2 tttt -75.94 -41.66 50.98 Favored 'General case' 0 C--N 1.333 -0.142 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -67.12 -45.8 76.05 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.458 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 42.3 t60 -57.56 -45.51 85.06 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 -178.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 3.0 mp -62.88 -29.12 70.52 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.958 -179.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -66.79 -32.46 73.77 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 121.078 -0.249 . . . . 0.0 111.1 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -83.58 -33.59 25.35 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.672 -179.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.6 mm100 -78.67 -27.44 45.19 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.378 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -77.66 -41.98 36.31 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.425 -179.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 13.2 m-80 -66.3 -41.1 90.24 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 116.733 -0.212 . . . . 0.0 110.788 -179.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 36.4 m -72.17 -64.47 0.94 Allowed 'General case' 0 C--O 1.233 0.225 0 N-CA-C 110.129 -0.322 . . . . 0.0 110.129 179.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 90.07 -55.59 3.65 Favored Glycine 0 CA--C 1.524 0.649 0 N-CA-C 111.496 -0.642 . . . . 0.0 111.496 179.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 21.8 ttm180 -135.13 -58.75 0.79 Allowed 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 121.305 -0.158 . . . . 0.0 111.262 -179.412 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 5.0 mmt -71.42 107.65 4.46 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.852 -179.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 70.7 m -97.25 157.89 34.15 Favored Pre-proline 0 CA--C 1.533 0.325 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.141 179.74 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -77.48 -175.83 2.89 Favored 'Trans proline' 0 N--CA 1.493 1.481 0 C-N-CA 122.254 1.969 . . . . 0.0 112.112 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 45.4 mtm -88.59 -64.67 1.11 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.369 179.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 140.69 -59.87 0.56 Allowed Glycine 0 CA--C 1.524 0.631 0 N-CA-C 110.853 -0.899 . . . . 0.0 110.853 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.9 t -71.78 170.61 13.24 Favored 'General case' 0 C--O 1.234 0.249 0 N-CA-C 110.519 -0.178 . . . . 0.0 110.519 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -94.71 170.05 9.73 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.478 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 8.6 p -144.97 -56.74 0.34 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.465 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 90.28 53.05 2.4 Favored Glycine 0 CA--C 1.524 0.609 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.5 m -146.09 -57.21 0.3 Allowed 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.525 0.202 . . . . 0.0 110.586 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -95.05 146.47 24.25 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.631 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 35.7 m -86.62 153.6 55.65 Favored Pre-proline 0 CA--C 1.535 0.384 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.66 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -79.93 102.45 1.46 Allowed 'Trans proline' 0 N--CA 1.491 1.381 0 C-N-CA 122.335 2.023 . . . . 0.0 112.004 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 6.4 m . . . . . 0 C--O 1.219 -0.504 0 CA-C-O 118.022 -0.99 . . . . 0.0 110.592 -179.859 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.356 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.2 m -111.82 32.26 5.59 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 120.645 0.26 . . . . 0.0 110.872 -179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 61.7 mtt -69.07 -55.05 11.92 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.792 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -102.84 32.64 3.57 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.857 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 -116.75 33.03 5.8 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.586 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -109.7 -178.53 3.56 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-O 120.748 0.308 . . . . 0.0 111.23 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 33.9 p -73.99 166.52 23.23 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.413 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -106.76 28.81 7.56 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.237 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.406 ' O ' HG23 ' A' ' 10' ' ' THR . 2.0 pt20 -137.44 76.97 1.61 Allowed 'General case' 0 C--O 1.235 0.34 0 CA-C-O 121.218 0.532 . . . . 0.0 110.056 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.406 HG23 ' O ' ' A' ' 9' ' ' GLN . 3.3 p -154.2 151.28 24.0 Favored Pre-proline 0 C--O 1.234 0.259 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.673 179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -73.57 168.51 24.58 Favored 'Trans proline' 0 N--CA 1.493 1.498 0 C-N-CA 122.189 1.926 . . . . 0.0 112.064 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 143.31 -54.03 0.59 Allowed Glycine 0 CA--C 1.535 1.293 0 N-CA-C 111.445 -0.662 . . . . 0.0 111.445 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -79.72 95.15 1.03 Allowed 'Trans proline' 0 N--CA 1.493 1.477 0 C-N-CA 122.295 1.997 . . . . 0.0 112.78 -179.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -72.56 95.7 1.86 Allowed 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.757 179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.462 HD13 ' O ' ' A' ' 22' ' ' PHE . 2.1 mm? -78.22 142.84 37.63 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.223 -0.444 . . . . 0.0 109.83 179.722 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.1 t -51.1 120.95 5.42 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 39.5 m -59.67 -25.36 64.67 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.429 -179.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 66.7 p -72.04 -18.95 61.91 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.63 39.71 8.09 Favored Glycine 0 C--N 1.342 0.91 0 C-N-CA 121.194 -0.527 . . . . 0.0 111.988 178.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 30.5 p -89.28 -20.38 24.17 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 120.946 -0.301 . . . . 0.0 111.359 178.412 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 93.96 5.5 62.54 Favored Glycine 0 CA--C 1.538 1.514 0 CA-C-O 120.011 -0.327 . . . . 0.0 113.248 179.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.462 ' O ' HD13 ' A' ' 15' ' ' LEU . 18.7 m-85 -103.14 -177.57 3.41 Favored 'General case' 0 C--O 1.231 0.09 0 CA-C-N 117.444 0.622 . . . . 0.0 110.937 -179.125 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.7 t80 -89.01 134.03 34.13 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.299 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -107.95 165.38 12.9 Favored Glycine 0 CA--C 1.533 1.172 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.876 -179.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -114.92 134.89 22.41 Favored Pre-proline 0 CA--C 1.541 0.631 0 CA-C-O 119.523 -0.275 . . . . 0.0 111.419 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -76.55 -26.39 8.57 Favored 'Trans proline' 0 N--CA 1.496 1.638 0 C-N-CA 122.386 2.057 . . . . 0.0 112.228 179.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 36.3 mtt-85 -71.14 -33.33 69.97 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 178.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 45.9 p -77.52 -154.0 0.06 Allowed 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.0 m-80 -91.58 27.65 1.95 Allowed 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.322 0.51 . . . . 0.0 111.466 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.88 15.3 79.44 Favored Glycine 0 CA--C 1.534 1.244 0 N-CA-C 112.315 -0.314 . . . . 0.0 112.315 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -118.89 164.18 15.81 Favored 'General case' 0 C--N 1.342 0.261 0 CA-C-N 117.195 0.498 . . . . 0.0 110.706 -179.144 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 31.2 p -76.26 -157.57 0.08 Allowed 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.549 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.78 -50.4 20.75 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 112.277 0.473 . . . . 0.0 112.277 -179.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 21.3 t -67.36 -55.8 15.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 N-CA-C 112.233 0.457 . . . . 0.0 112.233 -177.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 91.1 m -55.73 -36.62 67.44 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 -178.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.464 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 35.3 t80 -59.62 -43.18 93.86 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -178.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 29.1 ttpt -73.32 -46.37 49.84 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-O 120.724 0.297 . . . . 0.0 110.385 -179.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -54.85 -39.4 68.58 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.944 -0.571 . . . . 0.0 112.376 -178.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.464 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 0.8 OUTLIER -85.98 -33.28 21.14 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 120.309 -0.557 . . . . 0.0 112.212 -179.238 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 17.5 tp -63.98 -33.4 75.64 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 120.555 0.217 . . . . 0.0 111.057 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -69.12 -38.75 79.04 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 116.197 -0.456 . . . . 0.0 109.864 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 45.7 mtp180 -72.8 -32.35 65.49 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.179 179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -76.51 -36.11 57.96 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.734 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 65.0 mt-30 -75.6 -37.18 60.03 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.654 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -67.58 -37.33 82.46 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.719 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 39.0 m -77.33 -50.28 13.14 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.494 179.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 68.03 48.05 56.13 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.923 -0.871 . . . . 0.0 110.923 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -98.01 -61.55 1.37 Allowed 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.427 0.156 . . . . 0.0 110.68 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 8.7 tpt -105.1 103.89 13.52 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.509 179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 97.2 p -162.68 155.83 16.95 Favored Pre-proline 0 CA--C 1.535 0.37 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.58 -179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -75.43 -36.03 2.53 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 122.298 1.999 . . . . 0.0 112.051 179.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 12.1 mmt -138.72 -62.93 0.55 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.483 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 100.12 -35.94 4.45 Favored Glycine 0 CA--C 1.527 0.788 0 N-CA-C 111.215 -0.754 . . . . 0.0 111.215 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 40.8 p -124.75 155.18 39.75 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.575 0.226 . . . . 0.0 110.551 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -89.38 117.66 28.48 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.504 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 45.4 m -88.69 176.1 7.24 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.559 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 87.68 77.68 1.27 Allowed Glycine 0 CA--C 1.526 0.749 0 N-CA-C 111.11 -0.796 . . . . 0.0 111.11 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.3 m -145.22 33.67 1.09 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 120.815 0.34 . . . . 0.0 110.815 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -76.28 152.94 36.33 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.674 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 39.9 t -136.72 149.01 65.73 Favored Pre-proline 0 CA--C 1.536 0.428 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.475 -179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -56.62 145.09 83.28 Favored 'Trans proline' 0 N--CA 1.501 1.957 0 C-N-CA 122.247 1.965 . . . . 0.0 112.414 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 3.5 m . . . . . 0 C--O 1.22 -0.481 0 CA-C-O 118.049 -0.977 . . . . 0.0 110.629 179.964 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.271 0 N-CA-C 109.535 -1.426 . . . . 0.0 109.535 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.8 m -136.84 140.83 42.71 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 38.9 mtt -148.35 179.81 7.51 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.713 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -91.78 -39.41 11.8 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.796 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.0 tt0 -99.21 30.27 3.55 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.169 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -77.45 113.98 15.81 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.641 -0.254 . . . . 0.0 110.519 179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.1 t -85.73 162.92 18.52 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.455 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -129.99 34.46 4.25 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.821 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -101.5 172.48 6.94 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.665 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 4.5 t -160.62 143.87 9.94 Favored Pre-proline 0 CA--C 1.54 0.575 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.443 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -75.59 167.0 27.39 Favored 'Trans proline' 0 N--CA 1.493 1.495 0 C-N-CA 122.139 1.893 . . . . 0.0 112.176 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 133.6 -62.59 0.63 Allowed Glycine 0 CA--C 1.536 1.39 0 N-CA-C 110.622 -0.991 . . . . 0.0 110.622 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -69.89 73.82 1.4 Allowed 'Trans proline' 0 N--CA 1.5 1.868 0 C-N-CA 122.419 2.079 . . . . 0.0 112.899 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 3.6 mmt -71.54 83.77 0.84 Allowed 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.346 179.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.96 144.99 40.68 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.5 t -46.3 134.03 9.11 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 113.665 0.987 . . . . 0.0 113.665 -178.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 3.9 m -67.92 -24.56 65.21 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 114.869 -1.06 . . . . 0.0 112.153 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.62 HG23 ' SD ' ' A' ' 31' ' ' MET . 76.9 p -81.53 -16.91 50.33 Favored 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 112.621 0.6 . . . . 0.0 112.621 -179.241 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.21 34.41 14.61 Favored Glycine 0 CA--C 1.527 0.821 0 C-N-CA 121.007 -0.616 . . . . 0.0 112.19 178.