data_1wvk_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 1wvk _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 ' 44' ' ' MET . . . . . . . . . . . . . 65.7 mtt . . . . . 0 N--CA 1.465 0.296 0 CA-C-O 121.854 0.835 . . . . 7.93 109.062 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.8 p -71.95 -87.33 0.02 OUTLIER 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 115.308 1.595 . . . . 4.16 115.308 -176.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.511 ' O ' ' HA ' ' A' ' 54' ' ' THR . 80.6 mt -131.62 124.6 54.5 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.739 0 CA-C-N 116.036 -0.529 . . . . 3.76 110.641 -175.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.727 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 39.7 tt0 -86.49 137.46 32.52 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.149 0.5 . . . . 7.28 110.078 177.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.596 ' SG ' HG23 ' A' ' 50' ' ' VAL . 42.4 t -77.76 130.7 37.06 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 115.015 -0.993 . . . . 5.75 111.17 178.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.54 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -58.51 -27.99 65.0 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-N 113.593 -1.639 . . . . 5.98 111.124 -178.092 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.596 HG23 ' SG ' ' A' ' 48' ' ' CYS . 8.1 m -61.19 -31.29 49.75 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 N-CA-C 112.084 0.402 . . . . 7.94 112.084 -176.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.8 t -161.37 -82.01 0.04 OUTLIER 'General case' 0 N--CA 1.44 -0.96 0 CA-C-O 120.779 0.323 . . . . 9.38 110.863 -179.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 37.6 tpp -164.38 22.1 0.06 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 121.568 0.699 . . . . 9.71 109.267 -175.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.727 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 20.7 mm-40 -84.09 -167.81 1.9 Allowed 'General case' 0 CA--C 1.492 -1.282 0 C-N-CA 120.436 -0.506 . . . . 9.17 109.946 -171.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.511 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 11.3 t -141.46 161.08 38.78 Favored 'General case' 0 N--CA 1.419 -2.002 0 C-N-CA 118.521 -1.271 . . . . 6.39 112.833 -175.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.42 ' CE2' ' HB2' ' A' ' 48' ' ' CYS . 87.3 m-85 -140.04 153.18 46.72 Favored 'General case' 0 N--CA 1.436 -1.15 0 C-N-CA 126.732 2.013 . . . . 5.78 107.55 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 6.9 tp -73.39 136.13 26.11 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.473 0 CA-C-O 121.218 0.532 . . . . 5.53 112.081 -177.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 53.8 t -78.27 74.13 4.81 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-O 121.48 0.657 . . . . 4.52 110.443 176.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.3 m -87.03 -5.71 58.98 Favored 'General case' 0 N--CA 1.428 -1.547 0 N-CA-C 107.77 -1.196 . . . . 6.29 107.77 171.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 92.2 m -148.18 138.7 22.88 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 107.805 -1.183 . . . . 6.33 107.805 178.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.3 p -71.36 -81.38 0.05 Allowed 'General case' 0 CA--C 1.55 0.954 0 O-C-N 123.523 0.514 . . . . 6.87 112.074 -177.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.85 ' HA ' ' SG ' ' A' ' 64' ' ' CYS . 42.8 tt0 178.99 -36.13 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.047 0 C-N-CA 124.873 1.269 . . . . 4.86 108.237 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.455 ' O ' ' HB3' ' A' ' 65' ' ' ARG . 80.8 t -70.49 -37.57 70.66 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 C-N-CA 120.569 -0.452 . . . . 7.56 110.865 175.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.588 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 1.0 OUTLIER -72.81 -26.68 61.59 Favored 'General case' 0 CA--C 1.553 1.079 0 N-CA-C 108.924 -0.769 . . . . 9.7 108.924 178.439 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . 0.85 ' SG ' ' HA ' ' A' ' 61' ' ' GLU . 28.9 p -82.71 -25.26 33.1 Favored 'General case' 0 C--O 1.205 -1.248 0 C-N-CA 118.634 -1.226 . . . . 6.07 110.26 176.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.455 ' HB3' ' O ' ' A' ' 62' ' ' VAL . 68.0 ttt180 -57.62 -47.71 81.45 Favored 'General case' 0 N--CA 1.441 -0.913 0 C-N-CA 123.869 0.867 . . . . 8.11 110.665 174.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -65.74 -35.62 81.25 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.496 0.665 . . . . 9.78 110.069 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -74.06 -24.14 59.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.733 -0.667 . . . . 9.61 111.066 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -74.79 -56.81 4.39 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-N 115.891 -0.595 . . . . 6.53 110.617 -177.007 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -58.52 -34.51 71.05 Favored 'General case' 0 C--N 1.317 -0.813 0 O-C-N 123.751 0.657 . . . . 8.5 111.561 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -77.26 -12.45 59.95 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 115.118 -0.946 . . . . 9.9 112.568 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm -132.58 -84.57 0.48 Allowed 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 112.866 0.691 . . . . 10.62 112.866 -176.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.44 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 25.6 p80 42.49 60.26 9.91 Favored Pre-proline 0 N--CA 1.479 1.015 0 N-CA-C 113.97 1.1 . . . . 8.11 113.97 -175.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.44 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 24.9 Cg_exo -64.7 -60.65 0.13 Allowed 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.143 1.895 . . . . 7.3 111.412 -178.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 23.5 pttm -165.21 20.41 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.183 -0.462 . . . . 7.81 110.701 -179.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.517 ' HA ' ' CG2' ' A' ' 78' ' ' VAL . . . 64.07 -82.3 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.594 -0.73 . . . . 4.52 109.254 -172.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.4 t70 53.78 -88.43 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.538 1.135 . . . . 6.83 113.693 175.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.7 m -73.35 -24.01 20.14 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.05 0 N-CA-C 109.585 -0.524 . . . . 8.44 109.585 177.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.517 ' CG2' ' HA ' ' A' ' 75' ' ' ALA . 19.0 m -104.43 13.96 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.376 0 CA-C-N 115.872 -0.603 . . . . 6.03 110.439 176.498 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.35 -14.58 62.64 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 121.484 0.659 . . . . 4.71 110.153 177.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 82.5 m -76.8 -19.65 57.32 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 114.908 -1.042 . . . . 6.16 110.491 177.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.601 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 34.4 t80 -155.58 83.97 3.55 Favored Pre-proline 0 N--CA 1.447 -0.615 0 N-CA-C 107.353 -1.351 . . . . 6.08 107.353 176.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -63.19 3.44 0.58 Allowed 'Trans proline' 0 C--O 1.197 -1.552 0 C-N-CA 123.676 2.917 . . . . 3.27 115.312 -172.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 66.6 m-70 -72.73 -8.44 55.43 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 119.177 0.899 . . . . 4.77 110.842 174.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 81' ' ' PHE . 11.0 mt . . . . . 0 N--CA 1.416 -2.155 0 N-CA-C 107.15 -1.426 . . . . 5.47 107.15 -178.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 CA--C 1.555 1.142 0 N-CA-C 112.128 0.418 . . . . 7.93 112.128 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.472 ' HB3' ' O ' ' A' ' 55' ' ' PHE . 41.2 t 56.16 -96.78 0.07 Allowed 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.971 1.1 . . . . 4.16 113.971 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.463 HG13 ' OG ' ' A' ' 45' ' ' SER . 14.4 mt -124.67 160.96 28.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 C-N-CA 123.395 0.678 . . . . 3.76 109.989 -176.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.676 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 7.5 tt0 -120.11 131.22 54.97 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 123.227 0.611 . . . . 7.28 109.399 177.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.599 ' SG ' ' HB3' ' A' ' 80' ' ' CYS . 21.3 t -68.83 134.51 49.77 Favored 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 124.238 1.015 . . . . 5.75 111.91 -177.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.453 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -62.68 -29.35 70.58 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.82 1.648 . . . . 5.98 109.806 -177.731 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.593 HG23 ' SG ' ' A' ' 48' ' ' CYS . 11.6 m -62.14 -25.5 37.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.164 -0.471 . . . . 7.94 112.169 -174.243 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.462 ' SG ' ' HG2' ' A' ' 52' ' ' MET . 47.6 t -169.26 -77.2 0.02 OUTLIER 'General case' 0 N--CA 1.438 -1.032 0 O-C-N 123.406 0.442 . . . . 9.38 110.776 179.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.462 ' HG2' ' SG ' ' A' ' 51' ' ' CYS . 19.8 ptm -169.41 32.28 0.02 OUTLIER 'General case' 0 C--O 1.21 -1.025 0 CA-C-N 116.273 -0.421 . . . . 9.71 111.732 -176.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.676 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 17.2 mm-40 -90.82 -166.14 1.51 Allowed 'General case' 0 C--O 1.205 -1.276 0 N-CA-C 108.924 -0.769 . . . . 9.17 108.924 -173.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.8 t -135.99 167.39 21.31 Favored 'General case' 0 C--N 1.289 -2.031 0 C-N-CA 118.442 -1.303 . . . . 6.39 112.277 -175.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.472 ' O ' ' HB3' ' A' ' 45' ' ' SER . 89.5 m-85 -135.17 153.61 51.91 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 106.095 -1.817 . . . . 5.78 106.095 175.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 7.9 tp -83.81 133.67 28.67 Favored 'Isoleucine or valine' 0 C--O 1.251 1.145 0 O-C-N 123.644 0.59 . . . . 5.53 110.929 -177.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 49.0 t -71.6 74.4 0.8 Allowed 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 121.633 0.73 . . . . 4.52 112.217 176.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 18.0 p -82.11 -3.77 55.48 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 109.158 -0.682 . . . . 6.29 109.158 169.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 87.3 m -161.66 149.83 15.22 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.009 -1.478 . . . . 6.33 107.009 178.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.0 t -79.71 139.92 37.16 Favored 'General case' 0 N--CA 1.419 -1.983 0 N-CA-C 106.981 -1.489 . . . . 6.87 106.981 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -53.25 -32.91 50.74 Favored 'General case' 0 C--O 1.206 -1.218 0 O-C-N 123.826 0.704 . . . . 4.86 110.534 -178.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.452 ' O ' ' HB3' ' A' ' 65' ' ' ARG . 67.7 t -62.09 -31.8 52.5 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.096 0 N-CA-C 112.832 0.678 . . . . 7.56 112.832 -177.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.593 ' O ' ' HD2' ' A' ' 63' ' ' LYS . 1.0 OUTLIER -79.85 -35.88 37.56 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 118.171 -1.411 . . . . 9.7 107.338 179.216 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 69.1 m -67.15 -27.88 67.67 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 109.123 -0.695 . . . . 6.07 109.123 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.452 ' HB3' ' O ' ' A' ' 62' ' ' VAL . 72.7 ttt180 -60.61 -54.85 40.38 Favored 'General case' 0 N--CA 1.426 -1.666 0 C-N-CA 124.607 1.163 . . . . 8.11 112.17 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -63.68 -33.84 76.52 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-O 121.079 0.466 . . . . 9.78 110.39 -178.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -70.73 -37.36 73.47 Favored 'General case' 0 N--CA 1.438 -1.031 0 N-CA-C 109.167 -0.679 . . . . 9.61 109.167 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.72 -48.39 54.82 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-N 115.954 -0.567 . . . . 6.53 111.878 -178.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -71.73 -17.98 62.17 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.509 0.559 . . . . 8.5 112.509 -176.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -93.7 -18.17 22.42 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 116.417 -0.356 . . . . 9.9 111.28 176.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -118.27 -81.01 0.62 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.784 0.29 . . . . 10.62 111.784 -178.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.483 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 30.8 p80 44.47 54.21 11.99 Favored Pre-proline 0 N--CA 1.498 1.934 0 N-CA-C 114.449 1.277 . . . . 8.11 114.449 -178.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.483 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 5.3 Cg_exo -75.59 -58.87 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.126 0 C-N-CA 121.686 1.591 . . . . 7.3 113.17 -178.435 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -159.73 104.91 1.59 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.487 0.661 . . . . 7.81 112.066 -175.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.74 113.15 21.7 Favored 'General case' 0 C--N 1.292 -1.896 0 CA-C-N 116.057 -0.52 . . . . 4.52 109.788 175.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -115.12 -76.79 0.57 Allowed 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 111.89 0.33 . . . . 6.83 111.89 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 28.2 m -73.81 -18.94 17.57 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.743 0 CA-C-O 122.368 1.08 . . . . 8.44 108.977 176.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 35.5 m -105.59 15.83 6.71 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.37 0 CA-C-N 114.359 -1.292 . . . . 6.03 109.803 175.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.58 -15.89 59.33 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-O 121.905 0.859 . . . . 4.71 110.018 175.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . 0.599 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 64.4 m -67.59 -16.78 64.36 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 114.285 -1.325 . . . . 