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 27.2 p -77.74 -18.54 56.41 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 120.595 -0.442 . . . . 0.0 110.841 178.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 91.62 9.8 62.47 Favored Glycine 0 CA--C 1.534 1.248 0 CA-C-O 119.982 -0.343 . . . . 0.0 112.759 179.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 59.9 m-85 -105.8 -171.05 1.83 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 117.485 0.643 . . . . 0.0 110.602 -179.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -97.46 143.57 28.05 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 120.66 0.267 . . . . 0.0 111.106 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -113.36 170.85 13.54 Favored Glycine 0 CA--C 1.528 0.856 0 N-CA-C 110.297 -1.121 . . . . 0.0 110.297 179.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -122.82 140.57 33.49 Favored Pre-proline 0 CA--C 1.538 0.513 0 CA-C-O 119.467 -0.301 . . . . 0.0 110.561 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -75.63 -17.36 18.27 Favored 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 121.835 1.69 . . . . 0.0 112.677 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.1 mmt180 -78.26 -34.24 49.19 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 109.909 -0.404 . . . . 0.0 109.909 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 40.7 p -77.63 -151.31 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 108.185 -1.043 . . . . 0.0 108.185 178.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -88.94 29.36 1.05 Allowed 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 118.534 0.607 . . . . 0.0 111.2 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 74.39 15.39 80.3 Favored Glycine 0 CA--C 1.535 1.301 0 N-CA-C 111.993 -0.443 . . . . 0.0 111.993 -179.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.62 ' SD ' HG23 ' A' ' 18' ' ' THR . 10.9 mtt -129.04 176.57 7.78 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 117.416 0.608 . . . . 0.0 109.979 -179.902 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 14.6 p -77.37 -169.31 1.37 Allowed 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.306 -178.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -74.85 -47.21 31.5 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 114.004 1.113 . . . . 0.0 114.004 -177.62 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 20.2 t -68.27 -52.49 37.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 120.999 -0.281 . . . . 0.0 111.3 -178.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 79.2 m -60.73 -36.99 80.24 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.146 -179.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.446 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 29.2 t80 -57.82 -33.21 68.37 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.482 -0.326 . . . . 0.0 110.517 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.4 mtpt -77.02 -45.86 25.77 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.804 0.335 . . . . 0.0 110.101 179.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -58.68 -41.3 85.88 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 -178.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.446 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.3 p-80 -82.11 -36.13 27.85 Favored 'General case' 0 N--CA 1.468 0.47 0 C-N-CA 120.21 -0.596 . . . . 0.0 111.697 -178.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 10.9 tp -62.02 -28.81 69.85 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 120.576 0.227 . . . . 0.0 110.877 179.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -61.82 -38.69 89.09 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.643 179.314 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 60.2 mtt180 -77.11 -29.45 54.79 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.55 178.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -73.84 -36.22 64.88 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.597 -0.274 . . . . 0.0 110.689 179.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.0 tt0 -72.77 -22.98 60.76 Favored 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 112.076 0.399 . . . . 0.0 112.076 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -51.57 -42.15 61.67 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 -179.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.8 p -89.76 -51.71 5.36 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.75 -0.205 . . . . 0.0 110.882 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 92.23 -54.32 2.84 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 111.042 -0.823 . . . . 0.0 111.042 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 17.5 ttt85 -129.69 97.69 4.59 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 120.565 0.221 . . . . 0.0 110.555 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 11.2 ttt -120.43 -62.75 1.43 Allowed 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.235 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 10.6 m -100.72 160.04 27.93 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.787 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -54.15 126.49 22.29 Favored 'Trans proline' 0 N--CA 1.501 1.948 0 C-N-CA 122.547 2.165 . . . . 0.0 112.663 -179.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 15.0 ttt -103.31 -41.43 6.04 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.709 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 100.01 -51.83 1.03 Allowed Glycine 0 CA--C 1.526 0.74 0 N-CA-C 110.716 -0.954 . . . . 0.0 110.716 -179.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.1 m -90.81 142.54 27.66 Favored 'General case' 0 C--O 1.232 0.153 0 N-CA-C 110.446 -0.205 . . . . 0.0 110.446 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -133.38 -51.03 0.87 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.499 -179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 2.8 t -85.87 -37.74 18.83 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.059 -0.518 . . . . 0.0 110.676 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 100.82 39.69 3.08 Favored Glycine 0 CA--C 1.525 0.702 0 N-CA-C 110.966 -0.854 . . . . 0.0 110.966 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.6 m -84.76 -58.89 2.53 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.514 0.197 . . . . 0.0 110.709 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -91.11 135.25 33.89 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.681 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.6 t -154.06 88.07 3.55 Favored Pre-proline 0 CA--C 1.538 0.492 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.536 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_exo -58.24 150.91 63.4 Favored 'Trans proline' 0 N--CA 1.5 1.868 0 C-N-CA 122.351 2.034 . . . . 0.0 112.18 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 30.9 p . . . . . 0 C--O 1.219 -0.53 0 CA-C-O 118.047 -0.978 . . . . 0.0 110.521 179.9 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.427 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.3 m -82.77 119.82 24.83 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 120.622 0.249 . . . . 0.0 110.57 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 17.5 ptm -150.94 33.49 0.6 Allowed 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.869 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -102.88 31.59 4.11 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.297 -0.41 . . . . 0.0 111.031 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 31.8 tt0 -101.72 -46.89 4.79 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.555 179.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -109.93 127.87 55.02 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.736 -179.806 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.7 t -114.19 159.15 20.43 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.428 179.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 34.1 m120 -101.09 33.56 2.81 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.684 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -89.88 112.19 23.47 Favored 'General case' 0 C--O 1.232 0.163 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.815 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 16.4 p -87.57 146.87 40.35 Favored Pre-proline 0 CA--C 1.535 0.383 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.159 179.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 63.1 Cg_endo -76.48 142.5 23.6 Favored 'Trans proline' 0 N--CA 1.495 1.607 0 C-N-CA 122.206 1.937 . . . . 0.0 111.829 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 175.9 -62.32 0.1 Allowed Glycine 0 CA--C 1.535 1.319 0 N-CA-C 111.43 -0.668 . . . . 0.0 111.43 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_endo -84.18 70.39 5.98 Favored 'Trans proline' 0 N--CA 1.49 1.307 0 C-N-CA 122.43 2.087 . . . . 0.0 112.286 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 19.1 mtt -70.01 96.84 1.08 Allowed 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.42 -179.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.438 HD13 ' O ' ' A' ' 22' ' ' PHE . 0.9 OUTLIER -73.77 140.97 46.27 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 109.55 -0.537 . . . . 0.0 109.55 179.255 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 12.2 t -39.67 137.06 0.92 Allowed 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -178.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 57.8 m -61.65 -25.41 67.36 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.197 -179.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 68.1 p -90.76 -5.58 55.49 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -178.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.35 41.38 85.69 Favored Glycine 0 C--N 1.341 0.841 0 N-CA-C 111.482 -0.647 . . . . 0.0 111.482 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 15.2 p -86.58 -13.23 46.37 Favored 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 102.2 -7.48 54.51 Favored Glycine 0 CA--C 1.542 1.765 0 CA-C-O 119.746 -0.474 . . . . 0.0 113.539 178.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.438 ' O ' HD13 ' A' ' 15' ' ' LEU . 11.4 m-85 -91.41 178.91 5.82 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 117.627 0.714 . . . . 0.0 110.895 -178.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 4.1 t80 -89.71 135.62 33.51 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.336 -179.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -100.78 140.18 14.76 Favored Glycine 0 CA--C 1.529 0.959 0 N-CA-C 111.069 -0.813 . . . . 0.0 111.069 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -99.89 135.47 20.45 Favored Pre-proline 0 CA--C 1.538 0.491 0 CA-C-O 119.446 -0.312 . . . . 0.0 110.253 -179.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -74.79 -21.78 16.0 Favored 'Trans proline' 0 N--CA 1.492 1.415 0 C-N-CA 121.791 1.66 . . . . 0.0 112.863 179.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -75.3 -31.75 60.77 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 110.012 -0.366 . . . . 0.0 110.012 178.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 54.0 p -79.59 -153.27 0.08 Allowed 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 178.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -91.45 27.34 2.0 Allowed 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 118.331 0.514 . . . . 0.0 111.046 178.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.35 17.25 76.57 Favored Glycine 0 CA--C 1.539 1.593 0 N-CA-C 110.978 -0.849 . . . . 0.0 110.978 -178.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 28.5 mtt -120.58 160.5 23.1 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-O 121.097 0.475 . . . . 0.0 111.571 -178.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 22.4 p -73.88 -161.62 0.12 Allowed 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.888 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -75.42 -43.21 51.09 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 -178.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.6 t -69.97 -45.89 75.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.9 m -73.53 -36.22 65.66 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 112.609 0.596 . . . . 0.0 112.609 -177.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -63.38 -37.3 86.72 Favored 'General case' 0 N--CA 1.469 0.475 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -178.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.76 -43.0 48.78 Favored 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.28 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 62.2 mm-40 -62.79 -47.76 82.09 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.586 -0.734 . . . . 0.0 110.541 179.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 58.5 t60 -58.49 -46.25 87.06 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.986 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 1.1 mp -60.96 -26.65 67.69 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.862 -0.608 . . . . 0.0 111.881 -179.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -55.24 -36.26 65.84 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-O 120.752 0.31 . . . . 0.0 111.354 -179.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 11.1 mtm105 -83.87 -29.08 27.51 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.921 -0.582 . . . . 0.0 111.083 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -66.06 -40.53 90.98 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 116.767 -0.197 . . . . 0.0 110.988 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.6 pt20 -66.68 -39.03 87.97 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.852 -178.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -75.34 -45.43 39.53 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 121.029 -0.268 . . . . 0.0 110.82 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 44.4 t -70.85 -56.46 6.23 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.615 -179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 102.29 -52.36 0.84 Allowed Glycine 0 CA--C 1.526 0.735 0 N-CA-C 110.867 -0.893 . . . . 0.0 110.867 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 98.4 mtt180 -139.33 95.3 2.91 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 7.3 ttt -83.26 -64.17 1.22 Allowed 'General case' 0 N--CA 1.463 0.196 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.387 -179.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 66.2 m -89.75 155.32 48.01 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 116.387 -0.369 . . . . 0.0 110.993 -179.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -74.18 179.73 5.51 Favored 'Trans proline' 0 N--CA 1.494 1.546 0 C-N-CA 122.248 1.965 . . . . 0.0 111.737 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -141.04 172.6 12.46 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.74 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 145.43 -50.11 0.64 Allowed Glycine 0 CA--C 1.527 0.791 0 N-CA-C 111.141 -0.784 . . . . 0.0 111.141 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 43.4 p -145.41 114.71 7.1 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-O 120.508 0.194 . . . . 0.0 110.661 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -114.53 84.54 2.08 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.411 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 77.3 p -152.26 -50.29 0.11 Allowed 'General case' 0 N--CA 1.461 0.115 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.498 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 91.3 59.75 1.35 Allowed Glycine 0 CA--C 1.527 0.803 0 N-CA-C 111.079 -0.808 . . . . 0.0 111.079 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 66.2 m -83.29 -61.18 1.92 Allowed 'General case' 0 C--O 1.234 0.275 0 CA-C-O 120.536 0.208 . . . . 0.0 110.721 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 26.2 m120 -80.42 113.77 18.84 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.777 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.8 t -79.16 148.46 71.29 Favored Pre-proline 0 CA--C 1.537 0.444 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.468 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -79.81 155.41 23.65 Favored 'Trans proline' 0 N--CA 1.492 1.416 0 C-N-CA 122.319 2.013 . . . . 