6.16 110.49 176.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.485 ' CE2' ' HB2' ' A' ' 83' ' ' HIS . 14.2 t80 -167.85 89.32 0.69 Allowed Pre-proline 0 N--CA 1.444 -0.771 0 N-CA-C 108.052 -1.092 . . . . 6.08 108.052 171.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -63.91 3.91 0.63 Allowed 'Trans proline' 0 N--CA 1.505 2.206 0 C-N-CA 124.087 3.192 . . . . 3.27 114.504 -173.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.485 ' HB2' ' CE2' ' A' ' 81' ' ' PHE . 13.2 m-70 -88.92 -0.67 57.6 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 109.258 -0.645 . . . . 4.77 109.258 177.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 49.0 mt . . . . . 0 C--N 1.344 0.327 0 CA-C-N 116.413 -0.358 . . . . 5.47 111.748 -177.512 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 65.8 mtt . . . . . 0 N--CA 1.484 1.269 0 N-CA-C 112.273 0.471 . . . . 7.93 112.273 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.5 p 51.67 -104.76 0.19 Allowed 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 116.347 1.98 . . . . 4.16 116.347 177.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.422 ' O ' ' HA ' ' A' ' 54' ' ' THR . 59.0 mt -118.35 143.75 28.36 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 N-CA-C 109.657 -0.498 . . . . 3.76 109.657 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.604 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 1.1 tp-100 -112.19 133.82 54.09 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 106.549 -1.648 . . . . 7.28 106.549 178.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.608 ' SG ' HG22 ' A' ' 50' ' ' VAL . 35.7 t -66.28 135.72 54.82 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 124.512 1.125 . . . . 5.75 113.024 -175.545 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.408 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -64.31 -26.59 68.55 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.1 1.36 . . . . 5.98 110.168 -178.266 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.608 HG22 ' SG ' ' A' ' 48' ' ' CYS . 5.4 m -66.52 -33.19 61.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 120.843 0.354 . . . . 7.94 111.797 -175.202 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 83.9 m -156.67 -83.11 0.06 Allowed 'General case' 0 N--CA 1.433 -1.318 0 CA-C-N 115.801 -0.636 . . . . 9.38 110.792 -174.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 52.1 ttp 179.9 47.51 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.768 0 N-CA-C 108.471 -0.937 . . . . 9.71 108.471 -178.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.604 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 21.2 mm-40 -101.56 -178.29 3.68 Favored 'General case' 0 C--O 1.173 -2.927 0 N-CA-C 107.263 -1.384 . . . . 9.17 107.263 -178.259 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.422 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 9.5 t -125.7 154.12 42.89 Favored 'General case' 0 C--N 1.286 -2.16 0 C-N-CA 117.53 -1.668 . . . . 6.39 113.574 -175.19 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.44 ' HE2' ' SG ' ' A' ' 48' ' ' CYS . 86.7 m-85 -137.59 147.9 45.43 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 113.867 -1.515 . . . . 5.78 107.634 177.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.431 HG13 ' H ' ' A' ' 58' ' ' THR . 9.2 tp -73.7 132.18 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 N-CA-C 109.402 -0.592 . . . . 5.53 109.402 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.426 ' C ' ' H ' ' A' ' 59' ' ' THR . 24.9 p -74.43 -18.98 60.57 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.03 0.381 . . . . 4.52 112.03 -176.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.431 ' H ' HG13 ' A' ' 56' ' ' ILE 0.25 13.6 t 54.34 -4.89 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 127.26 2.224 . . . . 6.29 115.152 177.739 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.426 ' H ' ' C ' ' A' ' 57' ' ' CYS . 87.0 m -155.93 -83.9 0.06 Allowed 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 109.319 -0.623 . . . . 6.33 109.319 178.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 18.0 p -161.2 10.36 0.09 Allowed 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 112.242 0.46 . . . . 6.87 112.242 -178.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.56 ' O ' ' HG3' ' A' ' 65' ' ' ARG . 26.7 tt0 68.51 -52.04 0.56 Allowed 'General case' 0 C--O 1.183 -2.416 0 C-N-CA 124.523 1.129 . . . . 4.86 110.806 -177.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.535 HG12 ' CZ ' ' A' ' 65' ' ' ARG . 35.7 m -55.37 -39.18 51.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 O-C-N 121.354 -0.841 . . . . 7.56 112.77 -178.322 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -60.46 -42.28 95.87 Favored 'General case' 0 C--N 1.306 -1.3 0 CA-C-N 115.357 -0.838 . . . . 9.7 109.496 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . 0.485 ' HG ' HD22 ' A' ' 84' ' ' LEU . 28.5 p -78.19 -31.81 49.71 Favored 'General case' 0 N--CA 1.428 -1.544 0 C-N-CA 119.85 -0.74 . . . . 6.07 109.621 178.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.56 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 22.3 mtm180 -59.68 -50.26 74.56 Favored 'General case' 0 CA--C 1.5 -0.966 0 N-CA-C 111.921 0.341 . . . . 8.11 111.921 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -66.73 -33.79 76.41 Favored 'General case' 0 C--O 1.236 0.366 0 O-C-N 123.741 0.65 . . . . 9.78 111.931 -178.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -74.39 -30.25 61.87 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 119.696 -0.802 . . . . 9.61 109.463 177.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.527 ' CB ' ' HA ' ' A' ' 83' ' ' HIS . . . -71.14 -46.86 60.7 Favored 'General case' 0 C--O 1.204 -1.333 0 CA-C-N 116.559 -0.291 . . . . 6.53 111.543 179.664 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 10.7 pt-20 -71.65 -11.6 60.92 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.417 0.627 . . . . 8.5 111.432 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.05 -32.06 59.13 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.009 -0.996 . . . . 9.9 109.798 173.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -120.65 -86.48 0.65 Allowed 'General case' 0 C--O 1.216 -0.698 0 CA-C-N 115.763 -0.653 . . . . 10.62 111.191 -177.184 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.483 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 20.4 t-80 45.49 55.58 14.74 Favored Pre-proline 0 CA--C 1.561 1.403 0 C-N-CA 123.85 0.86 . . . . 8.11 112.014 -178.859 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.483 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 34.6 Cg_exo -65.23 -44.93 8.33 Favored 'Trans proline' 0 C--N 1.37 1.661 0 C-N-CA 121.881 1.721 . . . . 7.3 110.341 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -170.03 106.14 0.33 Allowed 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 114.141 -1.391 . . . . 7.81 108.85 177.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.16 112.77 4.64 Favored 'General case' 0 C--N 1.302 -1.476 0 C-N-CA 119.427 -0.909 . . . . 4.52 109.153 171.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -86.94 -90.75 0.11 Allowed 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 122.003 0.906 . . . . 6.83 110.709 -174.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 28.2 m -89.49 -14.96 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.219 0 N-CA-C 108.546 -0.909 . . . . 8.44 108.546 177.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 24.4 m -87.03 7.44 2.54 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.833 0 CA-C-N 115.019 -0.991 . . . . 6.03 109.047 177.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.33 -2.77 3.38 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-N 115.185 -0.916 . . . . 4.71 112.003 178.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 25.3 p -73.51 -23.22 60.0 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 115.366 -0.833 . . . . 6.16 109.213 174.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.505 ' CE2' ' HB2' ' A' ' 83' ' ' HIS . 31.8 t80 -160.36 88.67 1.81 Allowed Pre-proline 0 N--CA 1.428 -1.528 0 N-CA-C 106.456 -1.683 . . . . 6.08 106.456 170.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -60.01 6.73 0.1 OUTLIER 'Trans proline' 0 N--CA 1.509 2.395 0 C-N-CA 124.435 3.423 . . . . 3.27 115.527 -173.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.527 ' HA ' ' CB ' ' A' ' 68' ' ' ALA . 83.2 m-70 -98.87 5.58 47.28 Favored 'General case' 0 C--N 1.286 -2.163 0 N-CA-C 110.075 -0.343 . . . . 4.77 110.075 177.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.485 HD22 ' HG ' ' A' ' 64' ' ' CYS . 74.9 mt . . . . . 0 N--CA 1.43 -1.471 0 N-CA-C 111.982 0.364 . . . . 5.47 111.982 -179.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 68.6 mtm . . . . . 0 N--CA 1.496 1.866 0 N-CA-C 113.21 0.819 . . . . 7.93 113.21 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 67.1 m 52.0 -92.18 0.03 OUTLIER 'General case' 0 CA--C 1.561 1.387 0 N-CA-C 115.594 1.701 . . . . 4.16 115.594 176.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.507 ' O ' ' HA ' ' A' ' 54' ' ' THR . 66.2 mt -131.86 133.88 60.63 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.209 0 N-CA-C 108.894 -0.78 . . . . 3.76 108.894 -177.305 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.672 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 35.3 tt0 -100.81 138.83 37.34 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 120.918 0.39 . . . . 7.28 110.217 -179.027 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.599 ' SG ' HG11 ' A' ' 50' ' ' VAL . 44.8 t -77.86 143.96 37.37 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.709 -0.678 . . . . 5.75 111.152 178.237 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.414 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -57.06 -39.07 74.19 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 126.06 1.744 . . . . 5.98 112.579 -174.37 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.607 HG23 ' SG ' ' A' ' 51' ' ' CYS . 2.1 p -49.0 -51.37 12.78 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 114.74 1.385 . . . . 7.94 114.74 -176.272 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.607 ' SG ' HG23 ' A' ' 50' ' ' VAL . 93.4 m -153.96 -67.73 0.14 Allowed 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 121.093 -0.243 . . . . 9.38 111.302 -173.104 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.434 ' HG3' ' NE2' ' A' ' 47' ' ' GLN . 39.1 ttp -174.86 35.4 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 120.109 -0.636 . . . . 9.71 109.653 -175.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.672 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 13.4 mm-40 -87.47 179.25 6.6 Favored 'General case' 0 CA--C 1.494 -1.199 0 C-N-CA 119.265 -0.974 . . . . 9.17 108.665 -174.371 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.507 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 7.5 t -137.99 154.31 49.35 Favored 'General case' 0 C--N 1.299 -1.597 0 C-N-CA 118.541 -1.264 . . . . 6.39 113.946 -175.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -132.94 151.55 52.04 Favored 'General case' 0 N--CA 1.409 -2.497 0 N-CA-C 105.877 -1.897 . . . . 5.78 105.877 175.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 10.8 tp -75.57 146.32 9.42 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.563 0 N-CA-C 109.459 -0.571 . . . . 5.53 109.459 -177.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 45.1 t -76.95 72.68 3.53 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 121.883 0.849 . . . . 4.52 110.941 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 8.9 t -84.94 -3.2 58.64 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.103 -0.953 . . . . 6.29 110.097 174.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 95.0 m -160.29 140.28 11.36 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 106.721 -1.585 . . . . 6.33 106.721 177.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 35.7 p -75.65 139.32 41.93 Favored 'General case' 0 N--CA 1.42 -1.946 0 N-CA-C 109.396 -0.594 . . . . 6.87 109.396 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.72 ' HA ' ' SG ' ' A' ' 64' ' ' CYS . 14.4 pt-20 -52.53 -35.02 52.56 Favored 'General case' 0 C--O 1.206 -1.184 0 C-N-CA 123.543 0.737 . . . . 4.86 111.824 178.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.418 ' O ' ' HB3' ' A' ' 65' ' ' ARG . 99.4 t -67.16 -38.97 82.12 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.844 0 C-N-CA 123.155 0.582 . . . . 7.56 112.494 178.001 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -73.01 -35.93 66.9 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 121.476 0.655 . . . . 9.7 109.683 -178.111 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . 0.72 ' SG ' ' HA ' ' A' ' 61' ' ' GLU . 1.8 p -74.52 -27.34 60.5 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 115.656 -0.702 . . . . 6.07 111.044 174.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.444 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 54.8 ttt180 -59.68 -52.65 64.58 Favored 'General case' 0 N--CA 1.439 -1.018 0 C-N-CA 123.627 0.771 . . . . 8.11 112.251 178.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -68.98 -30.24 68.61 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.37 -0.532 . . . . 9.78 110.99 -179.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 61.3 t60 -66.96 -37.96 85.22 Favored 'General case' 0 C--O 1.241 0.644 0 CA-C-N 116.158 -0.474 . . . . 9.61 109.805 176.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.25 -42.16 72.55 Favored 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 115.966 -0.561 . . . . 6.53 110.379 178.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 6.0 mm-40 -63.63 -17.95 63.43 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.157 0.503 . . . . 8.5 111.698 -179.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -84.46 -11.3 56.43 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.994 -0.548 . . . . 9.9 111.06 176.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -142.52 -84.83 0.17 Allowed 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.611 0.597 . . . . 10.62 112.611 -177.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.462 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 34.9 p80 41.76 47.81 2.65 Favored Pre-proline 0 N--CA 1.502 2.158 0 C-N-CA 125.357 1.463 . . . . 8.11 114.036 -176.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.462 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 1.3 Cg_endo -73.75 -41.75 1.01 Allowed 'Trans proline' 0 N--CA 1.444 -1.414 0 C-N-CA 121.015 1.143 . . . . 7.3 112.374 -175.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.502 ' HB2' ' HZ2' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -160.53 116.16 2.29 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.48 -0.933 . . . . 