0.0 112.129 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 16.7 p . . . . . 0 C--O 1.219 -0.55 0 CA-C-O 118.006 -0.997 . . . . 0.0 110.62 -179.88 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.268 0 N-CA-C 109.613 -1.395 . . . . 0.0 109.613 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.2 m -87.02 -57.93 2.78 Favored 'General case' 0 C--O 1.233 0.211 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 8.7 ptp -98.34 159.65 14.8 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.313 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -101.75 36.31 2.1 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 120.985 0.421 . . . . 0.0 110.654 -179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -109.39 -38.33 5.51 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.661 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -76.85 137.36 39.13 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.475 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.5 p -82.39 176.19 9.63 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.843 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -76.4 -52.58 9.6 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.388 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 20.5 mm100 -82.99 105.84 14.32 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.558 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 6.2 m -156.08 136.81 9.03 Favored Pre-proline 0 CA--C 1.537 0.465 0 CA-C-N 116.095 -0.502 . . . . 0.0 109.963 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -73.14 123.97 9.2 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 C-N-CA 121.866 1.711 . . . . 0.0 111.538 179.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 167.68 -55.82 0.22 Allowed Glycine 0 CA--C 1.536 1.351 0 N-CA-C 111.202 -0.759 . . . . 0.0 111.202 -179.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -72.02 67.05 3.31 Favored 'Trans proline' 0 N--CA 1.497 1.691 0 C-N-CA 122.086 1.858 . . . . 0.0 111.76 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 13.4 mtt -72.02 83.54 0.97 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 115.798 -0.637 . . . . 0.0 111.394 -179.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 13.3 mt -74.49 148.7 40.77 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.509 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 10.0 t -44.82 132.95 6.4 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.551 0.945 . . . . 0.0 113.551 -178.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 2.6 m -61.61 -29.07 69.8 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.796 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.556 HG23 ' SD ' ' A' ' 31' ' ' MET . 71.2 p -78.89 -9.75 59.59 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -179.652 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 71.94 33.23 62.86 Favored Glycine 0 C--N 1.342 0.888 0 N-CA-C 111.26 -0.736 . . . . 0.0 111.26 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.5 p -71.83 -19.14 62.02 Favored 'General case' 0 CA--C 1.545 0.788 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 101.37 4.28 53.19 Favored Glycine 0 CA--C 1.539 1.557 0 CA-C-O 119.569 -0.573 . . . . 0.0 113.481 178.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 76.2 m-85 -115.53 164.09 14.81 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 117.944 0.872 . . . . 0.0 111.038 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -69.21 146.55 52.29 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.571 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -109.68 166.89 12.63 Favored Glycine 0 CA--C 1.527 0.794 0 N-CA-C 110.216 -1.153 . . . . 0.0 110.216 178.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -114.93 135.96 22.51 Favored Pre-proline 0 N--CA 1.467 0.416 0 N-CA-C 109.948 -0.389 . . . . 0.0 109.948 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -74.82 -23.46 14.19 Favored 'Trans proline' 0 N--CA 1.495 1.58 0 C-N-CA 122.022 1.814 . . . . 0.0 112.928 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -75.67 -36.81 60.0 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 109.362 -0.607 . . . . 0.0 109.362 178.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.2 p -70.87 -154.93 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -89.76 29.21 1.2 Allowed 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.681 0.673 . . . . 0.0 111.031 179.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.44 16.27 78.33 Favored Glycine 0 CA--C 1.534 1.24 0 CA-C-O 119.872 -0.404 . . . . 0.0 112.465 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.556 ' SD ' HG23 ' A' ' 18' ' ' THR . 9.4 mtt -131.2 176.56 8.17 Favored 'General case' 0 C--N 1.343 0.298 0 CA-C-N 117.616 0.708 . . . . 0.0 111.213 -178.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 18.9 p -77.22 -167.15 0.84 Allowed 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.677 -179.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -73.51 -48.83 30.11 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -177.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 4.1 t -65.68 -57.74 9.57 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 N-CA-C 112.651 0.611 . . . . 0.0 112.651 -177.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 73.2 m -57.51 -35.38 70.18 Favored 'General case' 0 N--CA 1.469 0.525 0 N-CA-C 111.641 0.237 . . . . 0.0 111.641 -178.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.46 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 41.1 t80 -57.42 -41.45 80.42 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.216 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -74.29 -45.09 49.8 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -56.69 -39.76 74.37 Favored 'General case' 0 N--CA 1.467 0.39 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -179.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.46 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.6 p-80 -84.46 -33.24 23.68 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 120.006 -0.677 . . . . 0.0 111.675 -179.131 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 15.7 tp -62.33 -30.39 71.13 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.634 -0.257 . . . . 0.0 111.254 179.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -65.11 -39.47 93.16 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-O 120.662 0.268 . . . . 0.0 111.0 -179.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 61.9 mtm180 -76.11 -30.53 58.29 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.344 -179.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -76.74 -38.21 54.61 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.792 -179.683 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 18.1 mm-40 -75.26 -31.78 60.88 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 123.231 0.332 . . . . 0.0 110.776 179.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -55.65 -29.38 59.16 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 111.738 0.274 . . . . 0.0 111.738 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 20.2 m -60.47 -64.25 1.02 Allowed 'General case' 0 N--CA 1.468 0.469 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.358 -179.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 67.87 62.33 4.34 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 110.989 -0.844 . . . . 0.0 110.989 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 72.7 mtt180 -72.27 154.67 40.86 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 10.0 mtt -112.16 96.77 6.22 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.716 -179.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -161.29 159.0 23.95 Favored Pre-proline 0 CA--C 1.537 0.453 0 CA-C-N 115.907 -0.588 . . . . 0.0 110.186 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -57.1 -171.83 0.04 OUTLIER 'Trans proline' 0 N--CA 1.502 1.992 0 C-N-CA 122.338 2.025 . . . . 0.0 112.09 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 14.3 ptp -111.2 150.66 29.23 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.497 179.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 78.1 36.45 31.5 Favored Glycine 0 CA--C 1.527 0.81 0 N-CA-C 111.085 -0.806 . . . . 0.0 111.085 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.3 m -101.57 131.45 47.74 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.554 0.216 . . . . 0.0 110.576 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -80.97 88.46 5.92 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.718 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.3 t -152.72 -177.53 6.31 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.341 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.03 80.19 1.42 Allowed Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.5 t -144.91 33.51 1.12 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 120.743 0.306 . . . . 0.0 110.877 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -100.37 146.97 26.34 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.665 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 87.4 p -149.09 153.63 38.32 Favored Pre-proline 0 CA--C 1.536 0.415 0 CA-C-N 116.092 -0.503 . . . . 0.0 110.504 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_endo -77.18 142.8 21.93 Favored 'Trans proline' 0 N--CA 1.495 1.581 0 C-N-CA 122.407 2.071 . . . . 0.0 111.99 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 72.9 p . . . . . 0 C--O 1.22 -0.485 0 CA-C-O 118.041 -0.98 . . . . 0.0 110.59 -179.894 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.178 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.0 p -94.96 -50.26 5.19 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.521 0.201 . . . . 0.0 110.52 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -145.31 87.58 1.82 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.725 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -93.12 -38.32 11.66 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.621 179.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.6 mp0 -85.56 -52.72 5.64 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.717 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 57.5 mm-40 -80.69 94.85 6.43 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.038 -179.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 40.7 p -104.98 137.7 42.33 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.147 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -89.55 -66.13 0.95 Allowed 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.624 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -91.26 149.86 21.58 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.282 179.671 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.529 ' O ' HG23 ' A' ' 10' ' ' THR . 3.9 t -166.8 101.06 0.66 Allowed Pre-proline 0 CA--C 1.538 0.509 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.505 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -74.28 164.62 33.73 Favored 'Trans proline' 0 N--CA 1.492 1.429 0 C-N-CA 121.943 1.762 . . . . 0.0 111.611 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 155.74 -52.61 0.43 Allowed Glycine 0 CA--C 1.535 1.304 0 N-CA-C 111.249 -0.74 . . . . 0.0 111.249 -179.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -76.48 81.47 2.5 Favored 'Trans proline' 0 N--CA 1.493 1.497 0 C-N-CA 122.011 1.807 . . . . 0.0 112.236 -179.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 18.7 mmt -71.78 93.85 1.34 Allowed 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.954 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.463 ' HA ' HD13 ' A' ' 15' ' ' LEU . 2.5 mm? -79.83 139.65 37.12 Favored 'General case' 0 C--O 1.233 0.189 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.0 t -42.22 121.5 1.9 Allowed 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 113.11 0.782 . . . . 0.0 113.11 -178.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.1 m -55.94 -22.58 26.99 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.318 -179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 60.9 p -81.18 -9.64 59.76 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 111.922 0.341 . . . . 0.0 111.922 179.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 74.49 40.24 39.84 Favored Glycine 0 C--N 1.344 1.023 0 C-N-CA 121.457 -0.401 . . . . 0.0 112.357 179.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 24.2 p -86.62 -9.16 56.65 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 117.012 0.406 . . . . 0.0 112.066 179.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.21 -2.74 85.44 Favored Glycine 0 CA--C 1.537 1.441 0 CA-C-O 119.777 -0.457 . . . . 0.0 113.394 178.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.428 ' O ' HD13 ' A' ' 15' ' ' LEU . 67.2 m-85 -100.79 171.95 7.36 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 117.788 0.794 . . . . 0.0 110.533 -179.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -80.31 139.06 36.78 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.568 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -111.78 155.24 16.3 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 109.874 -1.291 . . . . 0.0 109.874 178.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.495 ' HB3' HG23 ' A' ' 28' ' ' THR . 1.9 t-20 -101.38 137.46 19.65 Favored Pre-proline 0 CA--C 1.537 0.47 0 CA-C-O 119.499 -0.286 . . . . 0.0 110.822 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -73.13 -27.28 14.01 Favored 'Trans proline' 0 N--CA 1.493 1.449 0 C-N-CA 121.848 1.699 . . . . 0.0 112.294 179.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.4 mmt180 -74.08 -26.9 60.63 Favored 'General case' 0 CA--C 1.536 0.433 0 O-C-N 123.041 0.213 . . . . 0.0 110.526 178.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.495 HG23 ' HB3' ' A' ' 25' ' ' ASN . 68.8 p -82.11 -150.49 0.09 Allowed 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 178.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 54.1 m-20 -91.21 28.3 1.67 Allowed 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 118.375 0.534 . . . . 0.0 110.891 178.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 76.01 17.51 80.0 Favored Glycine 0 CA--C 1.537 1.444 0 N-CA-C 111.702 -0.559 . . . . 0.0 111.702 -179.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 48.6 mtt -123.16 170.34 10.33 Favored 'General case' 0 C--N 1.347 0.491 0 CA-C-N 117.291 0.546 . . . . 0.0 111.419 -179.538 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 31.2 p -77.62 -167.79 1.04 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.324 -0.853 . . . . 0.0 109.639 179.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -73.24 -44.41 59.54 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -178.672 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 18.1 t -62.78 -51.22 74.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -178.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 68.5 m -70.62 -34.55 72.23 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.944 -178.351 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.437 ' CE1' HD13 ' A' ' 40' ' ' LEU . 38.9 t80 -64.83 -32.92 74.84 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.46 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -77.87 -43.05 31.39 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 120.475 -0.49 . . . . 0.0 110.906 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -63.64 -45.21 91.24 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 120.869 0.366 . . . . 0.0 110.106 179.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 39.6 t60 -59.94 -44.86 94.12 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 115.792 -0.64 . . . . 0.0 111.701 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.437 HD13 ' CE1' ' A' ' 36' ' ' TYR . 1.0 OUTLIER -65.33 -29.33 70.05 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.634 -178.798 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -71.99 -31.48 66.28 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 120.934 -0.307 . . . . 0.0 110.315 179.