7.81 108.48 -179.324 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.497 ' O ' HG21 ' A' ' 78' ' ' VAL . . . -73.05 -51.58 17.58 Favored 'General case' 0 C--N 1.286 -2.187 0 C-N-CA 118.738 -1.185 . . . . 4.52 108.654 173.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.442 ' OD1' HG12 ' A' ' 77' ' ' VAL . 11.3 t70 61.0 -86.5 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 124.111 0.965 . . . . 6.83 113.037 170.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . 0.442 HG12 ' OD1' ' A' ' 76' ' ' ASP . 35.6 m -92.63 -19.32 6.88 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.742 0 CA-C-O 121.166 0.508 . . . . 8.44 109.884 178.247 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.511 ' HB ' ' CE1' ' A' ' 81' ' ' PHE . 21.1 m -102.34 18.39 3.84 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.504 0 N-CA-C 107.973 -1.121 . . . . 6.03 107.973 174.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.48 -11.97 39.15 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-O 121.803 0.811 . . . . 4.71 111.496 178.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . 0.533 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 89.2 m -75.4 -15.56 60.44 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-N 115.135 -0.939 . . . . 6.16 110.025 174.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.576 ' CD1' HD13 ' A' ' 84' ' ' LEU . 11.9 p90 -154.45 69.86 6.03 Favored Pre-proline 0 CA--C 1.563 1.47 0 C-N-CA 124.64 1.176 . . . . 6.08 111.401 178.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -64.22 -17.46 59.8 Favored 'Trans proline' 0 N--CA 1.5 1.854 0 C-N-CA 123.814 3.009 . . . . 3.27 115.375 -172.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -81.48 4.47 21.04 Favored 'General case' 0 C--N 1.31 -1.143 0 C-N-CA 120.549 -0.46 . . . . 4.77 111.601 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.576 HD13 ' CD1' ' A' ' 81' ' ' PHE . 17.0 mt . . . . . 0 N--CA 1.443 -0.779 0 C-N-CA 120.391 -0.524 . . . . 5.47 110.687 -177.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.517 ' O ' HG22 ' A' ' 54' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.207 -1.159 0 N-CA-C 111.742 0.275 . . . . 7.93 111.742 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 54.7 m 60.84 -80.11 0.02 OUTLIER 'General case' 0 CA--C 1.563 1.479 0 N-CA-C 114.618 1.34 . . . . 4.16 114.618 178.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 57.2 mt -139.86 144.81 27.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 N-CA-C 109.053 -0.721 . . . . 3.76 109.053 -178.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.628 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 1.1 tp-100 -109.36 136.78 48.23 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-O 121.015 0.436 . . . . 7.28 110.592 -178.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.549 ' SG ' HG22 ' A' ' 50' ' ' VAL . 38.1 t -74.28 145.05 44.31 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 124.803 1.241 . . . . 5.75 113.483 -175.504 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.6 ttpt -63.86 -34.97 79.13 Favored 'General case' 0 C--O 1.216 -0.689 0 C-N-CA 125.796 1.639 . . . . 5.98 111.332 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.549 HG22 ' SG ' ' A' ' 48' ' ' CYS . 8.5 m -61.04 -25.05 34.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 N-CA-C 113.286 0.847 . . . . 7.94 113.286 -171.3 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.5 t -170.07 -76.25 0.02 OUTLIER 'General case' 0 N--CA 1.436 -1.149 0 N-CA-C 108.825 -0.805 . . . . 9.38 108.825 -178.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.414 ' C ' HE21 ' A' ' 53' ' ' GLN . 27.5 ttt -179.89 60.86 0.01 OUTLIER 'General case' 0 C--O 1.208 -1.11 0 N-CA-C 107.303 -1.369 . . . . 9.71 107.303 179.141 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.628 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 23.3 mm-40 -106.43 -174.24 2.49 Favored 'General case' 0 C--O 1.195 -1.809 0 N-CA-C 109.475 -0.565 . . . . 9.17 109.475 -176.009 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.517 HG22 ' O ' ' A' ' 44' ' ' MET . 97.4 m -120.57 142.89 48.95 Favored 'General case' 0 C--N 1.273 -2.718 0 N-CA-C 114.255 1.206 . . . . 6.39 114.255 -170.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.409 ' HE2' ' SG ' ' A' ' 48' ' ' CYS . 79.9 m-85 -130.41 172.75 11.53 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 125.698 1.599 . . . . 5.78 108.435 175.212 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.1 tp -100.21 137.36 27.97 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 CA-C-O 121.035 0.445 . . . . 5.53 112.114 -175.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 25.8 p -89.01 77.48 7.65 Favored 'General case' 0 N--CA 1.418 -2.031 0 CA-C-O 121.571 0.7 . . . . 4.52 110.258 176.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 8.2 m -67.47 -9.44 42.06 Favored 'General case' 0 CA--C 1.576 1.968 0 CA-C-O 122.29 1.043 . . . . 6.29 110.189 174.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.426 ' C ' ' H ' ' A' ' 61' ' ' GLU . 33.2 m -149.75 173.76 13.35 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 104.681 -2.34 . . . . 6.33 104.681 178.082 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.5 m -75.75 20.42 0.18 Allowed 'General case' 0 CA--C 1.552 1.051 0 CA-C-N 119.533 1.06 . . . . 6.87 112.517 -174.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.426 ' H ' ' C ' ' A' ' 59' ' ' THR . 29.7 tt0 65.23 -52.22 0.35 Allowed 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 126.929 2.092 . . . . 4.86 111.542 -178.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.577 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 28.3 m -55.47 -41.93 65.44 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.411 0 N-CA-C 113.388 0.884 . . . . 7.56 113.388 -177.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.457 ' HA ' ' OE1' ' A' ' 66' ' ' GLU . 0.6 OUTLIER -59.9 -35.26 74.49 Favored 'General case' 0 CA--C 1.55 0.953 0 CA-C-O 122.037 0.922 . . . . 9.7 109.466 178.34 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 55.7 m -73.7 -36.26 65.23 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 108.45 -0.944 . . . . 6.07 108.45 179.123 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -59.3 -42.76 92.08 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 115.615 -0.72 . . . . 8.11 110.93 178.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.577 ' HG3' ' O ' ' A' ' 62' ' ' VAL . 25.3 mt-10 -59.14 -45.46 90.89 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 124.35 1.031 . . . . 9.78 109.894 -177.29 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -75.65 -24.59 56.4 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.281 -0.872 . . . . 9.61 109.721 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.97 -43.86 33.39 Favored 'General case' 0 C--O 1.206 -1.189 0 CA-C-N 116.179 -0.464 . . . . 6.53 111.485 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.93 -18.83 64.15 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.098 0.475 . . . . 8.5 110.186 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.09 -29.5 67.6 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.16 -0.927 . . . . 9.9 110.733 175.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -128.16 -76.13 0.56 Allowed 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 112.327 0.491 . . . . 10.62 112.327 -175.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.417 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 13.4 p80 39.13 60.62 5.63 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 125.148 1.379 . . . . 8.11 113.695 -175.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.417 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 51.1 Cg_exo -59.58 -51.43 6.19 Favored 'Trans proline' 0 C--N 1.358 1.057 0 C-N-CA 122.36 2.04 . . . . 7.3 112.483 -178.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.28 -32.03 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 113.619 0.97 . . . . 7.81 113.619 177.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 71.45 116.53 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.74 0.816 . . . . 4.52 109.956 -176.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -104.21 -80.87 0.53 Allowed 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.062 0.458 . . . . 6.83 111.129 -174.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.8 m -81.53 -18.06 11.64 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 121.657 0.741 . . . . 8.44 109.174 176.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 35.3 m -97.0 12.03 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.305 0 CA-C-N 115.003 -0.999 . . . . 6.03 109.514 176.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.99 -12.89 9.02 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-O 121.41 0.624 . . . . 4.71 111.996 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . 0.475 ' HB3' ' HG ' ' A' ' 48' ' ' CYS . 71.2 m -84.16 -8.64 59.02 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 115.42 -0.809 . . . . 6.16 111.384 178.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.428 ' CE2' ' HB2' ' A' ' 83' ' ' HIS . 19.9 t80 -168.12 84.1 0.75 Allowed Pre-proline 0 N--CA 1.434 -1.269 0 N-CA-C 108.158 -1.053 . . . . 6.08 108.158 168.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -62.14 5.97 0.2 Allowed 'Trans proline' 0 N--CA 1.508 2.371 0 C-N-CA 124.57 3.513 . . . . 3.27 115.199 -174.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.428 ' HB2' ' CE2' ' A' ' 81' ' ' PHE . 90.3 m-70 -92.81 3.34 55.84 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 109.803 -0.443 . . . . 4.77 109.803 177.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 45.7 mt . . . . . 0 C--N 1.32 -0.716 0 CA-C-N 115.96 -0.564 . . . . 5.47 110.641 179.85 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 68.1 mtm . . . . . 0 N--CA 1.486 1.357 0 N-CA-C 112.002 0.371 . . . . 7.93 112.002 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.7 p 48.25 -101.1 0.07 Allowed 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 115.666 1.728 . . . . 4.16 115.666 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.488 ' O ' ' HA ' ' A' ' 54' ' ' THR . 62.0 mt -122.83 136.64 58.98 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.059 0 N-CA-C 109.006 -0.738 . . . . 3.76 109.006 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.649 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 7.3 tt0 -102.89 141.84 35.02 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.779 0.324 . . . . 7.28 110.618 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.517 ' SG ' HG11 ' A' ' 50' ' ' VAL . 48.7 t -80.0 144.68 33.04 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.985 -0.552 . . . . 5.75 110.911 177.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.412 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 1.8 tmmm? -59.92 -44.67 94.18 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 125.061 1.344 . . . . 5.98 112.299 -174.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.517 HG11 ' SG ' ' A' ' 48' ' ' CYS . 7.5 p -46.95 -37.86 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 N-CA-C 114.885 1.439 . . . . 7.94 114.885 -171.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 50.1 t -159.96 -67.26 0.07 Allowed 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.388 -0.525 . . . . 9.38 110.072 -179.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.418 ' C ' HE21 ' A' ' 53' ' ' GLN . 27.5 ttt 178.21 60.24 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.417 0 O-C-N 123.758 0.662 . . . . 9.71 109.904 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.649 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 19.1 mm-40 -103.55 -170.78 1.83 Allowed 'General case' 0 C--O 1.203 -1.384 0 N-CA-C 107.478 -1.304 . . . . 9.17 107.478 -177.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.488 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 9.0 t -141.94 157.97 44.33 Favored 'General case' 0 N--CA 1.42 -1.952 0 C-N-CA 118.333 -1.347 . . . . 6.39 113.013 -178.205 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -140.39 139.98 35.41 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 106.026 -1.842 . . . . 5.78 106.026 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 7.1 tp -63.49 140.62 19.35 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 O-C-N 123.413 0.445 . . . . 5.53 111.623 -178.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 12.6 p -75.08 72.13 2.18 Favored 'General case' 0 N--CA 1.426 -1.638 0 CA-C-O 121.747 0.784 . . . . 4.52 112.71 178.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 24.5 p -82.46 -4.47 57.51 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.312 -0.858 . . . . 6.29 109.872 171.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.54 HG22 ' SG ' ' A' ' 64' ' ' CYS . 25.1 m -143.31 161.0 39.48 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 106.586 -1.635 . . . . 6.33 106.586 176.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.5 m -87.27 17.22 4.51 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 112.219 0.452 . . . . 6.87 112.219 -174.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.491 ' CD ' ' HE ' ' A' ' 65' ' ' ARG . 5.4 tp10 67.58 -64.85 0.26 Allowed 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 112.225 0.454 . . . . 4.86 112.225 179.229 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 5.4 p -63.9 -25.86 39.19 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 C-N-CA 123.014 0.526 . . . . 7.56 111.016 -175.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -62.28 -41.59 98.62 Favored 'General case' 0 C--O 1.25 1.104 0 N-CA-C 108.106 -1.072 . . . . 9.7 108.106 177.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . 0.54 ' SG ' HG22 ' A' ' 59' ' ' THR . 63.9 m -77.48 -29.42 52.65 Favored 'General case' 0 N--CA 1.424 -1.741 0 CA-C-N 115.058 -0.974 . . . . 6.07 108.904 176.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.491 ' HE ' ' CD ' ' A' ' 61' ' ' GLU . 97.1 mtt180 -57.78 -47.18 83.29 Favored 'General case' 0 CA--C 1.5 -0.957 0 N-CA-C 113.114 0.783 . . . . 8.11 113.114 179.047 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -65.35 -40.69 93.94 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 119.95 -0.7 . . . . 9.78 110.49 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . 0.426 ' O ' ' HB3' ' A' ' 70' ' ' ALA . 3.7 t-160 -75.91 -26.95 57.44 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 115.937 -0.574 . . . . 9.61 110.725 -175.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.562 ' O ' ' HB2' ' A' ' 72' ' ' HIS . . . -77.62 -49.85 13.74 Favored 'General case' 0 C--O 1.186 -2.255 0 N-CA-C 109.935 -0.395 . . . . 6.53 109.935 178.804 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -67.81 -8.45 36.08 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.39 0.614 . . . . 8.5 111.049 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 67' ' ' HIS . . . -73.12 -31.37 64.26 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 115.047 -0.979 . . . . 