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 39.2 ttt-85 -75.21 -31.44 60.89 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.172 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -73.02 -25.53 60.99 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.568 -0.287 . . . . 0.0 111.235 179.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.2 mm-40 -79.43 -22.04 44.76 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -64.24 -36.27 83.55 Favored 'General case' 0 N--CA 1.466 0.331 0 N-CA-C 111.89 0.33 . . . . 0.0 111.89 -178.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 90.0 p -73.56 -62.65 1.41 Allowed 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 58.88 57.36 20.29 Favored Glycine 0 CA--C 1.53 1.01 0 CA-C-N 116.19 -0.459 . . . . 0.0 112.684 178.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 2.5 mpp_? -82.63 171.36 14.12 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 179.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 31.2 mtt -109.09 40.27 1.86 Allowed 'General case' 0 C--O 1.236 0.363 0 CA-C-O 120.861 0.362 . . . . 0.0 110.983 -179.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 38.8 m -98.61 155.15 37.08 Favored Pre-proline 0 CA--C 1.533 0.309 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.327 179.533 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_endo -82.16 176.67 7.92 Favored 'Trans proline' 0 N--CA 1.489 1.207 0 C-N-CA 122.357 2.038 . . . . 0.0 111.834 179.924 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -88.73 177.82 6.63 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.472 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 84.67 35.96 12.68 Favored Glycine 0 CA--C 1.527 0.787 0 N-CA-C 111.065 -0.814 . . . . 0.0 111.065 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.0 m -117.82 109.5 16.65 Favored 'General case' 0 N--CA 1.464 0.247 0 N-CA-C 110.396 -0.224 . . . . 0.0 110.396 179.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -95.82 -43.34 7.9 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.592 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 6.0 m -77.25 156.82 31.17 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.393 179.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 85.19 58.46 2.08 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 13.1 m -152.64 -61.27 0.15 Allowed 'General case' 0 C--O 1.233 0.2 0 CA-C-O 120.504 0.192 . . . . 0.0 110.513 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 13.3 p-10 -86.71 131.68 34.07 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.692 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 44.9 t -160.9 86.2 1.79 Allowed Pre-proline 0 CA--C 1.538 0.513 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.551 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -59.47 161.3 17.64 Favored 'Trans proline' 0 N--CA 1.498 1.789 0 C-N-CA 122.274 1.982 . . . . 0.0 112.026 -179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 6.5 t . . . . . 0 C--O 1.221 -0.433 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.601 179.973 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.367 0 N-CA-C 109.661 -1.375 . . . . 0.0 109.661 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 31.0 t -114.36 122.69 47.43 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 120.438 0.161 . . . . 0.0 110.588 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 64.8 mtt -89.67 -179.99 5.89 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.628 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -138.19 34.32 2.33 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.933 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -119.11 35.49 4.8 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.557 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -74.61 148.96 40.28 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.871 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.4 t -77.93 150.98 33.94 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.746 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -130.49 35.08 4.08 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.612 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -72.14 121.8 19.91 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.864 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 3.2 p -149.82 161.73 30.45 Favored Pre-proline 0 CA--C 1.536 0.439 0 CA-C-N 115.928 -0.578 . . . . 0.0 109.926 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -56.74 103.93 0.13 Allowed 'Trans proline' 0 N--CA 1.5 1.87 0 C-N-CA 122.079 1.852 . . . . 0.0 112.073 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -159.83 45.79 0.42 Allowed Glycine 0 CA--C 1.542 1.756 0 CA-C-O 119.199 -0.778 . . . . 0.0 111.982 -179.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -67.68 71.99 0.69 Allowed 'Trans proline' 0 N--CA 1.503 2.043 0 C-N-CA 122.193 1.929 . . . . 0.0 112.361 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 14.8 mmt -72.87 97.6 2.29 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.832 -179.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.2 mp -76.65 144.28 39.57 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 179.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.5 t -48.79 123.71 7.37 Favored 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 112.38 0.511 . . . . 0.0 112.38 -178.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 4.9 m -65.32 -30.57 71.43 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.015 -179.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 51.0 p -64.81 -23.03 67.11 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 -178.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 91.05 36.93 6.47 Favored Glycine 0 CA--C 1.526 0.76 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.132 179.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.9 p -84.81 -16.44 41.4 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 117.034 0.417 . . . . 0.0 110.91 178.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.49 12.68 66.72 Favored Glycine 0 C--N 1.349 1.298 0 CA-C-O 119.747 -0.474 . . . . 0.0 113.097 178.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -114.37 176.71 4.93 Favored 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 117.633 0.717 . . . . 0.0 111.833 -179.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 8.1 t80 -81.21 140.82 34.7 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.101 -0.954 . . . . 0.0 111.025 -179.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -124.7 -176.51 14.62 Favored Glycine 0 CA--C 1.53 1.008 0 N-CA-C 111.054 -0.819 . . . . 0.0 111.054 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -130.13 139.25 35.08 Favored Pre-proline 0 N--CA 1.47 0.536 0 CA-C-O 119.548 -0.263 . . . . 0.0 111.389 -179.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -77.07 -14.89 16.64 Favored 'Trans proline' 0 N--CA 1.49 1.273 0 C-N-CA 121.994 1.796 . . . . 0.0 112.949 178.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -77.6 -35.87 52.41 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 178.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 66.6 p -72.52 -154.77 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 177.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -90.77 26.02 2.19 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.574 0.624 . . . . 0.0 111.622 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 84.31 8.27 83.75 Favored Glycine 0 CA--C 1.538 1.484 0 N-CA-C 111.628 -0.589 . . . . 0.0 111.628 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -116.8 163.31 16.35 Favored 'General case' 0 C--N 1.346 0.413 0 CA-C-N 117.146 0.473 . . . . 0.0 110.987 -179.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 30.8 p -76.04 -157.71 0.08 Allowed 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -74.77 -48.3 26.28 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -179.061 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.2 t -69.03 -55.69 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 -178.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 77.7 m -57.19 -35.47 69.65 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.205 0.446 . . . . 0.0 112.205 -178.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.429 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 30.5 t80 -59.03 -40.44 85.04 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 111.833 0.309 . . . . 0.0 111.833 -179.127 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.6 tttm -74.37 -45.39 47.3 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.825 0.345 . . . . 0.0 110.347 -179.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -56.25 -38.51 71.23 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -178.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.429 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.6 p-80 -86.4 -33.4 20.49 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 120.191 -0.603 . . . . 0.0 112.155 -178.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 5.0 tt -65.91 -30.63 71.25 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.804 179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -58.77 -40.53 84.18 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.393 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 12.7 ttm180 -84.79 -29.56 25.33 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.894 179.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -69.83 -44.19 70.47 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-O 120.96 0.409 . . . . 0.0 110.089 179.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -67.63 -26.83 66.42 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.973 -179.565 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 7.1 t-20 -63.17 -47.51 82.31 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 120.495 0.188 . . . . 0.0 111.32 -179.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 12.3 p -100.77 -64.79 1.01 Allowed 'General case' 0 N--CA 1.464 0.254 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 179.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 79.06 34.81 32.37 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 111.488 -0.645 . . . . 0.0 111.488 179.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 31.7 mmt180 -104.41 160.65 14.74 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 109.948 -0.389 . . . . 0.0 109.948 179.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 38.9 mtt -101.89 -36.2 8.73 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.558 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.6 p -133.01 157.62 77.9 Favored Pre-proline 0 CA--C 1.535 0.398 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.685 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 55.3 Cg_endo -73.21 114.4 4.03 Favored 'Trans proline' 0 N--CA 1.494 1.554 0 C-N-CA 122.43 2.086 . . . . 0.0 112.289 179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -85.78 -40.66 15.81 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.419 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 95.18 35.82 5.64 Favored Glycine 0 CA--C 1.527 0.836 0 N-CA-C 111.314 -0.714 . . . . 0.0 111.314 179.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.2 m -107.08 147.7 29.68 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 179.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -72.47 -177.82 2.35 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.485 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 5.4 m -69.33 -42.04 75.86 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.365 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 106.78 80.05 1.28 Allowed Glycine 0 CA--C 1.526 0.753 0 N-CA-C 111.11 -0.796 . . . . 0.0 111.11 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 35.2 p -124.54 33.73 5.18 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.828 0.347 . . . . 0.0 110.768 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -92.41 131.77 37.31 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.754 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 13.1 m -91.6 158.18 40.82 Favored Pre-proline 0 CA--C 1.535 0.382 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.687 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_endo -79.38 138.04 13.65 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 122.311 2.007 . . . . 0.0 112.066 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 5.2 t . . . . . 0 C--O 1.219 -0.526 0 CA-C-O 118.059 -0.972 . . . . 0.0 110.51 -179.875 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.377 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.6 m -137.78 135.17 36.06 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-O 120.526 0.203 . . . . 0.0 110.68 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 56.3 mtm -143.47 123.55 13.65 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.622 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -126.46 33.28 5.03 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.791 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 21.0 tp60 -80.6 -60.11 2.44 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.408 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 53.1 mt-10 -103.75 111.03 23.36 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.413 179.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.4 m -86.77 119.34 26.89 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.411 -0.358 . . . . 0.0 110.449 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -90.81 -54.07 4.13 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.764 -179.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -89.72 152.43 21.34 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.612 179.902 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 2.3 p -92.48 158.32 38.77 Favored Pre-proline 0 CA--C 1.536 0.409 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.953 -179.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -76.11 159.58 37.2 Favored 'Trans proline' 0 N--CA 1.497 1.682 0 C-N-CA 122.406 2.071 . . . . 0.0 112.567 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.541 ' O ' HD23 ' A' ' 15' ' ' LEU . . . 67.06 44.01 89.13 Favored Glycine 0 CA--C 1.542 1.764 0 CA-C-O 119.125 -0.819 . . . . 0.0 112.71 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.419 ' CD ' ' N ' ' A' ' 12' ' ' GLY . 51.1 Cg_endo -71.41 -83.99 0.01 OUTLIER 'Trans proline' 0 N--CA 1.498 1.781 0 CA-C-N 119.802 1.801 . . . . 0.0 113.956 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 1.5 mtt -71.44 78.42 0.77 Allowed 'General case' 0 CA--C 1.536 0.417 0 CA-C-O 121.068 0.461 . . . . 0.0 112.173 -178.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.541 HD23 ' O ' ' A' ' 12' ' ' GLY . 2.0 mm? -71.27 148.36 47.24 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.139 179.018 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 11.2 t -41.34 140.66 0.82 Allowed 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -179.035 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 68.7 m -63.81 -29.19 70.42 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 115.526 -0.761 . . . . 0.0 111.824 -179.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.5 p -88.17 -5.19 58.55 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -179.174 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 71.03 38.71 63.81 Favored Glycine 0 C--N 1.343 0.972 0 CA-C-O 119.931 -0.372 . . . . 0.0 113.099 178.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 32.0 p -78.68 -17.78 55.41 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-N 117.179 0.489 . . . . 0.0 111.887 179.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 105.03 1.26 41.9 Favored Glycine 0 CA--C 1.54 1.621 0 CA-C-O 119.711 -0.494 . . . . 0.0 113.243 179.291 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 67.1 m-85 -109.01 156.74 19.39 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 117.767 0.783 . . . . 0.0 110.685 -179.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 26.4 t80 -65.25 146.17 55.29 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.289 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -109.04 163.43 12.59 Favored Glycine 0 CA--C 1.529 0.932 0 N-CA-C 110.257 -1.137 . . . . 0.0 110.257 179.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -113.21 136.22 21.8 Favored Pre-proline 0 CA--C 1.541 0.608 0 CA-C-O 119.276 -0.392 . . . . 0.0 110.098 -179.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -76.59 -22.73 11.88 Favored 'Trans proline' 0 N--CA 1.494 1.525 0 C-N-CA 122.052 1.835 . . . . 0.0 112.313 179.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 61.7 mtp180 -74.53 -33.57 62.8 Favored 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 178.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 44.8 p -82.12 -155.42 0.14 Allowed 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 107.641 -1.244 . . . . 0.0 107.641 178.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -89.56 24.94 2.12 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 118.623 0.647 . . . . 0.0 111.825 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.42 17.75 75.31 Favored Glycine 0 CA--C 1.54 1.604 0 N-CA-C 111.322 -0.711 . . . . 0.0 111.322 -179.187 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 16.9 mtt -120.33 155.38 33.46 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-N 117.152 0.476 . . . . 0.0 110.772 -179.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 29.3 p -66.38 -162.72 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.105 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -74.12 -48.36 30.0 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -178.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 17.5 t -62.61 -56.63 16.35 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-N 116.301 -0.409 . . . . 0.0 112.053 -178.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.6 m -60.39 -33.49 72.56 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -178.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 30.2 t80 -65.25 -34.87 79.38 Favored 'General case' 0 N--CA 1.464 0.265 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -178.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 39.3 tttt -77.26 -47.86 19.02 Favored 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 120.753 -0.379 . . . . 0.0 111.159 -179.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -66.1 -42.98 88.52 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.421 -179.002 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -59.39 -49.27 78.44 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.877 -178.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -63.76 -29.27 70.5 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 111.733 0.271 . . . . 0.0 111.733 -178.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -57.96 -40.65 81.09 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 120.47 0.176 . . . . 0.0 111.195 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 4.6 ptp180 -82.17 -30.84 30.77 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.952 179.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -70.69 -52.44 21.07 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.475 -179.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -58.15 -34.28 70.11 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.662 -179.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -65.63 -55.98 14.65 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.993 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.2 m -124.66 -64.68 1.09 Allowed 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.518 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 73.32 33.53 58.78 Favored Glycine 0 CA--C 1.528 0.886 0 N-CA-C 111.243 -0.743 . . . . 0.0 111.243 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 57.0 ttt180 -132.81 -65.01 0.73 Allowed 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.483 0.182 . . . . 0.0 110.764 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 39.7 mtm -120.93 -60.09 1.68 Allowed 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.836 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 2.7 p -156.6 159.49 31.33 Favored Pre-proline 0 CA--C 1.537 0.454 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.934 -179.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -76.24 -49.16 0.13 Allowed 'Trans proline' 0 N--CA 1.495 1.569 0 C-N-CA 122.452 2.101 . . . . 0.0 112.518 179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -93.41 -44.32 8.33 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.757 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 99.77 -59.98 0.76 Allowed Glycine 0 CA--C 1.527 0.783 0 N-CA-C 111.03 -0.828 . . . . 0.0 111.03 179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 21.0 p -92.46 173.92 7.55 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 120.486 0.184 . . . . 0.0 110.584 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -76.67 127.93 33.72 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.547 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 21.4 m -150.8 178.9 8.68 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.618 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 98.87 51.51 1.37 Allowed Glycine 0 CA--C 1.526 0.723 0 N-CA-C 111.132 -0.787 . . . . 0.0 111.132 179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 77.4 p -148.81 34.67 0.76 Allowed 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.995 0.426 . . . . 0.0 110.828 179.812 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -106.19 130.75 54.01 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.611 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 22.7 t -86.08 149.13 49.49 Favored Pre-proline 0 CA--C 1.536 0.435 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.403 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -55.08 132.62 53.4 Favored 'Trans proline' 0 N--CA 1.502 1.985 0 C-N-CA 122.364 2.043 . . . . 0.0 112.573 -179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 4.9 m . . . . . 0 N--CA 1.471 0.589 0 CA-C-O 117.966 -1.016 . . . . 0.0 111.188 179.909 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.247 0 N-CA-C 109.641 -1.383 . . . . 0.0 109.641 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.6 t -84.41 116.59 23.14 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 120.542 0.211 . . . . 0.0 110.583 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 10.3 ptp -142.34 32.85 1.5 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.083 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -77.76 -50.67 11.9 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.571 179.764 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 41.8 mt-30 -73.07 -45.32 58.03 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.542 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -85.72 111.44 20.12 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.533 -179.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.5 m -140.75 155.38 46.45 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.648 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -91.7 -39.96 11.53 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.909 -179.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -79.16 176.33 9.76 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.027 -179.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 13.5 m -153.94 106.29 2.48 Favored Pre-proline 0 CA--C 1.541 0.596 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.395 -179.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -87.39 130.6 2.86 Favored 'Trans proline' 0 N--CA 1.492 1.386 0 C-N-CA 122.408 2.072 . . . . 0.0 112.528 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.411 ' N ' ' CD ' ' A' ' 13' ' ' PRO . . . 65.21 43.87 94.72 Favored Glycine 0 CA--C 1.543 1.803 0 CA-C-O 119.111 -0.827 . . . . 0.0 112.856 179.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.411 ' CD ' ' N ' ' A' ' 12' ' ' GLY . 56.1 Cg_endo -71.88 87.07 0.86 Allowed 'Trans proline' 0 N--CA 1.498 1.779 0 C-N-CA 121.992 1.795 . . . . 0.0 112.373 -179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.04 78.51 0.93 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.427 179.826 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.549 HD23 ' O ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -79.19 145.21 33.78 Favored 'General case' 0 C--O 1.235 0.297 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 179.864 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.7 t -51.29 124.26 11.38 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -178.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 5.8 m -64.6 -22.03 66.87 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 115.525 -0.761 . . . . 0.0 112.11 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 58.0 p -76.7 -19.54 57.59 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 112.012 0.375 . . . . 0.0 112.012 -179.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 85.65 43.19 6.56 Favored Glycine 0 CA--C 1.528 0.901 0 C-N-CA 121.168 -0.539 . . . . 0.0 112.081 179.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 28.9 p -88.37 -22.6 23.71 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 116.958 0.379 . . . . 0.0 111.706 179.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 98.65 6.94 56.13 Favored Glycine 0 CA--C 1.539 1.531 0 CA-C-O 119.707 -0.496 . . . . 0.0 113.6 178.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.549 ' O ' HD23 ' A' ' 15' ' ' LEU . 63.8 m-85 -108.36 -170.34 1.66 Allowed 'General case' 0 CA--C 1.54 0.576 0 CA-C-N 117.819 0.809 . . . . 0.0 111.13 -179.265 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -96.7 141.21 30.2 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.201 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -111.08 172.59 15.22 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 111.049 -0.821 . . . . 0.0 111.049 179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -124.92 138.11 30.85 Favored Pre-proline 0 CA--C 1.54 0.571 0 CA-C-O 119.501 -0.285 . . . . 0.0 110.821 -179.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -75.79 -19.16 16.49 Favored 'Trans proline' 0 N--CA 1.498 1.748 0 C-N-CA 122.269 1.979 . . . . 0.0 112.488 178.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 75.0 mtt180 -75.96 -34.95 59.83 Favored 'General case' 0 N--CA 1.465 0.3 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 178.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 70.1 p -77.77 -154.41 0.07 Allowed 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -90.57 27.62 1.69 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.364 0.529 . . . . 0.0 111.718 179.825 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 79.26 10.88 85.59 Favored Glycine 0 CA--C 1.535 1.288 0 N-CA-C 111.6 -0.6 . . . . 0.0 111.6 -179.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.07 169.81 9.6 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 117.332 0.566 . . . . 0.0 111.097 -178.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 22.0 p -78.89 -162.03 0.35 Allowed 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.124 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.76 -45.92 40.65 Favored 'General case' 0 N--CA 1.467 0.379 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -178.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 11.7 t -69.35 -56.82 10.37 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -178.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 72.3 m -56.77 -35.43 68.65 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.444 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 31.7 t80 -57.94 -37.91 74.98 Favored 'General case' 0 N--CA 1.471 0.61 0 CA-C-N 116.778 -0.192 . . . . 0.0 111.166 -179.444 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.6 tttt -77.65 -45.48 24.89 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.897 0.379 . . . . 0.0 110.129 179.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -57.2 -40.86 78.26 Favored 'General case' 0 N--CA 1.466 0.352 0 N-CA-C 112.878 0.695 . . . . 0.0 112.878 -178.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.444 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.1 p-80 -82.14 -33.85 29.41 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 120.102 -0.639 . . . . 0.0 111.398 -179.085 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.5 tp -64.28 -29.27 70.37 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.582 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 5.3 tp60 -61.94 -40.95 97.3 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 120.605 0.24 . . . . 0.0 111.289 -179.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 36.9 ttt85 -84.13 -31.38 25.26 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.495 -179.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 14.2 tt0 -73.1 -48.18 37.93 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.575 0.226 . . . . 0.0 111.061 -179.68 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -63.82 -21.89 66.65 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 116.286 -0.416 . . . . 0.0 112.083 -179.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -57.42 -31.63 66.07 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 -179.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 2.7 t -59.85 -66.85 0.45 Allowed 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 66.25 63.04 4.2 Favored Glycine 0 CA--C 1.528 0.878 0 N-CA-C 111.027 -0.829 . . . . 0.0 111.027 -179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 13.2 ptt180 -94.67 64.75 3.02 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.22 0.533 . . . . 0.0 110.768 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 5.4 tpt -87.22 -61.58 1.69 Allowed 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.044 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 1.2 t -91.8 153.76 43.73 Favored Pre-proline 0 CA--C 1.534 0.355 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.83 179.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -57.43 -41.93 67.04 Favored 'Trans proline' 0 N--CA 1.501 1.924 0 C-N-CA 122.16 1.906 . . . . 0.0 112.135 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 56.1 mtt -73.22 -62.72 1.37 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.351 179.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 135.3 -41.74 1.41 Allowed Glycine 0 CA--C 1.527 0.805 0 N-CA-C 111.035 -0.826 . . . . 0.0 111.035 179.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 37.2 p -128.93 126.08 38.91 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 110.474 -0.195 . . . . 0.0 110.474 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -91.27 173.32 7.98 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.55 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 58.6 m -148.45 177.08 9.76 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.611 -179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 74.49 68.55 1.54 Allowed Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.006 -0.838 . . . . 0.0 111.006 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 28.4 p -149.88 32.69 0.68 Allowed 'General case' 0 C--O 1.236 0.352 0 CA-C-O 120.772 0.32 . . . . 0.0 110.906 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -97.24 127.41 43.18 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.418 -0.356 . . . . 0.0 110.564 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.4 m -155.32 158.25 31.91 Favored Pre-proline 0 CA--C 1.535 0.379 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.537 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -74.91 153.29 42.12 Favored 'Trans proline' 0 N--CA 1.495 1.596 0 C-N-CA 122.317 2.012 . . . . 0.0 111.933 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 32.4 p . . . . . 0 C--O 1.219 -0.518 0 CA-C-O 118.018 -0.992 . . . . 0.0 110.513 -179.984 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.34 0 N-CA-C 109.589 -1.404 . . . . 0.0 109.589 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.7 m -88.53 137.73 32.06 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 120.552 0.215 . . . . 0.0 110.608 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 33.0 ttp -101.41 35.33 2.3 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.248 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -112.27 -33.92 6.07 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.175 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -96.88 43.28 1.07 Allowed 'General case' 0 C--O 1.238 0.466 0 CA-C-O 120.948 0.404 . . . . 