9.9 109.446 173.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -131.39 -79.07 0.52 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.793 -0.64 . . . . 10.62 110.113 -176.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.562 ' HB2' ' O ' ' A' ' 68' ' ' ALA . 5.8 t-160 47.07 48.43 5.71 Favored Pre-proline 0 CA--C 1.566 1.587 0 C-N-CA 124.809 1.244 . . . . 8.11 111.643 176.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.434 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 45.7 Cg_exo -56.61 -51.09 9.89 Favored 'Trans proline' 0 C--N 1.387 2.556 0 C-N-CA 121.903 1.735 . . . . 7.3 111.789 -174.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -163.69 106.86 0.98 Allowed 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.68 -0.691 . . . . 7.81 109.727 178.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.27 111.35 2.57 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 120.039 -0.665 . . . . 4.52 109.338 173.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -107.01 -87.62 0.47 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 114.871 -1.058 . . . . 6.83 110.858 -170.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 30.3 m -82.16 -1.69 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-O 122.468 1.127 . . . . 8.44 108.973 174.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 32.7 m -110.01 10.05 8.83 Favored 'Isoleucine or valine' 0 C--O 1.183 -2.403 0 CA-C-N 113.286 -1.779 . . . . 6.03 108.517 176.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.57 -21.38 62.54 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-O 121.598 0.714 . . . . 4.71 112.156 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . 0.451 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 72.3 m -76.37 -15.92 59.85 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.557 -0.747 . . . . 6.16 110.876 176.74 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.64 ' CD1' HD12 ' A' ' 84' ' ' LEU . 4.4 p90 -153.61 71.49 6.7 Favored Pre-proline 0 CA--C 1.555 1.164 0 C-N-CA 124.728 1.211 . . . . 6.08 111.119 -179.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -64.63 -1.56 4.17 Favored 'Trans proline' 0 C--N 1.364 1.371 0 C-N-CA 123.944 3.096 . . . . 3.27 116.239 -172.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -91.86 -0.49 57.51 Favored 'General case' 0 C--N 1.297 -1.688 0 C-N-CA 119.502 -0.879 . . . . 4.77 109.891 177.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.64 HD12 ' CD1' ' A' ' 81' ' ' PHE . 20.0 mt . . . . . 0 N--CA 1.425 -1.676 0 C-N-CA 121.011 -0.276 . . . . 5.47 111.347 -175.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 26.1 mmt . . . . . 0 N--CA 1.487 1.401 0 N-CA-C 111.889 0.329 . . . . 7.93 111.889 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.7 p 46.69 -98.55 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.157 0 N-CA-C 116.485 2.032 . . . . 4.16 116.485 176.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.446 ' O ' ' HA ' ' A' ' 54' ' ' THR . 66.5 mt -119.99 149.87 22.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.024 0 N-CA-C 108.294 -1.002 . . . . 3.76 108.294 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.651 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 0.0 OUTLIER -119.22 141.33 49.0 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 108.841 -0.8 . . . . 7.28 108.841 -177.407 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.614 ' SG ' HG12 ' A' ' 50' ' ' VAL . 22.6 t -78.99 147.65 32.83 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 112.217 0.451 . . . . 5.75 112.217 -177.2 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 2.5 tmmm? -64.29 -46.37 83.94 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.827 1.251 . . . . 5.98 110.978 -177.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.614 HG12 ' SG ' ' A' ' 48' ' ' CYS . 8.5 p -51.19 -32.55 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 N-CA-C 113.962 1.097 . . . . 7.94 113.962 -173.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 41.9 t -159.01 -74.06 0.08 Allowed 'General case' 0 C--N 1.3 -1.583 0 C-N-CA 120.79 -0.364 . . . . 9.38 110.044 -177.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 35.2 ttp 176.38 40.64 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 108.967 -0.753 . . . . 9.71 108.967 -176.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.651 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 13.9 mm-40 -89.69 -176.22 4.91 Favored 'General case' 0 C--O 1.193 -1.894 0 N-CA-C 107.72 -1.215 . . . . 9.17 107.72 -174.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.446 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 5.2 t -133.17 152.19 51.95 Favored 'General case' 0 C--N 1.286 -2.185 0 C-N-CA 117.73 -1.588 . . . . 6.39 113.506 -175.076 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -135.18 156.55 48.8 Favored 'General case' 0 N--CA 1.427 -1.613 0 N-CA-C 106.489 -1.671 . . . . 5.78 106.489 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.2 tp -70.83 138.34 22.03 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.657 0 O-C-N 123.713 0.633 . . . . 5.53 111.88 -176.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 19.0 p -86.36 74.15 10.02 Favored 'General case' 0 N--CA 1.418 -2.064 0 CA-C-O 121.588 0.709 . . . . 4.52 111.132 178.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.1 p -70.78 -16.01 62.71 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.356 -0.838 . . . . 6.29 109.931 173.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 60.7 m -155.14 153.18 30.41 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 106.299 -1.741 . . . . 6.33 106.299 176.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.9 m -77.4 138.27 39.19 Favored 'General case' 0 N--CA 1.418 -2.03 0 N-CA-C 106.459 -1.682 . . . . 6.87 106.459 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -52.17 -39.31 59.86 Favored 'General case' 0 C--O 1.185 -2.291 0 C-N-CA 120.749 -0.381 . . . . 4.86 110.402 -179.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.497 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 17.2 m -53.38 -41.42 44.33 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.205 0 N-CA-C 114.403 1.26 . . . . 7.56 114.403 -178.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -72.37 -33.08 66.98 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 122.137 0.97 . . . . 9.7 108.851 -179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 60.0 m -73.48 -31.34 63.7 Favored 'General case' 0 C--N 1.31 -1.135 0 N-CA-C 108.39 -0.967 . . . . 6.07 108.39 178.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.439 ' HB3' ' O ' ' A' ' 62' ' ' VAL . 27.1 ttm180 -64.86 -42.85 94.53 Favored 'General case' 0 N--CA 1.426 -1.65 0 C-N-CA 125.472 1.509 . . . . 8.11 110.967 177.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.497 ' HG3' ' O ' ' A' ' 62' ' ' VAL . 27.9 mt-10 -55.43 -47.92 75.24 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 122.372 1.082 . . . . 9.78 108.44 178.645 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -75.59 -16.82 60.19 Favored 'General case' 0 C--N 1.293 -1.87 0 CA-C-N 113.768 -1.56 . . . . 9.61 110.943 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.596 ' HA ' ' CD2' ' A' ' 72' ' ' HIS . . . -88.56 -41.46 12.68 Favored 'General case' 0 CA--C 1.489 -1.386 0 N-CA-C 112.423 0.527 . . . . 6.53 112.423 -177.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 33.0 mm-40 -68.2 -25.06 65.04 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 107.854 -1.165 . . . . 8.5 107.854 178.405 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.482 ' O ' ' HD3' ' A' ' 71' ' ' LYS . . . -75.8 -31.24 59.35 Favored 'General case' 0 C--O 1.245 0.854 0 CA-C-N 114.783 -1.099 . . . . 9.9 111.192 176.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.482 ' HD3' ' O ' ' A' ' 70' ' ' ALA . 73.4 mmtt -135.43 -111.08 0.21 Allowed 'General case' 0 C--N 1.355 0.842 0 N-CA-C 109.682 -0.488 . . . . 10.62 109.682 -177.239 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.596 ' CD2' ' HA ' ' A' ' 68' ' ' ALA . 9.7 m170 29.23 51.62 0.4 Allowed Pre-proline 0 N--CA 1.501 2.086 0 N-CA-C 115.758 1.762 . . . . 8.11 115.758 178.336 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.566 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 1.0 OUTLIER -79.85 -3.35 12.75 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.375 2.05 . . . . 7.3 113.838 -175.069 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.413 ' HE3' ' HB2' ' A' ' 74' ' ' LYS . 18.4 ptmt -161.45 109.3 1.47 Allowed 'General case' 0 C--O 1.199 -1.597 0 N-CA-C 111.987 0.365 . . . . 7.81 111.987 -177.198 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -97.62 122.04 40.24 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.221 -1.029 . . . . 4.52 108.221 174.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -98.95 -90.65 0.29 Allowed 'General case' 0 C--O 1.211 -0.942 0 CA-C-N 115.815 -0.629 . . . . 6.83 110.818 -173.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 32.7 m -82.44 -11.95 12.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 CA-C-O 122.284 1.04 . . . . 8.44 109.044 176.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 35.8 m -99.19 13.57 5.0 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 CA-C-N 113.881 -1.509 . . . . 6.03 108.707 177.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.85 -15.2 53.64 Favored 'General case' 0 C--O 1.251 1.132 0 CA-C-O 121.622 0.725 . . . . 4.71 111.539 178.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . 0.402 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 73.6 m -75.56 -15.81 60.33 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-N 115.295 -0.866 . . . . 6.16 110.701 175.165 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.511 ' CD1' HD12 ' A' ' 84' ' ' LEU . 16.4 p90 -154.1 70.6 6.34 Favored Pre-proline 0 CA--C 1.561 1.382 0 C-N-CA 124.454 1.102 . . . . 6.08 111.527 179.068 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -57.38 -22.96 52.6 Favored 'Trans proline' 0 N--CA 1.495 1.589 0 C-N-CA 123.481 2.787 . . . . 3.27 114.478 -173.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -73.71 -1.38 18.86 Favored 'General case' 0 C--N 1.309 -1.181 0 C-N-CA 120.161 -0.615 . . . . 4.77 111.825 -178.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.511 HD12 ' CD1' ' A' ' 81' ' ' PHE . 19.3 mt . . . . . 0 C--O 1.208 -1.11 0 CA-C-N 118.162 0.437 . . . . 5.47 111.011 -177.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.473 0.696 0 CA-C-O 121.55 0.691 . . . . 7.93 110.795 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.47 ' OG ' HG13 ' A' ' 46' ' ' ILE . 22.7 t -60.0 -81.86 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 114.889 -1.05 . . . . 4.16 113.767 -178.263 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.47 HG13 ' OG ' ' A' ' 45' ' ' SER . 13.2 mt -129.41 159.34 41.55 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 CA-C-N 115.968 -0.56 . . . . 3.76 110.056 -172.368 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.631 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 34.9 tt0 -108.98 135.03 50.83 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.914 0.885 . . . . 7.28 109.196 178.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.653 ' SG ' HG13 ' A' ' 50' ' ' VAL . 47.6 t -77.55 144.81 37.31 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.516 -0.765 . . . . 5.75 111.06 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.48 ' HD3' ' O ' ' A' ' 79' ' ' ALA . 14.7 ttpt -59.13 -47.07 86.63 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 124.897 1.279 . . . . 5.98 112.426 -175.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.653 HG13 ' SG ' ' A' ' 48' ' ' CYS . 7.1 p -49.48 -32.84 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-N 114.542 -1.208 . . . . 7.94 113.902 -170.764 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.429 ' SG ' ' HG2' ' A' ' 52' ' ' MET . 52.7 t -160.02 -71.23 0.07 Allowed 'General case' 0 N--CA 1.419 -2.01 0 C-N-CA 119.915 -0.714 . . . . 9.38 110.492 -177.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.429 ' HG2' ' SG ' ' A' ' 51' ' ' CYS . 24.3 ptt? -178.95 28.12 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 O-C-N 123.5 0.5 . . . . 9.71 111.195 -174.568 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.631 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 10.6 mm-40 -83.95 178.6 7.81 Favored 'General case' 0 C--O 1.201 -1.456 0 N-CA-C 108.177 -1.045 . . . . 9.17 108.177 -171.36 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.47 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 9.5 t -134.86 145.1 47.97 Favored 'General case' 0 C--N 1.279 -2.483 0 C-N-CA 117.894 -1.523 . . . . 6.39 112.303 -175.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.448 ' O ' ' HB3' ' A' ' 45' ' ' SER . 96.8 m-85 -107.31 173.42 6.33 Favored 'General case' 0 N--CA 1.424 -1.762 0 CA-C-N 114.317 -1.311 . . . . 5.78 108.27 176.404 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.428 HD13 ' H ' ' A' ' 57' ' ' CYS . 0.3 OUTLIER -104.51 148.79 8.7 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.547 0 N-CA-C 107.287 -1.375 . . . . 5.53 107.287 -177.217 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.428 ' H ' HD13 ' A' ' 56' ' ' ILE . 42.5 t -71.82 77.58 0.87 Allowed 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.895 0.855 . . . . 4.52 110.322 176.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 9.9 t -96.95 -11.02 25.15 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 114.859 -1.064 . . . . 6.29 108.706 174.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 47.2 m -161.95 150.81 15.47 Favored 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 106.76 -1.57 . . . . 6.33 106.76 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 11.3 m -89.4 131.16 35.59 Favored 'General case' 0 N--CA 1.406 -2.647 0 N-CA-C 105.719 -1.956 . . . . 6.87 105.719 178.279 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.537 ' O ' ' HG3' ' A' ' 65' ' ' ARG . 42.7 mt-10 -52.45 -29.98 27.35 Favored 'General case' 0 C--O 1.186 -2.256 0 N-CA-C 112.787 0.662 . . . . 4.86 112.787 -177.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 86.5 t -58.91 -36.86 63.77 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.4 0 N-CA-C 111.721 0.267 . . . . 7.56 111.721 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -71.56 -30.59 66.04 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 108.02 -1.104 . . . . 9.7 108.02 -179.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 69.8 m -80.2 -25.68 39.55 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 114.726 -1.125 . . . . 6.07 110.956 176.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.537 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 65.8 mtm180 -64.78 -49.12 71.95 Favored 'General case' 0 CA--C 1.5 -0.958 0 N-CA-C 111.972 0.36 . . . . 