0.0 111.029 -179.447 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -134.37 49.03 2.27 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-O 121.205 0.526 . . . . 0.0 110.333 179.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 24.0 p -144.11 168.46 19.98 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.848 -0.614 . . . . 0.0 110.572 179.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -72.42 -36.14 68.53 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.949 -179.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 2.3 tp60 -96.88 131.05 44.03 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.376 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.547 ' O ' HG23 ' A' ' 10' ' ' THR . 5.0 t -135.73 96.56 13.26 Favored Pre-proline 0 CA--C 1.541 0.632 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.657 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -78.66 -174.88 2.45 Favored 'Trans proline' 0 N--CA 1.498 1.753 0 C-N-CA 122.357 2.038 . . . . 0.0 112.569 -179.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 156.94 -55.37 0.39 Allowed Glycine 0 CA--C 1.535 1.33 0 N-CA-C 111.106 -0.798 . . . . 0.0 111.106 179.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -84.46 100.09 0.77 Allowed 'Trans proline' 0 N--CA 1.488 1.171 0 C-N-CA 122.442 2.095 . . . . 0.0 112.195 -179.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 6.7 mmt -70.81 82.64 0.64 Allowed 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.63 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -75.07 146.75 41.23 Favored 'General case' 0 N--CA 1.461 0.086 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 179.304 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.8 t -48.96 124.59 8.95 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -178.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 22.5 m -62.68 -27.13 69.03 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.758 179.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 68.4 p -71.04 -20.88 62.33 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 -179.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 84.8 34.09 16.65 Favored Glycine 0 C--N 1.342 0.899 0 N-CA-C 111.855 -0.498 . . . . 0.0 111.855 179.186 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 31.4 p -78.85 -17.12 56.17 Favored 'General case' 0 CA--C 1.547 0.85 0 N-CA-C 111.77 0.285 . . . . 0.0 111.77 179.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.53 6.34 59.76 Favored Glycine 0 CA--C 1.538 1.511 0 CA-C-O 119.678 -0.512 . . . . 0.0 113.708 178.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -116.45 167.64 10.86 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 117.936 0.868 . . . . 0.0 111.313 -179.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -69.46 143.99 53.38 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 116.064 -0.516 . . . . 0.0 111.713 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -114.79 171.09 13.53 Favored Glycine 0 CA--C 1.531 1.041 0 N-CA-C 110.836 -0.905 . . . . 0.0 110.836 179.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -118.27 139.35 26.66 Favored Pre-proline 0 N--CA 1.471 0.608 0 CA-C-N 116.642 0.221 . . . . 0.0 111.265 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -78.68 -25.31 6.61 Favored 'Trans proline' 0 N--CA 1.489 1.245 0 C-N-CA 122.191 1.927 . . . . 0.0 113.195 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 33.1 mmt180 -74.15 -33.03 63.38 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 109.109 -0.7 . . . . 0.0 109.109 178.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 71.0 p -74.57 -155.92 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 177.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -90.01 26.07 1.95 Allowed 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 118.2 0.454 . . . . 0.0 111.446 179.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 81.83 10.91 83.5 Favored Glycine 0 CA--C 1.539 1.537 0 N-CA-C 111.429 -0.668 . . . . 0.0 111.429 -179.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -119.95 163.32 17.76 Favored 'General case' 0 C--N 1.346 0.436 0 CA-C-N 117.335 0.568 . . . . 0.0 110.538 -179.185 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 28.3 p -74.7 -158.59 0.08 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.773 -179.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -75.36 -47.03 29.48 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -178.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 16.3 t -69.58 -51.03 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 CA-C-O 120.749 0.309 . . . . 0.0 111.311 -178.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 74.1 m -62.88 -37.75 88.14 Favored 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 112.489 0.552 . . . . 0.0 112.489 -178.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.433 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 26.1 t80 -59.22 -45.99 89.65 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -178.682 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 38.5 pttt -74.13 -44.08 55.12 Favored 'General case' 0 C--N 1.331 -0.239 0 C-N-CA 120.479 -0.488 . . . . 0.0 110.206 -179.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -55.5 -36.51 66.75 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.505 0.558 . . . . 0.0 112.505 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.433 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 0.7 OUTLIER -86.5 -33.79 20.22 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 120.161 -0.616 . . . . 0.0 112.361 -179.302 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 11.0 tp -62.51 -28.97 70.21 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 121.251 -0.18 . . . . 0.0 111.435 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.3 tp60 -63.76 -38.74 92.25 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 116.58 -0.282 . . . . 0.0 111.407 -179.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 9.8 tpp180 -76.45 -29.35 56.92 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.701 179.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -74.47 -38.43 62.93 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 116.401 -0.363 . . . . 0.0 110.488 -179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -74.67 -42.93 57.56 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.104 -179.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 37.9 t30 -61.46 -33.09 73.16 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.233 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.2 m -82.29 -65.82 0.96 Allowed 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.29 -0.413 . . . . 0.0 110.067 179.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 88.62 -56.19 4.15 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 111.529 -0.628 . . . . 0.0 111.529 179.326 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 56.5 mtp85 -140.02 -69.27 0.41 Allowed 'General case' 0 C--O 1.233 0.199 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 18.9 mtt -99.55 146.11 26.77 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.462 179.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 96.7 p -105.62 144.52 29.03 Favored Pre-proline 0 CA--C 1.536 0.412 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.251 179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -56.05 -63.39 0.18 Allowed 'Trans proline' 0 N--CA 1.503 2.049 0 C-N-CA 122.21 1.94 . . . . 0.0 112.558 -179.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 11.7 ttt -101.77 -59.13 1.75 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.59 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.12 -55.63 0.59 Allowed Glycine 0 CA--C 1.525 0.715 0 N-CA-C 110.648 -0.981 . . . . 0.0 110.648 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.3 t -144.56 150.9 38.28 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.525 0.203 . . . . 0.0 110.521 179.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -141.47 119.48 11.99 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.629 -179.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 12.6 t -147.58 104.74 3.64 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.584 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 68.11 41.06 87.86 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 111.05 -0.82 . . . . 0.0 111.05 179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 4.2 m -98.99 -62.59 1.21 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-O 120.544 0.212 . . . . 0.0 110.515 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 12.3 p-10 -96.43 125.23 40.77 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.685 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.5 t -154.18 90.77 3.2 Favored Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.602 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -82.12 155.83 17.24 Favored 'Trans proline' 0 N--CA 1.493 1.455 0 C-N-CA 122.286 1.99 . . . . 0.0 111.902 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 6.4 m . . . . . 0 C--O 1.221 -0.421 0 CA-C-O 117.996 -1.002 . . . . 0.0 110.587 -179.945 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.308 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 59.0 p -91.45 136.35 33.18 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 120.579 0.228 . . . . 0.0 110.438 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 55.2 mtt -143.13 121.68 12.47 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.541 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -92.71 -35.13 13.64 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.908 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.5 tm0? -80.67 -39.19 27.7 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.537 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -69.9 152.74 44.16 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.351 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.3 m -67.32 101.23 0.91 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.595 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -93.91 -38.94 10.95 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.576 -179.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 24.8 mp0 -78.79 135.48 37.1 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.428 179.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.561 ' O ' HG23 ' A' ' 10' ' ' THR . 6.3 t -151.12 92.97 3.71 Favored Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 116.444 -0.343 . . . . 0.0 110.757 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_exo -58.7 100.68 0.12 Allowed 'Trans proline' 0 N--CA 1.501 1.945 0 C-N-CA 122.322 2.014 . . . . 0.0 112.179 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -114.82 -61.54 0.38 Allowed Glycine 0 CA--C 1.539 1.532 0 N-CA-C 111.709 -0.556 . . . . 0.0 111.709 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_exo -60.64 100.68 0.16 Allowed 'Trans proline' 0 N--CA 1.499 1.8 0 C-N-CA 122.164 1.909 . . . . 0.0 112.177 -179.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 3.7 mmt -71.86 83.27 0.92 Allowed 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.359 179.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.5 mp -74.17 146.78 43.17 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.233 -179.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.3 t -46.6 131.53 11.22 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.592 0.59 . . . . 0.0 112.592 -179.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -61.55 -32.33 72.39 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.931 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 76.5 p -72.35 -13.98 61.62 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 120.993 -0.283 . . . . 0.0 111.242 178.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 74.59 42.4 32.87 Favored Glycine 0 C--N 1.345 1.081 0 N-CA-C 111.667 -0.573 . . . . 0.0 111.667 179.255 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 29.4 p -80.3 -15.87 55.93 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 120.742 -0.383 . . . . 0.0 111.914 179.81 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 95.3 2.72 61.88 Favored Glycine 0 CA--C 1.54 1.611 0 CA-C-O 119.971 -0.349 . . . . 0.0 113.073 179.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -102.96 -168.13 1.48 Allowed 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 117.373 0.587 . . . . 0.0 109.837 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 5.3 t80 -98.9 142.01 30.95 Favored 'General case' 0 C--O 1.234 0.25 0 N-CA-C 110.755 -0.091 . . . . 0.0 110.755 179.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -108.2 164.56 12.77 Favored Glycine 0 CA--C 1.531 1.07 0 N-CA-C 111.414 -0.675 . . . . 0.0 111.414 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.492 ' HB3' HG23 ' A' ' 28' ' ' THR . 13.2 t-20 -119.22 122.72 29.29 Favored Pre-proline 0 CA--C 1.54 0.587 0 CA-C-O 119.195 -0.431 . . . . 0.0 111.135 -179.424 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -67.37 -16.35 47.68 Favored 'Trans proline' 0 N--CA 1.493 1.471 0 C-N-CA 121.775 1.65 . . . . 0.0 112.957 178.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.9 mpt_? -76.77 -35.58 57.61 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 177.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.492 HG23 ' HB3' ' A' ' 25' ' ' ASN . 46.6 p -72.08 -156.66 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 178.109 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 7.7 m-20 -91.22 26.62 2.14 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 118.235 0.47 . . . . 0.0 112.09 179.507 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 90.15 8.74 66.3 Favored Glycine 0 CA--C 1.534 1.246 0 CA-C-O 119.793 -0.448 . . . . 0.0 112.104 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.64 165.68 18.12 Favored 'General case' 0 C--N 1.345 0.399 0 CA-C-N 117.697 0.749 . . . . 0.0 111.326 -179.097 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 24.3 p -73.22 -156.45 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.744 -178.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -76.3 -51.48 11.9 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 -179.065 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 3.3 t -67.94 -56.6 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -177.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 81.8 m -58.39 -38.09 76.61 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -178.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.435 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 5.3 t80 -57.16 -39.71 75.8 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 111.713 0.264 . . . . 0.0 111.713 -178.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 9.6 ttpt -75.82 -45.07 37.98 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.121 179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -55.11 -38.86 68.69 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -179.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.435 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 2.2 p-80 -85.31 -32.38 22.52 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 120.136 -0.626 . . . . 0.0 111.278 -179.635 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 25.6 tp -61.53 -30.3 70.54 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.612 179.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 22.8 tt0 -56.57 -37.54 70.72 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 120.732 0.301 . . . . 0.0 111.183 -179.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 45.5 mmm-85 -79.04 -28.22 43.22 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.558 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -81.19 -32.67 33.42 Favored 'General case' 0 N--CA 1.466 0.336 0 O-C-N 123.051 0.219 . . . . 0.0 111.45 -179.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -74.29 -25.49 59.61 Favored 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 111.666 0.247 . . . . 0.0 111.666 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.66 -38.87 92.02 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.571 0.224 . . . . 