8.11 111.972 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -63.68 -39.48 94.42 Favored 'General case' 0 C--O 1.217 -0.617 0 C-N-CA 119.967 -0.693 . . . . 9.78 109.673 177.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -62.72 -30.85 71.73 Favored 'General case' 0 CA--C 1.558 1.271 0 CA-C-N 115.918 -0.583 . . . . 9.61 111.085 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -77.67 -50.36 12.62 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 116.295 -0.411 . . . . 6.53 111.17 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 10.8 pt-20 -69.17 -18.09 63.89 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 121.103 0.478 . . . . 8.5 111.743 -178.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.0 -17.56 59.64 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.424 -0.807 . . . . 9.9 111.287 176.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -138.19 -73.99 0.4 Allowed 'General case' 0 C--O 1.211 -0.93 0 CA-C-O 120.691 0.281 . . . . 10.62 111.31 -174.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 18.5 p80 43.5 63.06 8.36 Favored Pre-proline 0 N--CA 1.478 0.963 0 N-CA-C 114.864 1.431 . . . . 8.11 114.864 -178.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -79.74 -60.64 0.03 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.343 0 C-N-CA 121.244 1.296 . . . . 7.3 114.101 178.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -158.21 107.29 2.03 Favored 'General case' 0 N--CA 1.44 -0.942 0 C-N-CA 119.587 -0.845 . . . . 7.81 112.555 -173.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.0 89.96 7.72 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.374 -0.83 . . . . 4.52 110.201 176.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -113.98 -72.48 0.7 Allowed 'General case' 0 N--CA 1.482 1.165 0 CA-C-O 121.101 0.477 . . . . 6.83 111.647 -178.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 27.2 m -77.51 -14.56 14.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 122.079 0.942 . . . . 8.44 108.973 176.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 29.1 m -105.22 11.08 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.141 0 CA-C-N 114.346 -1.297 . . . . 6.03 108.979 175.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.48 ' O ' ' HD3' ' A' ' 49' ' ' LYS . . . -61.21 -18.2 57.06 Favored 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 112.076 0.398 . . . . 4.71 112.076 179.405 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . 0.522 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 78.2 m -76.99 -13.1 60.0 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 116.212 -0.449 . . . . 6.16 111.293 178.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.404 ' CZ ' HG21 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -151.69 75.27 7.75 Favored Pre-proline 0 C--N 1.306 -1.29 0 N-CA-C 106.69 -1.596 . . . . 6.08 106.69 174.634 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -67.88 9.44 0.36 Allowed 'Trans proline' 0 C--N 1.367 1.538 0 C-N-CA 123.7 2.933 . . . . 3.27 114.345 -173.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 38.7 m170 -91.08 -4.6 56.15 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.946 -0.761 . . . . 4.77 108.946 175.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 13.4 mt . . . . . 0 N--CA 1.469 0.518 0 CA-C-N 116.299 -0.409 . . . . 5.47 110.435 -174.974 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.452 -0.343 0 CA-C-O 121.513 0.673 . . . . 7.93 111.496 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.467 ' HB2' ' O ' ' A' ' 55' ' ' PHE . 62.6 m -61.26 -72.52 0.12 Allowed 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 114.816 -1.084 . . . . 4.16 112.253 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.516 ' O ' ' HA ' ' A' ' 54' ' ' THR . 75.4 mt -129.6 129.73 66.75 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 N-CA-C 108.019 -1.104 . . . . 3.76 108.019 -178.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.61 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 28.8 tt0 -97.9 130.33 44.79 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 108.728 -0.841 . . . . 7.28 108.728 178.265 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.584 ' SG ' HG21 ' A' ' 50' ' ' VAL . 41.9 t -67.56 123.6 20.89 Favored 'General case' 0 N--CA 1.421 -1.88 0 CA-C-N 115.708 -0.678 . . . . 5.75 110.479 178.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.451 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -50.07 -33.15 17.51 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 127.17 2.188 . . . . 5.98 111.608 -177.759 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.584 HG21 ' SG ' ' A' ' 48' ' ' CYS . 10.2 m -59.1 -23.18 23.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 N-CA-C 112.765 0.654 . . . . 7.94 112.765 -175.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.9 t -173.63 -81.93 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 120.734 0.302 . . . . 9.38 110.89 178.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.475 ' HA ' ' CG ' ' A' ' 47' ' ' GLN . 55.0 ttp -165.5 36.73 0.06 Allowed 'General case' 0 CA--C 1.547 0.832 0 CA-C-O 122.326 1.06 . . . . 9.71 109.736 -174.573 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.61 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 14.7 mm-40 -88.99 -177.27 5.42 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 107.302 -1.369 . . . . 9.17 107.302 -178.497 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.516 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 13.3 t -144.32 149.22 35.87 Favored 'General case' 0 N--CA 1.42 -1.952 0 C-N-CA 117.156 -1.817 . . . . 6.39 113.041 -177.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.467 ' O ' ' HB2' ' A' ' 45' ' ' SER . 98.4 m-85 -125.93 153.74 43.82 Favored 'General case' 0 N--CA 1.418 -2.068 0 N-CA-C 106.826 -1.546 . . . . 5.78 106.826 177.192 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 9.0 tp -79.32 139.72 17.91 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.342 0 O-C-N 123.411 0.444 . . . . 5.53 110.377 -178.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.0 t -81.16 74.7 8.16 Favored 'General case' 0 N--CA 1.429 -1.525 0 N-CA-C 108.683 -0.858 . . . . 4.52 108.683 177.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 9.8 t -92.26 1.14 57.4 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.406 -0.816 . . . . 6.29 109.951 177.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 92.5 m -156.54 137.26 13.29 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 108.014 -1.106 . . . . 6.33 108.014 178.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 17.9 m -78.72 138.23 38.16 Favored 'General case' 0 N--CA 1.419 -1.997 0 O-C-N 123.522 0.514 . . . . 6.87 110.038 -175.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -51.08 -29.33 12.73 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 124.915 1.286 . . . . 4.86 112.295 178.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 64.3 t -72.54 -32.42 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.78 0 CA-C-O 120.913 0.387 . . . . 7.56 111.384 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -71.52 -39.59 70.67 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 122.322 1.058 . . . . 9.7 108.96 177.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 55.6 m -62.47 -38.16 88.75 Favored 'General case' 0 C--N 1.271 -2.814 0 CA-C-N 113.885 -1.507 . . . . 6.07 109.462 174.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 23.5 ttt180 -57.68 -51.74 68.29 Favored 'General case' 0 N--CA 1.444 -0.768 0 C-N-CA 123.811 0.845 . . . . 8.11 112.895 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -61.7 -38.22 87.03 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-O 121.488 0.661 . . . . 9.78 111.346 -177.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 32.0 t60 -76.67 -31.8 57.53 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.857 -0.61 . . . . 9.61 109.898 -177.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.487 ' O ' ' HB3' ' A' ' 72' ' ' HIS . . . -75.99 -25.39 55.74 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 115.753 -0.658 . . . . 6.53 111.717 -177.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -83.17 -21.03 33.64 Favored 'General case' 0 C--N 1.294 -1.839 0 C-N-CA 120.03 -0.668 . . . . 8.5 111.512 176.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.47 -32.44 37.11 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.08 0.466 . . . . 9.9 110.493 175.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . 0.409 ' HB3' ' HD3' ' A' ' 73' ' ' PRO . 13.5 mptt -101.45 -86.54 0.41 Allowed 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.948 0.721 . . . . 10.62 112.948 -179.002 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.487 ' HB3' ' O ' ' A' ' 68' ' ' ALA 0.256 23.9 p80 46.38 59.01 16.21 Favored Pre-proline 0 N--CA 1.485 1.276 0 N-CA-C 116.052 1.871 . . . . 8.11 116.052 -177.306 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.485 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 6.2 Cg_exo -82.34 -55.43 0.03 OUTLIER 'Trans proline' 0 N--CA 1.434 -2.016 0 C-N-CA 121.77 1.647 . . . . 7.3 112.063 175.235 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 12.7 ptmm? -160.84 108.82 1.56 Allowed 'General case' 0 N--CA 1.436 -1.16 0 CA-C-O 121.435 0.636 . . . . 7.81 111.819 -177.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.07 88.88 1.43 Allowed 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 106.777 -1.564 . . . . 4.52 106.777 171.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -113.19 -75.24 0.6 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.014 -0.994 . . . . 6.83 110.66 -172.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 34.8 m -78.64 -11.91 13.34 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.832 0 CA-C-O 121.893 0.854 . . . . 8.44 108.743 176.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 33.4 m -109.29 13.1 8.68 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.025 0 CA-C-N 114.393 -1.276 . . . . 6.03 109.246 177.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.32 -6.0 12.55 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 121.725 0.774 . . . . 4.71 110.604 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 18.4 p -70.85 -27.31 63.75 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-N 114.813 -1.085 . . . . 6.16 109.634 176.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -155.02 88.22 3.22 Favored Pre-proline 0 N--CA 1.439 -0.986 0 N-CA-C 106.866 -1.531 . . . . 6.08 106.866 174.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -60.6 5.49 0.14 Allowed 'Trans proline' 0 N--CA 1.503 2.061 0 C-N-CA 124.212 3.275 . . . . 3.27 115.063 -172.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 65.1 m-70 -87.96 -8.58 55.5 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 109.205 -0.665 . . . . 4.77 109.205 174.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 36.9 mt . . . . . 0 CA--C 1.536 0.435 0 CA-C-N 115.848 -0.615 . . . . 5.47 111.128 -176.83 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 72.1 mtm . . . . . 0 CA--C 1.5 -0.963 0 CA-C-O 121.654 0.74 . . . . 7.93 109.122 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.561 ' HB2' ' O ' ' A' ' 55' ' ' PHE . 75.3 m -143.89 -73.04 0.27 Allowed 'General case' 0 N--CA 1.413 -2.321 0 CA-C-N 114.561 -1.2 . . . . 4.16 113.872 -174.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.568 ' O ' ' HA ' ' A' ' 54' ' ' THR . 44.3 mt -111.79 136.67 47.2 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.492 0 O-C-N 121.868 -0.52 . . . . 3.76 109.816 -177.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.642 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 19.3 tt0 -97.59 123.98 41.69 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 109.504 -0.554 . . . . 7.28 109.504 -176.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.697 ' SG ' HG21 ' A' ' 50' ' ' VAL . 34.2 t -60.46 141.78 55.98 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.725 1.61 . . . . 5.75 114.052 -173.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.432 ' HD2' ' O ' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -72.12 -31.96 66.51 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.338 1.455 . . . . 5.98 109.467 -177.77 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.697 HG21 ' SG ' ' A' ' 48' ' ' CYS . 5.9 m -61.28 -26.58 39.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 115.868 -0.606 . . . . 7.94 111.6 -174.488 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.7 t -161.86 -76.72 0.05 OUTLIER 'General case' 0 N--CA 1.426 -1.646 0 CA-C-N 115.967 -0.56 . . . . 9.38 109.97 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.501 ' HG2' ' NE2' ' A' ' 47' ' ' GLN . 34.3 ttp 178.51 35.75 0.0 OUTLIER 'General case' 0 C--O 1.212 -0.892 0 CA-C-O 121.925 0.869 . . . . 9.71 108.84 -175.49 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.642 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 14.4 mm-40 -93.92 -164.7 1.21 Allowed 'General case' 0 C--O 1.191 -1.983 0 N-CA-C 108.0 -1.111 . . . . 9.17 108.0 -172.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.568 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 15.3 t -137.14 162.41 33.49 Favored 'General case' 0 C--N 1.313 -0.999 0 C-N-CA 116.828 -1.949 . . . . 6.39 113.184 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.561 ' O ' ' HB2' ' A' ' 45' ' ' SER . 96.6 m-85 -144.18 177.9 8.27 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 126.626 1.97 . . . . 5.78 106.978 177.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 7.5 tp -86.95 134.73 26.81 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 CA-C-O 120.977 0.418 . . . . 5.53 111.994 -176.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.534 ' CB ' ' HB3' ' A' ' 45' ' ' SER . 10.3 t -110.4 85.0 2.02 Favored 'General case' 0 N--CA 1.413 -2.296 0 N-CA-C 107.353 -1.351 . . . . 4.52 107.353 175.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.9 p -55.27 -35.13 64.69 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.17 -0.923 . . . . 6.29 111.681 174.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.515 HG21 ' H ' ' A' ' 61' ' ' GLU . 14.2 t -109.09 -155.44 0.56 Allowed 'General case' 0 CA--C 1.556 1.176 0 N-CA-C 108.723 -0.843 . . . . 6.33 108.723 -178.105 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.0 t -100.07 21.74 12.36 Favored 'General case' 0 CA--C 1.554 1.097 0 N-CA-C 109.68 -0.489 . . . . 6.87 109.68 177.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.515 ' H ' HG21 ' A' ' 59' ' ' THR . 29.7 tt0 64.78 -50.88 0.32 Allowed 'General case' 0 N--CA 1.503 2.191 0 C-N-CA 126.361 1.864 . . . . 4.86 111.942 -175.163 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.473 ' O ' ' HB3' ' A' ' 65' ' ' ARG . 57.7 t -51.01 -29.49 7.9 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 C-N-CA 125.361 1.464 . . . . 7.56 112.956 -176.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.523 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 4.7 tmtm? -72.5 -38.07 68.23 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 122.038 0.923 . . . . 