0.0 110.905 -179.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 77.8 p -97.22 -44.65 6.84 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.0 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 68.15 43.7 79.52 Favored Glycine 0 CA--C 1.526 0.769 0 N-CA-C 110.461 -1.056 . . . . 0.0 110.461 -179.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 26.6 mmt180 -75.69 142.1 42.58 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.835 0.35 . . . . 0.0 111.556 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -122.52 33.93 5.3 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.36 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 17.3 t -162.01 144.7 8.85 Favored Pre-proline 0 CA--C 1.538 0.514 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.919 -179.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -82.24 96.92 0.88 Allowed 'Trans proline' 0 N--CA 1.492 1.432 0 C-N-CA 122.467 2.111 . . . . 0.0 112.005 179.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 26.7 mmt -103.29 -51.7 3.18 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.604 -179.805 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 74.21 36.38 50.91 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 111.327 -0.709 . . . . 0.0 111.327 179.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 5.7 m -96.15 118.32 32.49 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 110.385 -0.228 . . . . 0.0 110.385 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -89.95 103.47 16.13 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.538 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.7 t -145.02 102.58 3.78 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.694 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 74.65 43.54 28.96 Favored Glycine 0 CA--C 1.526 0.759 0 N-CA-C 111.241 -0.744 . . . . 0.0 111.241 179.749 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 66.1 p -85.3 -52.02 6.18 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-O 120.595 0.236 . . . . 0.0 110.394 179.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -86.58 110.75 20.02 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.676 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 22.8 p -85.93 158.72 55.75 Favored Pre-proline 0 CA--C 1.534 0.334 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.294 179.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -75.5 -178.68 4.44 Favored 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 122.248 1.965 . . . . 0.0 112.152 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 17.6 p . . . . . 0 C--O 1.221 -0.44 0 CA-C-O 118.04 -0.981 . . . . 0.0 110.525 -179.96 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 109.594 -1.402 . . . . 0.0 109.594 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 68.1 m -92.46 98.47 11.49 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 120.611 0.243 . . . . 0.0 110.724 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 34.9 mtt -154.27 32.46 0.43 Allowed 'General case' 0 CA--C 1.535 0.367 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.752 179.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -111.69 35.07 3.81 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 120.845 0.355 . . . . 0.0 110.604 179.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -131.86 37.84 3.59 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 121.18 0.514 . . . . 0.0 110.589 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -98.28 -53.23 3.41 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.225 179.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.3 m -90.63 140.46 29.74 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.65 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -130.74 -50.42 1.05 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.085 -0.507 . . . . 0.0 109.693 179.474 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 -91.12 139.3 30.89 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.061 179.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.6 m -150.85 91.34 4.04 Favored Pre-proline 0 CA--C 1.536 0.413 0 CA-C-N 116.226 -0.443 . . . . 0.0 109.856 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 25.2 Cg_exo -58.82 164.62 9.47 Favored 'Trans proline' 0 N--CA 1.497 1.734 0 C-N-CA 122.335 2.024 . . . . 0.0 112.671 -178.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.413 ' N ' ' CD ' ' A' ' 13' ' ' PRO . . . 77.01 44.5 13.8 Favored Glycine 0 CA--C 1.538 1.48 0 CA-C-O 119.277 -0.735 . . . . 0.0 111.742 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.413 ' CD ' ' N ' ' A' ' 12' ' ' GLY . 39.7 Cg_endo -67.91 90.89 0.36 Allowed 'Trans proline' 0 N--CA 1.494 1.53 0 CA-C-N 119.532 1.666 . . . . 0.0 111.535 -179.279 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 12.5 mmt -64.86 82.39 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 116.022 -0.536 . . . . 0.0 111.286 -179.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.7 mp -80.42 147.23 31.07 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 178.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.3 t -49.21 115.86 1.47 Allowed 'General case' 0 N--CA 1.475 0.798 0 CA-C-O 121.24 0.543 . . . . 0.0 112.359 -178.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 66.8 m -60.52 -20.1 59.18 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 115.073 -0.967 . . . . 0.0 113.129 -178.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.42 HG23 ' SD ' ' A' ' 31' ' ' MET . 76.0 p -80.74 -11.96 59.54 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -179.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 97.98 40.42 3.55 Favored Glycine 0 C--N 1.346 1.093 0 C-N-CA 121.272 -0.489 . . . . 0.0 112.454 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 56.4 m -87.39 -28.55 22.09 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 116.808 0.304 . . . . 0.0 111.718 179.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.49 8.13 85.34 Favored Glycine 0 CA--C 1.541 1.675 0 N-CA-C 111.463 -0.655 . . . . 0.0 111.463 -177.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -106.24 -175.98 2.95 Favored 'General case' 0 C--N 1.346 0.435 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 179.39 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 7.8 t80 -94.03 142.01 27.88 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-O 120.887 0.375 . . . . 0.0 111.474 -179.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -113.18 169.46 12.95 Favored Glycine 0 CA--C 1.524 0.611 0 N-CA-C 109.967 -1.253 . . . . 0.0 109.967 179.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -112.66 138.65 22.13 Favored Pre-proline 0 CA--C 1.537 0.478 0 CA-C-O 119.646 -0.216 . . . . 0.0 110.577 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -73.48 -27.18 13.38 Favored 'Trans proline' 0 N--CA 1.494 1.552 0 C-N-CA 122.019 1.813 . . . . 0.0 112.547 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 67.2 mtt180 -72.83 -36.07 67.41 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 178.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 60.3 p -75.66 -154.51 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 178.154 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.41 ' HB2' ' CD1' ' A' ' 36' ' ' TYR . 0.4 OUTLIER -90.37 29.48 1.26 Allowed 'General case' 0 CA--C 1.54 0.585 0 CA-C-N 118.256 0.48 . . . . 0.0 112.153 -179.697 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 66.25 17.0 65.54 Favored Glycine 0 CA--C 1.535 1.327 0 C-N-CA 121.126 -0.559 . . . . 0.0 112.374 179.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . 0.42 ' SD ' HG23 ' A' ' 18' ' ' THR . 15.3 mtt -124.26 179.7 4.79 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 117.339 0.57 . . . . 0.0 109.79 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 20.2 p -83.63 -175.61 5.9 Favored 'General case' 0 CA--C 1.542 0.659 0 O-C-N 122.966 0.166 . . . . 0.0 110.591 -179.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.61 -45.61 78.57 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -177.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 6.4 t -66.28 -37.17 79.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 CA-C-O 120.76 0.314 . . . . 0.0 111.361 -178.415 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 21.7 m -73.49 -40.08 64.37 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.943 -0.571 . . . . 0.0 112.326 -178.707 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.43 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 18.4 t80 -61.82 -33.66 74.53 Favored 'General case' 0 N--CA 1.465 0.315 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -177.736 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -79.28 -45.85 18.92 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.472 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -62.88 -46.97 85.35 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 113.03 0.752 . . . . 0.0 113.03 -178.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.43 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.7 p-80 -76.61 -40.5 49.23 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 119.964 -0.694 . . . . 0.0 112.375 -177.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 26.8 tp -60.45 -27.35 67.45 Favored 'General case' 0 N--CA 1.475 0.822 0 CA-C-O 120.781 0.324 . . . . 0.0 110.827 178.32 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -66.77 -38.4 86.5 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.53 179.65 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -75.38 -30.09 60.06 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.741 -179.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -78.69 -34.88 45.78 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 120.502 0.191 . . . . 0.0 110.984 179.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -68.73 -43.23 76.35 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.721 -179.78 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 9.1 m-80 -65.73 -20.69 66.37 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.783 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.3 t -60.75 -55.21 35.84 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.469 0.176 . . . . 0.0 111.324 -179.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 146.13 68.5 0.01 OUTLIER Glycine 0 CA--C 1.526 0.763 0 N-CA-C 111.384 -0.686 . . . . 0.0 111.384 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.0 ttm180 -123.31 135.96 54.45 Favored 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 110.148 -0.315 . . . . 0.0 110.148 179.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 38.5 mtt -119.99 175.21 6.02 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.315 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 15.6 p -150.91 155.19 35.2 Favored Pre-proline 0 CA--C 1.535 0.37 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.457 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -78.04 -46.09 0.13 Allowed 'Trans proline' 0 N--CA 1.494 1.526 0 C-N-CA 122.341 2.028 . . . . 0.0 112.172 -179.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 10.2 ttp -111.48 146.0 38.03 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.231 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 92.27 36.41 6.27 Favored Glycine 0 CA--C 1.527 0.783 0 N-CA-C 110.686 -0.966 . . . . 0.0 110.686 -179.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.3 p -79.65 114.22 18.41 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 110.494 -0.187 . . . . 0.0 110.494 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -81.54 177.01 9.2 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.598 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.4 t -142.05 170.74 15.14 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.401 179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 109.6 -38.18 3.44 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.818 -0.913 . . . . 0.0 110.818 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.5 m -74.25 -47.39 35.45 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.546 0.212 . . . . 0.0 110.45 179.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -79.4 118.24 21.11 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.621 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.7 t -83.82 150.14 58.35 Favored Pre-proline 0 CA--C 1.535 0.378 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.507 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -83.33 157.45 14.73 Favored 'Trans proline' 0 N--CA 1.492 1.417 0 C-N-CA 122.341 2.027 . . . . 0.0 112.148 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 40.5 p . . . . . 0 C--O 1.219 -0.541 0 CA-C-O 118.017 -0.992 . . . . 0.0 110.603 -179.89 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.303 0 N-CA-C 109.496 -1.442 . . . . 0.0 109.496 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 52.3 p -136.73 -52.96 0.71 Allowed 'General case' 0 C--O 1.233 0.192 0 CA-C-O 120.545 0.212 . . . . 0.0 110.593 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 70.8 mtm -151.41 140.38 21.04 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.559 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -101.35 34.21 2.65 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.704 179.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -92.63 -35.98 13.23 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.743 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -74.5 169.35 17.91 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.452 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 3.3 m -72.62 110.04 6.69 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.565 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -70.86 -37.71 73.1 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.638 -179.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 25.7 tt0 -72.38 127.62 33.11 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.729 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 7.2 p -148.66 109.1 3.56 Favored Pre-proline 0 CA--C 1.539 0.523 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.415 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_exo -59.49 -178.88 0.17 Allowed 'Trans proline' 0 N--CA 1.498 1.763 0 C-N-CA 121.989 1.793 . . . . 0.0 112.11 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.433 ' N ' ' CD ' ' A' ' 13' ' ' PRO . . . 83.0 42.25 8.2 Favored Glycine 0 CA--C 1.542 1.757 0 CA-C-O 119.25 -0.75 . . . . 0.0 112.224 -179.568 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.433 ' CD ' ' N ' ' A' ' 12' ' ' GLY . 18.5 Cg_endo -58.71 -72.16 0.03 OUTLIER 'Trans proline' 0 N--CA 1.5 1.872 0 C-N-CA 122.098 1.865 . . . . 0.0 112.546 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.2 65.35 0.82 Allowed 'General case' 0 CA--C 1.536 0.404 0 CA-C-O 120.667 0.27 . . . . 0.0 110.451 -179.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.438 HD12 ' HA ' ' A' ' 15' ' ' LEU . 5.4 tp -79.56 144.8 33.56 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 120.948 -0.301 . . . . 0.0 110.338 -179.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.3 t -37.21 117.46 0.54 Allowed 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -179.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 49.0 m -58.91 -26.29 64.19 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.412 179.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 19.7 p -83.28 -8.43 59.45 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 179.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 73.59 43.24 37.32 Favored Glycine 0 C--N 1.347 1.14 0 C-N-CA 121.307 -0.473 . . . . 0.0 112.666 178.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.4 p -85.04 -14.32 47.71 Favored 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 117.119 0.46 . . . . 0.0 111.83 179.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 96.7 2.72 59.75 Favored Glycine 0 CA--C 1.538 1.493 0 CA-C-O 119.39 -0.672 . . . . 0.0 113.901 178.341 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -105.91 -171.24 1.87 Allowed 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.304 1.052 . . . . 0.0 110.539 -178.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -96.71 143.73 27.38 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-O 120.873 0.368 . . . . 0.0 111.436 -179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -111.35 161.15 12.87 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 110.199 -1.16 . . . . 0.0 110.199 179.044 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.412 ' HB3' HG23 ' A' ' 28' ' ' THR . 24.7 t30 -107.33 137.33 19.59 Favored Pre-proline 0 CA--C 1.535 0.368 0 N-CA-C 109.901 -0.407 . . . . 0.0 109.901 179.672 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -72.73 -28.05 14.3 Favored 'Trans proline' 0 N--CA 1.491 1.382 0 C-N-CA 121.754 1.636 . . . . 0.0 111.957 179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -71.92 -31.69 66.62 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.234 178.515 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.412 HG23 ' HB3' ' A' ' 25' ' ' ASN . 68.5 p -77.1 -150.81 0.04 OUTLIER 'General case' 0 CA--C 1.542 0.653 0 N-CA-C 107.958 -1.127 . . . . 0.0 107.958 178.21 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -90.53 29.58 1.27 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 118.724 0.693 . . . . 0.0 111.121 179.362 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 73.74 18.22 79.46 Favored Glycine 0 CA--C 1.533 1.187 0 N-CA-C 110.938 -0.865 . . . . 0.0 110.938 -178.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 10.7 mtt -128.84 172.36 11.38 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-N 116.905 0.353 . . . . 0.0 110.398 -179.256 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 57.9 m -60.89 172.26 1.01 Allowed 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.115 -179.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 35.6 m -72.01 -46.32 57.6 Favored 'General case' 0 C--O 1.234 0.244 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 179.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 16.0 t -70.4 -36.72 67.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 CA-C-N 116.097 -0.502 . . . . 0.0 109.89 179.516 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 80.2 m -72.19 -37.24 69.34 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.07 -0.513 . . . . 0.0 110.654 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.447 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 25.8 t80 -58.1 -33.13 68.77 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.736 -179.617 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.9 tttt -77.96 -44.15 27.65 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.037 0.446 . . . . 0.0 110.173 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -56.57 -40.83 75.87 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.844 -178.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.447 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.9 p-80 -85.01 -33.63 22.51 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 120.321 -0.551 . . . . 0.0 112.162 -178.579 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 12.3 tp -60.79 -30.79 70.26 Favored 'General case' 0 N--CA 1.472 0.644 0 O-C-N 122.922 0.139 . . . . 0.0 111.219 179.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -68.64 -35.39 77.21 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.546 -0.297 . . . . 0.0 110.766 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 13.1 mmm-85 -71.68 -29.94 65.15 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.616 -179.477 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 19.0 mt-30 -77.11 -31.06 55.57 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 121.254 -0.178 . . . . 0.0 111.375 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.4 mt-30 -77.24 -48.7 16.85 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.789 0.328 . . . . 0.0 110.483 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 -62.7 -17.49 60.8 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.92 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.6 m -58.95 -60.76 3.35 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 111.616 0.228 . . . . 0.0 111.616 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 139.96 69.27 0.04 OUTLIER Glycine 0 CA--C 1.526 0.781 0 N-CA-C 110.728 -0.949 . . . . 0.0 110.728 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 27.1 ttt180 -58.56 -36.33 73.76 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 111.364 0.135 . . . . 0.0 111.364 -179.702 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 10.9 mtp -82.51 -49.62 9.71 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.179 179.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.1 p -145.41 94.31 5.22 Favored Pre-proline 0 CA--C 1.538 0.487 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.68 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -56.07 -61.98 0.29 Allowed 'Trans proline' 0 N--CA 1.501 1.927 0 C-N-CA 122.212 1.941 . . . . 0.0 112.234 179.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -125.08 -50.48 1.69 Allowed 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.19 179.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 144.3 -37.23 1.41 Allowed Glycine 0 CA--C 1.525 0.718 0 N-CA-C 111.026 -0.83 . . . . 0.0 111.026 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 4.5 t -133.42 148.13 51.77 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-O 120.59 0.233 . . . . 0.0 110.639 179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -145.28 148.66 33.7 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.591 -179.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 13.0 m -150.15 153.14 35.82 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.692 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 120.65 72.62 0.33 Allowed Glycine 0 CA--C 1.526 0.771 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 74.4 m -104.27 34.84 2.91 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 120.849 0.357 . . . . 0.0 110.709 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 15.6 p30 -70.48 147.41 49.43 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.687 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.4 p -86.99 158.31 53.21 Favored Pre-proline 0 CA--C 1.535 0.387 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.623 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_endo -73.51 118.59 5.55 Favored 'Trans proline' 0 N--CA 1.495 1.595 0 C-N-CA 122.221 1.947 . . . . 0.0 112.189 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 59.2 p . . . . . 0 N--CA 1.476 0.827 0 CA-C-O 118.216 -0.897 . . . . 0.0 112.039 179.959 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.241 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.5 m -84.77 165.96 17.37 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.544 0.211 . . . . 0.0 110.884 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 2.8 ptt? -77.09 142.41 39.79 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.605 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -137.39 -63.01 0.6 Allowed 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.376 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 25.3 tt0 -103.11 33.43 3.29 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.762 179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -81.87 -41.94 20.27 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.475 179.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 34.0 p -74.13 105.34 5.3 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.863 -179.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 8.5 p30 -107.1 -39.89 5.59 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.547 -179.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -92.82 161.83 14.35 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.947 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' THR . . . . . 0.56 ' O ' HG23 ' A' ' 10' ' ' THR . 5.0 t -156.19 94.86 2.38 Favored Pre-proline 0 CA--C 1.544 0.726 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.273 179.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -80.65 117.24 3.32 Favored 'Trans proline' 0 N--CA 1.492 1.385 0 C-N-CA 122.216 1.944 . . . . 0.0 112.113 -179.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -175.48 -62.42 0.06 OUTLIER Glycine 0 CA--C 1.535 1.311 0 N-CA-C 111.242 -0.743 . . . . 0.0 111.242 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -80.72 85.38 1.82 Allowed 'Trans proline' 0 N--CA 1.494 1.525 0 C-N-CA 122.373 2.049 . . . . 0.0 111.997 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 6.8 mmt -71.4 81.63 0.77 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.805 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -78.52 146.16 34.49 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 179.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 4.3 t -42.64 117.98 1.13 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.767 1.025 . . . . 0.0 113.767 -178.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.34 -23.68 50.41 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 115.736 -0.665 . . . . 0.0 111.72 179.285 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 46.4 p -81.33 -12.22 59.09 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -179.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.11 43.4 10.8 Favored Glycine 0 C--N 1.344 1.003 0 C-N-CA 121.255 -0.498 . . . . 0.0 112.58 178.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 3.7 p -87.44 -15.56 37.37 Favored 'General case' 0 CA--C 1.552 1.041 0 CA-C-N 117.252 0.526 . . . . 0.0 111.989 179.391 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 92.71 4.35 65.58 Favored Glycine 0 CA--C 1.54 1.623 0 CA-C-O 119.639 -0.534 . . . . 0.0 114.071 178.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 36.7 m-85 -106.12 -169.53 1.59 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 117.944 0.872 . . . . 0.0 110.062 179.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -96.45 141.38 29.81 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.143 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -116.52 171.92 13.99 Favored Glycine 0 CA--C 1.529 0.956 0 N-CA-C 110.554 -1.019 . . . . 0.0 110.554 179.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -122.53 143.12 38.98 Favored Pre-proline 0 CA--C 1.538 0.497 0 CA-C-N 116.82 0.31 . . . . 0.0 111.181 -179.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -77.01 -21.76 11.97 Favored 'Trans proline' 0 N--CA 1.491 1.338 0 C-N-CA 122.122 1.881 . . . . 0.0 113.122 179.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 5.9 mpt_? -73.98 -34.94 64.4 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 109.33 -0.619 . . . . 0.0 109.33 178.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 64.4 p -74.25 -156.69 0.05 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 178.027 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -91.52 25.5 2.62 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 118.379 0.536 . . . . 0.0 111.596 179.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 85.63 13.64 69.68 Favored Glycine 0 CA--C 1.538 1.476 0 N-CA-C 112.041 -0.424 . . . . 0.0 112.041 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.51 165.91 17.62 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-N 117.483 0.642 . . . . 0.0 111.387 -179.25 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 60.7 m -57.34 178.2 0.08 Allowed 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.788 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 13.2 m -71.76 -43.0 66.53 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 16.2 t -73.98 -37.49 47.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.733 178.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' CYS . . . . . . . . . . . . . 71.2 m -72.03 -38.14 69.62 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.715 -179.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.402 ' HA ' ' CE1' ' A' ' 39' ' ' HIS . 18.3 t80 -55.93 -38.68 70.61 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-O 120.625 0.25 . . . . 0.0 111.072 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 64.9 tttt -76.96 -43.9 33.31 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.955 -179.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -55.95 -40.01 72.57 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 115.725 -0.67 . . . . 0.0 112.744 -178.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' HIS . . . . . 0.402 ' CE1' ' HA ' ' A' ' 36' ' ' TYR . 1.7 p-80 -84.02 -32.73 24.75 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 120.087 -0.645 . . . . 0.0 111.414 -179.529 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 15.1 tp -60.21 -26.46 66.4 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 116.747 -0.206 . . . . 0.0 111.392 179.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -69.51 -37.81 77.34 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 120.461 0.172 . . . . 0.0 110.665 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.7 -32.27 60.02 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.7 179.812 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -70.62 -43.09 69.99 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.985 -179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 1.4 tp-100 -57.68 -26.13 61.27 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.755 -179.737 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -61.32 -19.68 62.07 Favored 'General case' 0 CA--C 1.54 0.566 0 O-C-N 123.039 0.212 . . . . 0.0 111.423 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 10.8 t -59.61 -36.65 76.74 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 120.582 0.23 . . . . 0.0 111.169 -179.812 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 104.7 -41.93 2.02 Favored Glycine 0 CA--C 1.524 0.638 0 N-CA-C 111.072 -0.811 . . . . 0.0 111.072 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 10.5 tpt180 -78.34 134.08 37.51 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.537 0.208 . . . . 0.0 110.844 -179.774 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.8 mtt -95.8 164.73 12.62 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.428 179.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 3.7 t -162.28 93.89 1.27 Allowed Pre-proline 0 CA--C 1.539 0.532 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.778 179.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -73.54 -35.77 4.46 Favored 'Trans proline' 0 N--CA 1.497 1.734 0 C-N-CA 122.263 1.976 . . . . 0.0 112.488 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -95.64 -175.4 3.44 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 120.79 0.328 . . . . 0.0 110.257 -179.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 137.64 -53.93 0.72 Allowed Glycine 0 CA--C 1.527 0.794 0 N-CA-C 110.924 -0.87 . . . . 0.0 110.924 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 77.4 p -74.19 134.0 42.75 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 120.476 0.179 . . . . 0.0 110.617 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -69.57 134.75 49.17 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.584 179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.1 t -76.59 112.79 13.51 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.531 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 86.75 52.13 3.23 Favored Glycine 0 CA--C 1.526 0.765 0 N-CA-C 111.01 -0.836 . . . . 0.0 111.01 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 8.1 t -80.33 -43.91 20.41 Favored 'General case' 0 N--CA 1.462 0.137 0 CA-C-O 120.593 0.235 . . . . 0.0 110.516 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -78.23 149.73 33.58 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.745 -179.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.1 t -139.22 90.84 11.54 Favored Pre-proline 0 CA--C 1.539 0.527 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.23 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_exo -58.4 157.43 26.6 Favored 'Trans proline' 0 N--CA 1.498 1.768 0 C-N-CA 122.301 2.001 . . . . 0.0 112.163 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 39.8 p . . . . . 0 C--O 1.22 -0.489 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.465 -179.941 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_