9.7 108.898 -179.311 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 85.6 m -75.78 -29.28 58.72 Favored 'General case' 0 C--N 1.284 -2.259 0 N-CA-C 109.038 -0.727 . . . . 6.07 109.038 176.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.473 ' HB3' ' O ' ' A' ' 62' ' ' VAL . 21.8 tpt180 -56.86 -55.34 35.65 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.421 1.088 . . . . 8.11 111.34 177.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -59.1 -37.61 77.55 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 123.981 0.801 . . . . 9.78 110.73 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 52.8 t60 -76.7 -26.77 55.08 Favored 'General case' 0 C--O 1.21 -1.023 0 C-N-CA 120.368 -0.533 . . . . 9.61 111.501 -178.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.449 ' O ' ' HB2' ' A' ' 72' ' ' HIS . . . -82.13 -38.03 25.38 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 111.771 0.286 . . . . 6.53 111.771 -177.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -73.49 -23.49 60.06 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.3 0.571 . . . . 8.5 110.297 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -89.63 -7.0 55.69 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.596 -0.729 . . . . 9.9 111.437 178.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -136.0 -85.87 0.36 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 111.962 0.356 . . . . 10.62 111.962 -177.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.467 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 44.3 t-80 51.25 51.8 10.95 Favored Pre-proline 0 CA--C 1.561 1.37 0 C-N-CA 123.743 0.817 . . . . 8.11 110.272 -178.197 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.467 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 31.4 Cg_exo -61.11 -46.67 14.7 Favored 'Trans proline' 0 C--N 1.382 2.301 0 C-N-CA 121.481 1.454 . . . . 7.3 110.79 -176.104 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.451 ' HG3' ' OD2' ' A' ' 76' ' ' ASP . 15.5 pttp -167.49 106.23 0.55 Allowed 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 115.196 -0.911 . . . . 7.81 109.075 179.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.428 ' O ' HG23 ' A' ' 78' ' ' VAL . . . -57.7 -54.7 43.94 Favored 'General case' 0 CA--C 1.564 1.518 0 N-CA-C 114.494 1.294 . . . . 4.52 114.494 177.645 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.451 ' OD2' ' HG3' ' A' ' 74' ' ' LYS . 13.5 m-20 56.43 -94.73 0.05 OUTLIER 'General case' 0 N--CA 1.518 2.958 0 C-N-CA 124.455 1.102 . . . . 6.83 113.136 -178.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.6 m -85.66 -17.03 9.72 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.746 0 CA-C-N 115.353 -0.84 . . . . 8.44 110.894 -176.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 75' ' ' ALA . 26.3 m -103.18 13.51 6.94 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.639 0 N-CA-C 109.079 -0.711 . . . . 6.03 109.079 175.154 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.9 -12.91 28.31 Favored 'General case' 0 N--CA 1.489 1.483 0 CA-C-O 121.429 0.633 . . . . 4.71 111.687 176.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 71.6 m -74.98 -11.59 60.14 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-N 115.803 -0.635 . . . . 6.16 110.262 176.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.469 ' CE2' ' HB2' ' A' ' 83' ' ' HIS . 25.8 t80 -167.78 83.37 0.8 Allowed Pre-proline 0 N--CA 1.435 -1.198 0 N-CA-C 108.226 -1.027 . . . . 6.08 108.226 172.108 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -63.07 11.26 0.09 OUTLIER 'Trans proline' 0 N--CA 1.498 1.741 0 C-N-CA 124.384 3.39 . . . . 3.27 116.053 -173.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.469 ' HB2' ' CE2' ' A' ' 81' ' ' PHE . 50.3 m170 -87.19 -1.62 58.03 Favored 'General case' 0 C--O 1.193 -1.908 0 N-CA-C 109.026 -0.731 . . . . 4.77 109.026 174.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 45.2 mt . . . . . 0 C--O 1.241 0.647 0 N-CA-C 113.556 0.947 . . . . 5.47 113.556 -172.952 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 47.2 tpp . . . . . 0 N--CA 1.503 2.213 0 CA-C-O 121.358 0.599 . . . . 7.93 111.757 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . 0.264 32.6 p 48.02 -98.74 0.05 OUTLIER 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 116.177 1.917 . . . . 4.16 116.177 179.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.506 ' O ' ' HA ' ' A' ' 54' ' ' THR . 70.2 mt -127.32 127.07 68.77 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.251 0 N-CA-C 109.414 -0.587 . . . . 3.76 109.414 -177.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.641 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 26.1 tt0 -99.52 133.38 43.93 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 109.133 -0.691 . . . . 7.28 109.133 -178.025 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.492 ' SG ' HG21 ' A' ' 50' ' ' VAL . 49.5 t -72.53 131.75 42.91 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 115.69 -0.687 . . . . 5.75 112.584 -177.465 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 5.9 ttpt -52.9 -29.39 28.11 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 127.097 2.159 . . . . 5.98 112.465 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.492 HG21 ' SG ' ' A' ' 48' ' ' CYS . 14.6 m -63.58 -27.78 43.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.984 -0.553 . . . . 7.94 112.223 -172.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 48.2 t -170.72 -77.5 0.02 OUTLIER 'General case' 0 N--CA 1.434 -1.267 0 CA-C-N 116.208 -0.451 . . . . 9.38 110.047 -178.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.44 ' O ' ' HG2' ' A' ' 52' ' ' MET . 26.9 ttt -171.51 39.85 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.664 0 CA-C-O 121.965 0.888 . . . . 9.71 109.817 -175.172 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.641 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 18.4 mm-40 -92.52 -173.41 3.36 Favored 'General case' 0 C--O 1.203 -1.394 0 N-CA-C 108.38 -0.971 . . . . 9.17 108.38 -177.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.506 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 9.6 t -139.21 161.81 36.51 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 118.111 -1.436 . . . . 6.39 112.461 -177.589 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -141.1 148.62 40.42 Favored 'General case' 0 N--CA 1.433 -1.322 0 C-N-CA 126.244 1.818 . . . . 5.78 106.527 178.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.1 tp -70.43 136.37 26.16 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.694 0 CA-C-O 121.061 0.458 . . . . 5.53 111.975 -177.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 16.6 p -81.68 76.66 8.58 Favored 'General case' 0 N--CA 1.423 -1.78 0 CA-C-O 121.811 0.815 . . . . 4.52 110.534 175.096 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.5 m -63.46 -8.59 9.66 Favored 'General case' 0 CA--C 1.568 1.659 0 CA-C-N 114.817 -1.083 . . . . 6.29 110.752 175.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.408 ' C ' ' H ' ' A' ' 61' ' ' GLU . 32.9 m -146.21 172.99 12.63 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 105.555 -2.017 . . . . 6.33 105.555 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 12.5 m -74.54 15.85 0.32 Allowed 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 118.987 0.812 . . . . 6.87 112.233 -174.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.416 ' CD ' HH21 ' A' ' 65' ' ' ARG . 35.1 tt0 63.1 -61.67 0.13 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 125.195 1.398 . . . . 4.86 112.066 -177.246 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.0 p -61.06 -28.28 43.37 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.966 0 C-N-CA 123.679 0.792 . . . . 7.56 110.735 -176.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.7 tmtt? -66.2 -41.78 89.69 Favored 'General case' 0 C--O 1.249 1.078 0 N-CA-C 107.142 -1.429 . . . . 9.7 107.142 179.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 55.6 m -66.16 -33.52 75.96 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 114.663 -1.153 . . . . 6.07 108.073 176.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.642 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 94.0 mtt180 -62.01 -37.49 85.07 Favored 'General case' 0 C--O 1.199 -1.559 0 CA-C-N 115.405 -0.816 . . . . 8.11 111.769 178.552 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -56.37 -50.26 72.07 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.642 0.734 . . . . 9.78 109.227 -179.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 76.4 t60 -68.37 -32.13 71.99 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 114.517 -1.219 . . . . 9.61 111.229 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.8 -44.66 31.84 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 112.475 0.546 . . . . 6.53 112.475 -175.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.642 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 11.5 mm-40 -63.51 -32.66 74.18 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.362 0.601 . . . . 8.5 109.467 -178.154 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -88.74 7.97 31.17 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-N 115.312 -0.858 . . . . 9.9 111.628 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -144.17 -85.56 0.14 Allowed 'General case' 0 CA--C 1.508 -0.651 0 C-N-CA 122.501 0.321 . . . . 10.62 111.852 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.412 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 29.4 p80 43.05 57.88 11.74 Favored Pre-proline 0 CA--C 1.554 1.128 0 C-N-CA 124.013 0.925 . . . . 8.11 112.338 -177.143 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.412 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 53.6 Cg_exo -54.92 -36.53 92.13 Favored 'Trans proline' 0 C--N 1.37 1.68 0 C-N-CA 122.934 2.423 . . . . 7.3 113.694 -175.403 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 63.5 pttt -171.86 -40.41 0.02 OUTLIER 'General case' 0 C--N 1.348 0.518 0 N-CA-C 113.3 0.852 . . . . 7.81 113.3 -178.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.409 ' HB3' ' HA ' ' A' ' 79' ' ' ALA . . . 76.03 108.66 0.08 Allowed 'General case' 0 C--O 1.212 -0.892 0 C-N-CA 124.387 1.075 . . . . 4.52 109.326 -172.336 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -87.47 -105.58 0.07 Allowed 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 113.899 -1.501 . . . . 6.83 110.102 -169.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.8 m -86.41 -7.65 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.838 0 N-CA-C 107.56 -1.274 . . . . 8.44 107.56 170.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 28.6 m -90.75 14.4 1.45 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.505 0 CA-C-N 113.766 -1.561 . . . . 6.03 109.266 177.2 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.409 ' HA ' ' HB3' ' A' ' 75' ' ' ALA . . . -71.35 1.05 6.77 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 122.079 0.942 . . . . 4.71 110.176 176.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . 0.47 ' HB2' ' HG ' ' A' ' 48' ' ' CYS . 19.9 p -75.76 -22.14 56.77 Favored 'General case' 0 N--CA 1.423 -1.778 0 CA-C-N 114.217 -1.356 . . . . 6.16 109.503 174.188 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.459 ' HD2' ' HG ' ' A' ' 84' ' ' LEU . 27.2 t80 -157.57 91.32 2.31 Favored Pre-proline 0 C--N 1.309 -1.163 0 N-CA-C 106.413 -1.699 . . . . 6.08 106.413 170.59 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -62.04 5.13 0.24 Allowed 'Trans proline' 0 N--CA 1.491 1.326 0 C-N-CA 123.762 2.975 . . . . 3.27 115.41 -172.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.426 ' HB2' ' CE2' ' A' ' 81' ' ' PHE . 76.7 m-70 -100.85 9.99 41.67 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 108.789 -0.819 . . . . 4.77 108.789 177.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.459 ' HG ' ' HD2' ' A' ' 81' ' ' PHE . 60.8 mt . . . . . 0 C--O 1.242 0.68 0 CA-C-N 115.691 -0.686 . . . . 5.47 111.254 178.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 66.5 mtt . . . . . 0 C--O 1.223 -0.297 0 CA-C-O 121.727 0.775 . . . . 7.93 110.387 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.41 ' HB3' ' CB ' ' A' ' 57' ' ' CYS . 31.0 m -52.33 -59.16 4.74 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 114.16 -1.382 . . . . 4.16 112.757 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.46 ' O ' ' HA ' ' A' ' 54' ' ' THR . 65.6 mt -127.88 128.39 69.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 109.294 -0.632 . . . . 3.76 109.294 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.624 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 1.6 tp60 -100.12 124.68 45.8 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 107.116 -1.439 . . . . 7.28 107.116 178.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.657 ' SG ' HG21 ' A' ' 50' ' ' VAL . 26.9 t -59.7 122.45 14.17 Favored 'General case' 0 C--N 1.307 -1.239 0 C-N-CA 124.135 0.974 . . . . 5.75 111.394 -176.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.58 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 1.5 tmmm? -52.02 -31.72 30.94 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 125.363 1.465 . . . . 5.98 111.411 -178.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.657 HG21 ' SG ' ' A' ' 48' ' ' CYS . 7.4 m -63.8 -28.15 44.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 112.176 0.435 . . . . 7.94 112.176 -174.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 54.1 t -161.17 -77.62 0.05 Allowed 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 120.969 -0.292 . . . . 9.38 110.863 -178.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.485 ' O ' ' HG2' ' A' ' 52' ' ' MET . 50.1 ttm -178.24 36.55 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.039 0 CA-C-O 121.523 0.678 . . . . 9.71 109.941 -176.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.624 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 22.1 mm-40 -91.99 178.73 5.8 Favored 'General case' 0 C--O 1.188 -2.145 0 O-C-N 121.13 -0.981 . . . . 9.17 109.569 -177.515 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.46 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 27.6 m -128.01 141.35 51.54 Favored 'General case' 0 N--CA 1.413 -2.276 0 C-N-CA 118.12 -1.432 . . . . 6.39 113.385 -173.371 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -126.24 172.55 9.98 Favored 'General case' 0 C--O 1.242 0.677 0 C-N-CA 125.275 1.43 . . . . 5.78 107.823 174.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.409 HD12 ' N ' ' A' ' 57' ' ' CYS . 0.1 OUTLIER -96.63 132.29 41.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 N-CA-C 109.434 -0.58 . . . . 5.53 109.434 -176.585 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.454 ' HB2' HG13 ' A' ' 46' ' ' ILE . 11.4 t -103.87 85.62 2.45 Favored 'General case' 0 N--CA 1.425 -1.704 0 N-CA-C 106.811 -1.551 . . . . 4.52 106.811 176.475 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 11.2 t -56.17 1.69 0.02 OUTLIER 'General case' 0 CA--C 1.579 2.072 0 N-CA-C 115.413 1.634 . . . . 6.29 115.413 178.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 14.9 t -155.33 -164.91 1.87 Allowed 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 106.919 -1.512 . . . . 6.33 106.919 178.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 41.6 t -85.05 135.39 34.02 Favored 'General case' 0 C--N 1.281 -2.375 0 N-CA-C 107.686 -1.227 . . . . 6.87 107.686 175.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.569 ' O ' ' HG3' ' A' ' 65' ' ' ARG . 42.3 tt0 -56.49 -26.89 55.69 Favored 'General case' 0 C--O 1.196 -1.76 0 N-CA-C 110.244 -0.28 . . . . 4.86 110.244 177.039 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 86.5 t -67.09 -30.31 49.02 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 O-C-N 122.06 -0.4 . . . . 7.56 110.722 179.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -71.89 -33.16 68.12 Favored 'General case' 0 C--O 1.257 1.457 0 N-CA-C 107.155 -1.424 . . . . 9.7 107.155 178.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 61' ' ' GLU . 82.1 m -69.21 -40.93 77.71 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-N 114.249 -1.342 . . . . 6.07 109.732 173.339 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.569 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 96.0 mtt180 -60.38 -50.69 72.59 Favored 'General case' 0 CA--C 1.508 -0.642 0 C-N-CA 123.271 0.628 . . . . 8.11 112.09 -177.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -62.49 -33.98 75.96 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.208 0.527 . . . . 9.78 110.687 -179.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 41.4 t60 -75.34 -31.81 60.69 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.093 -0.503 . . . . 9.61 110.936 178.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . 0.403 ' O ' ' HB3' ' A' ' 72' ' ' HIS . . . -73.66 -44.83 55.75 Favored 'General case' 0 CA--C 1.483 -1.615 0 N-CA-C 109.784 -0.45 . . . . 6.53 109.784 179.09 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -71.74 -7.64 49.37 Favored 'General case' 0 C--N 1.315 -0.902 0 O-C-N 123.541 0.525 . . . . 8.5 111.155 178.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.74 -54.32 4.99 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.731 -0.668 . . . . 9.9 109.862 172.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.3 mmmm -88.05 -77.54 0.35 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.693 -0.685 . . . . 10.62 111.221 -177.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.403 ' HB3' ' O ' ' A' ' 68' ' ' ALA 0.25 16.8 p80 40.85 63.62 5.58 Favored Pre-proline 0 N--CA 1.468 0.463 0 N-CA-C 115.087 1.514 . . . . 8.11 115.087 -177.183 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -83.12 -61.04 0.02 OUTLIER 'Trans proline' 0 N--CA 1.431 -2.171 0 C-N-CA 120.951 1.101 . . . . 7.3 111.466 176.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 13.7 pttm -161.32 120.4 2.5 Favored 'General case' 0 N--CA 1.411 -2.421 0 N-CA-C 108.037 -1.097 . . . . 7.81 108.037 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.468 ' O ' ' HB2' ' A' ' 79' ' ' ALA . . . -73.6 100.78 3.42 Favored 'General case' 0 C--N 1.286 -2.172 0 N-CA-C 108.752 -0.833 . . . . 4.52 108.752 175.058 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -95.19 -91.82 0.21 Allowed 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.448 0.642 . . . . 6.83 111.272 -177.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.1 m -79.54 -13.81 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.073 0 N-CA-C 108.151 -1.055 . . . . 8.44 108.151 176.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 13.9 m -92.95 9.32 4.4 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.874 0 CA-C-N 114.635 -1.166 . . . . 6.03 108.603 176.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' A' ' 75' ' ' ALA . . . -69.33 -11.15 60.57 Favored 'General case' 0 C--O 1.253 1.249 0 CA-C-O 121.104 0.478 . . . . 4.71 111.638 178.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 66.4 m -79.96 -23.43 41.66 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 115.627 -0.715 . . . . 6.16 109.122 174.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 3.7 p90 -140.74 67.39 28.95 Favored Pre-proline 0 CA--C 1.556 1.173 0 C-N-CA 124.547 1.139 . . . . 6.08 111.334 178.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -69.03 7.45 0.79 Allowed 'Trans proline' 0 C--N 1.366 1.478 0 C-N-CA 123.645 2.897 . . . . 3.27 114.013 -174.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 49.5 m170 -90.84 -7.27 52.77 Favored 'General case' 0 C--O 1.202 -1.413 0 N-CA-C 109.171 -0.677 . . . . 4.77 109.171 177.463 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.432 ' HB3' ' HB3' ' A' ' 64' ' ' CYS . 0.2 OUTLIER . . . . . 0 N--CA 1.42 -1.929 0 CA-C-N 114.921 -1.036 . . . . 5.47 110.348 178.116 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . 0.262 23.1 ptp . . . . . 0 N--CA 1.516 2.858 0 N-CA-C 115.682 1.734 . . . . 7.93 115.682 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 41.2 m 70.47 -101.07 0.04 OUTLIER 'General case' 0 N--CA 1.413 -2.295 0 N-CA-C 114.91 1.448 . . . . 4.16 114.91 176.112 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.446 ' O ' ' HA ' ' A' ' 54' ' ' THR . 66.3 mt -133.52 148.45 30.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 N-CA-C 110.169 -0.308 . . . . 3.76 110.169 -172.749 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.605 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 46.3 tt0 -110.6 143.69 40.62 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 123.417 0.687 . . . . 7.28 109.993 177.6 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.51 ' SG ' HG22 ' A' ' 50' ' ' VAL . 49.0 t -82.55 129.92 35.02 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 122.986 0.514 . . . . 5.75 111.214 178.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.5 -35.19 52.47 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 127.791 2.436 . . . . 5.98 110.617 -178.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.51 HG22 ' SG ' ' A' ' 48' ' ' CYS . 9.6 m -58.32 -23.46 22.24 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 N-CA-C 112.798 0.666 . . . . 7.94 112.798 -174.376 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.8 t -172.11 -86.27 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.846 0 O-C-N 123.473 0.483 . . . . 9.38 110.532 179.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.429 ' HA ' ' CG ' ' A' ' 47' ' ' GLN . 50.0 ttp -164.68 40.51 0.08 Allowed 'General case' 0 C--O 1.239 0.544 0 CA-C-O 122.67 1.224 . . . . 9.71 110.207 -178.062 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.605 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 19.1 mm-40 -86.97 -167.77 2.0 Favored 'General case' 0 C--O 1.205 -1.25 0 N-CA-C 108.22 -1.029 . . . . 9.17 108.22 -177.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.446 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 12.9 t -144.42 154.57 43.1 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 117.536 -1.665 . . . . 6.39 112.955 -176.271 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -130.46 162.79 28.4 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 106.116 -1.809 . . . . 5.78 106.116 176.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . 0.491 HD13 ' H ' ' A' ' 57' ' ' CYS . 0.3 OUTLIER -88.96 148.53 4.47 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 108.083 -1.08 . . . . 5.53 108.083 -177.264 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . 0.491 ' H ' HD13 ' A' ' 56' ' ' ILE . 20.7 p -76.69 77.36 3.34 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 121.45 0.643 . . . . 4.52 111.485 179.088 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 31.7 p -60.28 -26.89 66.84 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.675 -1.148 . . . . 6.29 111.18 174.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.529 ' HB ' ' SG ' ' A' ' 64' ' ' CYS . 16.3 m -143.38 173.04 11.97 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 107.178 -1.415 . . . . 6.33 107.178 -177.327 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.4 m -76.47 18.52 0.31 Allowed 'General case' 0 CA--C 1.556 1.191 0 N-CA-C 112.875 0.695 . . . . 6.87 112.875 -174.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 64.04 -62.16 0.17 Allowed 'General case' 0 N--CA 1.503 2.221 0 C-N-CA 125.375 1.47 . . . . 4.86 111.24 -176.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . 0.661 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 92.9 t -57.01 -36.42 50.75 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.477 0 C-N-CA 123.966 0.906 . . . . 7.56 111.575 -178.026 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.484 ' HA ' ' CG ' ' A' ' 66' ' ' GLU . 4.5 mptp? -68.28 -25.93 65.4 Favored 'General case' 0 C--O 1.244 0.815 0 CA-C-O 122.076 0.941 . . . . 9.7 112.296 177.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . 0.529 ' SG ' ' HB ' ' A' ' 59' ' ' THR . 57.3 m -77.41 -38.78 49.01 Favored 'General case' 0 C--N 1.272 -2.765 0 N-CA-C 107.029 -1.471 . . . . 6.07 107.029 175.089 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -63.53 -38.39 90.96 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 114.234 -1.348 . . . . 8.11 111.763 178.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . 0.661 ' HG2' ' O ' ' A' ' 62' ' ' VAL . 5.0 mm-40 -52.6 -55.17 24.26 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 107.471 -1.307 . . . . 9.78 107.471 176.423 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 48.8 t60 -76.14 -17.06 59.74 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-N 114.327 -1.306 . . . . 9.61 111.396 -176.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -77.92 -40.4 39.78 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 122.038 -0.414 . . . . 6.53 109.949 179.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -68.83 -16.97 63.93 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.76 0.79 . . . . 8.5 109.748 177.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.08 -18.24 60.32 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 114.568 -1.196 . . . . 9.9 112.058 175.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -141.04 -83.67 0.21 Allowed 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 111.987 0.366 . . . . 10.62 111.987 -178.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . 0.55 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 27.1 p80 44.48 43.43 1.2 Allowed Pre-proline 0 N--CA 1.507 2.383 0 C-N-CA 125.732 1.613 . . . . 8.11 114.682 -179.523 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . 0.55 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 7.5 Cg_exo -71.88 -52.33 0.2 Allowed 'Trans proline' 0 C--N 1.368 1.57 0 C-N-CA 121.48 1.453 . . . . 7.3 111.818 -176.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -154.84 122.09 5.61 Favored 'General case' 0 N--CA 1.404 -2.743 0 N-CA-C 107.751 -1.203 . . . . 7.81 107.751 -178.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.06 120.78 30.77 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 107.88 -1.156 . . . . 4.52 107.88 171.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -96.95 -90.55 0.25 Allowed 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.31 0.576 . . . . 6.83 111.678 -172.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.2 m -86.66 -12.01 11.0 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 CA-C-O 122.259 1.028 . . . . 8.44 108.595 176.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 27.6 m -96.6 12.2 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 CA-C-N 113.954 -1.475 . . . . 6.03 108.94 176.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.94 -3.42 3.44 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-O 121.46 0.648 . . . . 4.71 110.951 177.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 17.8 p -71.11 -28.45 64.32 Favored 'General case' 0 N--CA 1.426 -1.643 0 CA-C-N 115.039 -0.982 . . . . 6.16 109.717 175.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.407 ' C ' ' H ' ' A' ' 83' ' ' HIS . 18.8 t80 -155.94 92.38 2.63 Favored Pre-proline 0 N--CA 1.44 -0.951 0 N-CA-C 107.195 -1.409 . . . . 6.08 107.195 171.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -63.49 8.4 0.15 Allowed 'Trans proline' 0 N--CA 1.5 1.904 0 C-N-CA 124.462 3.441 . . . . 3.27 114.603 -173.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . 0.407 ' H ' ' C ' ' A' ' 81' ' ' PHE . 41.4 m80 -101.25 7.45 42.94 Favored 'General case' 0 C--N 1.287 -2.109 0 C-N-CA 120.469 -0.492 . . . . 4.77 110.022 176.444 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 37.6 mt . . . . . 0 CA--C 1.542 0.64 0 CA-C-N 116.422 -0.353 . . . . 5.47 111.267 -178.503 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 25.2 mmt . . . . . 0 N--CA 1.472 0.633 0 CA-C-O 121.532 0.682 . . . . 7.93 110.704 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.51 ' HB2' ' O ' ' A' ' 55' ' ' PHE . 53.1 m -75.48 -84.35 0.05 Allowed 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 114.677 1.362 . . . . 4.16 114.677 -176.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.9 mt -139.95 159.29 26.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 N-CA-C 107.812 -1.181 . . . . 3.76 107.812 -174.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.611 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 32.4 tt0 -112.09 149.34 32.25 Favored 'General case' 0 CA--C 1.552 1.029 0 N-CA-C 109.335 -0.617 . . . . 7.28 109.335 -176.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.465 ' SG ' HG21 ' A' ' 50' ' ' VAL . 41.6 t -85.99 145.25 27.19 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 112.408 0.521 . . . . 5.75 112.408 -177.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.456 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -66.39 -23.15 66.28 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.392 1.477 . . . . 5.98 110.371 -175.235 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.465 HG21 ' SG ' ' A' ' 48' ' ' CYS . 20.4 m -62.11 -30.06 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 CA-C-N 115.169 -0.923 . . . . 7.94 112.431 -175.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 41.9 t -176.96 -110.57 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.494 0 N-CA-C 107.3 -1.37 . . . . 9.38 107.3 -175.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 4.8 mpp? -136.44 64.28 1.56 Allowed 'General case' 0 N--CA 1.427 -1.614 0 CA-C-O 121.044 0.45 . . . . 9.71 111.6 177.095 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.611 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 23.0 mm-40 -106.25 -165.05 1.06 Allowed 'General case' 0 C--O 1.19 -2.062 0 N-CA-C 108.672 -0.862 . . . . 9.17 108.672 -178.068 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 15.0 t -144.13 151.8 40.06 Favored 'General case' 0 N--CA 1.437 -1.12 0 C-N-CA 117.991 -1.484 . . . . 6.39 112.954 -178.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.51 ' O ' ' HB2' ' A' ' 45' ' ' SER . 89.1 m-85 -123.29 174.55 7.24 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 107.105 -1.443 . . . . 5.78 107.105 175.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 10.2 tp -100.41 142.46 15.53 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.21 0 N-CA-C 110.057 -0.349 . . . . 5.53 110.057 -178.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 49.7 t -86.37 78.35 9.29 Favored 'General case' 0 N--CA 1.415 -2.198 0 CA-C-O 121.565 0.697 . . . . 4.52 109.244 178.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 9.4 t -73.31 -12.81 60.97 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 114.993 -1.003 . . . . 6.29 111.097 175.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 28.6 m -143.79 -89.57 0.12 Allowed 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 109.767 -0.457 . . . . 6.33 109.767 178.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 65.2 p -173.06 5.03 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 112.851 0.686 . . . . 6.87 112.851 176.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.482 ' O ' ' HG3' ' A' ' 65' ' ' ARG . 36.9 tt0 67.75 -45.58 0.49 Allowed 'General case' 0 N--CA 1.498 1.937 0 C-N-CA 123.839 0.855 . . . . 4.86 111.187 -172.113 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 94.8 t -56.84 -40.18 69.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 O-C-N 121.627 -0.671 . . . . 7.56 112.468 -178.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.457 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 8.0 tmtt? -61.91 -37.74 85.78 Favored 'General case' 0 CA--C 1.561 1.392 0 CA-C-O 122.293 1.044 . . . . 9.7 109.008 179.294 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . 0.453 ' SG ' ' HA ' ' A' ' 61' ' ' GLU . 29.7 p -81.49 -19.41 42.33 Favored 'General case' 0 C--O 1.204 -1.293 0 CA-C-N 115.791 -0.641 . . . . 6.07 110.152 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . 0.482 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 97.5 mtt180 -64.68 -39.8 94.3 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 108.736 -0.838 . . . . 8.11 108.736 175.198 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -60.13 -47.8 84.4 Favored 'General case' 0 C--O 1.245 0.867 0 CA-C-N 115.232 -0.894 . . . . 9.78 108.822 179.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . 0.449 ' O ' ' HB3' ' A' ' 70' ' ' ALA . 41.8 t60 -74.44 -22.31 59.19 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-N 115.072 -0.967 . . . . 9.61 111.29 -178.088 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -74.67 -42.26 58.79 Favored 'General case' 0 CA--C 1.492 -1.265 0 C-N-CA 119.957 -0.697 . . . . 6.53 109.231 178.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -65.76 -13.89 60.26 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.824 0.821 . . . . 8.5 110.67 176.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.449 ' HB3' ' O ' ' A' ' 67' ' ' HIS . . . -76.23 -19.17 58.6 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.099 -0.955 . . . . 9.9 110.911 174.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -146.0 -82.89 0.14 Allowed 'General case' 0 C--O 1.211 -0.939 0 CA-C-O 121.042 0.449 . . . . 10.62 111.861 -177.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.372 4.6 p80 36.45 67.24 1.72 Allowed Pre-proline 0 N--CA 1.488 1.431 0 C-N-CA 126.58 1.952 . . . . 8.11 116.052 -173.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_exo -70.02 -61.63 0.06 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 121.39 1.393 . . . . 7.3 111.214 174.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -158.56 120.05 3.47 Favored 'General case' 0 N--CA 1.418 -2.045 0 CA-C-N 115.558 -0.747 . . . . 7.81 108.986 178.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.438 ' O ' ' HB3' ' A' ' 79' ' ' ALA . . . -77.18 115.79 17.27 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 107.769 -1.197 . . . . 4.52 107.769 173.5 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -95.53 -87.1 0.29 Allowed 'General case' 0 C--O 1.201 -1.475 0 CA-C-O 121.012 0.434 . . . . 6.83 111.389 -173.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.8 m -84.6 -14.85 11.19 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.663 0 CA-C-O 122.128 0.966 . . . . 8.44 108.774 176.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 34.1 m -94.97 11.66 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.524 0 CA-C-N 114.681 -1.145 . . . . 6.03 109.223 177.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 75' ' ' ALA . . . -65.39 -6.82 11.22 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-O 121.767 0.794 . . . . 4.71 111.646 177.322 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 18.9 p -76.53 -17.67 59.13 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 115.144 -0.934 . . . . 6.16 109.701 175.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.505 ' CD1' ' HG ' ' A' ' 84' ' ' LEU . 1.6 t80 -161.93 80.13 1.95 Allowed Pre-proline 0 CA--C 1.555 1.14 0 N-CA-C 106.506 -1.665 . . . . 6.08 106.506 178.018 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -62.93 -3.85 5.25 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 124.265 3.31 . . . . 3.27 115.696 -171.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -84.77 -6.15 59.35 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 109.268 -0.641 . . . . 4.77 109.268 -179.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.505 ' HG ' ' CD1' ' A' ' 81' ' ' PHE . 42.6 mt . . . . . 0 CA--C 1.536 0.418 0 CA-C-N 116.217 -0.447 . . . . 5.47 112.188 -174.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 64.2 mtm . . . . . 0 N--CA 1.497 1.883 0 CA-C-O 121.692 0.758 . . . . 7.93 111.417 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . 0.353 12.9 p 55.6 -108.2 0.42 Allowed 'General case' 0 N--CA 1.409 -2.49 0 N-CA-C 118.141 2.645 . . . . 4.16 118.141 177.482 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.554 ' O ' ' HA ' ' A' ' 54' ' ' THR . 68.7 mt -127.04 132.19 70.12 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.99 0 CA-C-N 116.604 -0.271 . . . . 3.76 110.395 -174.578 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.65 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 9.2 tt0 -98.1 135.12 40.22 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.222 0.534 . . . . 7.28 110.397 -178.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.575 ' SG ' HG23 ' A' ' 50' ' ' VAL . 12.9 t -70.86 133.04 46.14 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-N 115.053 -0.976 . . . . 5.75 111.913 -178.224 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.6 ttpt -57.21 -30.42 64.56 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.78 1.632 . . . . 5.98 111.599 -179.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . 0.575 HG23 ' SG ' ' A' ' 48' ' ' CYS . 16.3 m -60.24 -27.89 40.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 N-CA-C 112.944 0.72 . . . . 7.94 112.944 -175.099 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 54.1 t -174.27 -99.84 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 109.076 -0.713 . . . . 9.38 109.076 -178.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.419 ' C ' HE21 ' A' ' 53' ' ' GLN . 2.2 mpt? -145.45 60.37 1.28 Allowed 'General case' 0 N--CA 1.426 -1.67 0 C-N-CA 122.543 0.337 . . . . 9.71 110.841 179.197 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.65 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 20.9 mm-40 -107.2 -172.49 2.09 Favored 'General case' 0 CA--C 1.481 -1.677 0 N-CA-C 108.064 -1.087 . . . . 9.17 108.064 -178.83 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.554 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 8.9 t -143.12 153.71 43.17 Favored 'General case' 0 N--CA 1.424 -1.773 0 C-N-CA 118.239 -1.384 . . . . 6.39 112.476 -177.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 99.7 m-85 -130.32 140.43 50.64 Favored 'General case' 0 C--N 1.298 -1.64 0 N-CA-C 105.489 -2.041 . . . . 5.78 105.489 176.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.9 tp -67.07 147.47 12.58 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 CA-C-O 121.225 0.536 . . . . 5.53 111.368 -173.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.6 t -78.34 73.13 4.9 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-O 121.52 0.676 . . . . 4.52 111.583 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 13.4 p -79.91 -22.27 42.95 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-O 121.483 0.658 . . . . 6.29 110.0 170.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' THR . . . . . 0.406 HG22 ' HB3' ' A' ' 64' ' ' CYS . 27.2 m -116.61 150.79 37.49 Favored 'General case' 0 N--CA 1.427 -1.595 0 N-CA-C 108.286 -1.005 . . . . 6.33 108.286 177.106 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 30.8 t -82.55 14.98 2.75 Favored 'General case' 0 CA--C 1.564 1.518 0 C-N-CA 122.7 0.4 . . . . 6.87 111.189 -176.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.665 ' HA ' ' SG ' ' A' ' 64' ' ' CYS . 5.5 tp10 64.96 -60.69 0.23 Allowed 'General case' 0 C--O 1.181 -2.509 0 C-N-CA 123.899 0.88 . . . . 4.86 111.858 -176.265 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 90.3 t -57.85 -29.07 34.61 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.329 0 O-C-N 121.577 -0.702 . . . . 7.56 111.956 -176.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.426 ' O ' ' HD2' ' A' ' 63' ' ' LYS . 3.2 tmmm? -77.79 -35.64 51.25 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 109.372 -0.603 . . . . 9.7 109.372 178.224 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . 0.665 ' SG ' ' HA ' ' A' ' 61' ' ' GLU . 23.1 p -76.54 -30.1 56.98 Favored 'General case' 0 C--O 1.197 -1.708 0 C-N-CA 119.514 -0.874 . . . . 6.07 109.47 177.111 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 65.0 ttt180 -56.61 -58.36 8.4 Favored 'General case' 0 N--CA 1.437 -1.118 0 C-N-CA 124.872 1.269 . . . . 8.11 112.103 177.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -62.26 -33.38 74.51 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 122.315 1.055 . . . . 9.78 109.728 -179.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 21.3 t60 -77.76 -13.38 59.91 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-N 113.933 -1.485 . . . . 9.61 110.75 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -98.24 -47.72 5.35 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 109.617 -0.512 . . . . 6.53 109.617 178.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -54.57 -37.88 66.01 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 123.757 0.661 . . . . 8.5 111.647 -179.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -87.77 2.71 50.53 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 116.076 -0.511 . . . . 9.9 112.376 -178.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -137.67 -81.9 0.34 Allowed 'General case' 0 C--N 1.343 0.287 0 CA-C-O 120.703 0.287 . . . . 10.62 111.431 -178.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.272 18.6 p80 41.99 62.88 7.18 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 125.381 1.473 . . . . 8.11 114.416 -176.262 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_exo -45.91 -56.52 2.79 Favored 'Trans proline' 0 C--N 1.378 2.089 0 C-N-CA 124.001 3.134 . . . . 7.3 114.031 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -177.39 -23.4 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 111.773 0.286 . . . . 7.81 111.773 -179.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 74.69 103.08 0.07 Allowed 'General case' 0 C--N 1.358 0.977 0 C-N-CA 124.222 1.009 . . . . 4.52 110.834 -179.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -100.18 -85.66 0.4 Allowed 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 114.867 -1.06 . . . . 6.83 111.298 -176.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.3 m -81.85 -15.65 12.15 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.749 0 CA-C-O 121.889 0.852 . . . . 8.44 108.836 176.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 31.8 m -97.34 11.11 5.57 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.827 0 CA-C-N 114.707 -1.133 . . . . 6.03 109.25 177.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.09 -11.26 18.6 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.514 0.673 . . . . 4.71 111.663 176.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . 0.467 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 76.9 m -82.9 -8.28 59.59 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 115.369 -0.832 . . . . 6.16 110.778 177.1 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -165.86 83.57 1.03 Allowed Pre-proline 0 C--N 1.32 -0.717 0 N-CA-C 107.734 -1.21 . . . . 6.08 107.734 171.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -58.08 1.73 0.22 Allowed 'Trans proline' 0 N--CA 1.498 1.755 0 C-N-CA 123.785 2.99 . . . . 3.27 116.487 -173.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 67.1 m-70 -88.73 -7.42 56.32 Favored 'General case' 0 CA--C 1.499 -0.984 0 C-N-CA 120.217 -0.593 . . . . 4.77 112.12 178.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 45.6 mt . . . . . 0 C--N 1.303 -1.446 0 C-N-CA 119.749 -0.78 . . . . 5.47 109.265 -178.667 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.853 0 N-CA-C 110.226 -1.15 . . . . 19.39 110.226 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 12.2 p80 -153.23 16.43 0.54 Allowed 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 117.983 0.892 . . . . 20.25 113.125 -179.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 34.9 t60 -174.7 -41.33 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 109.678 -0.49 . . . . 18.12 109.678 178.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 60.7 t60 -167.52 169.21 12.27 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 104.737 -2.32 . . . . 14.86 104.737 177.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -62.98 -70.81 0.19 Allowed 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 118.991 0.814 . . . . 14.68 112.581 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 21.8 m170 -117.48 178.26 4.45 Favored 'General case' 0 C--O 1.243 0.713 0 N-CA-C 113.164 0.802 . . . . 14.28 113.164 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 56.0 m80 -137.53 103.24 4.99 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-N 115.16 -0.927 . . . . 10.72 108.845 179.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 53.6 tp 64.24 97.78 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.886 0 O-C-N 124.568 1.168 . . . . 10.4 112.154 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -86.68 -27.38 23.78 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 115.252 -0.885 . . . . 11.87 109.236 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 126.37 -41.58 1.62 Allowed Glycine 0 C--O 1.217 -0.912 0 C-N-CA 120.936 -0.649 . . . . 10.09 111.935 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -173.19 -164.93 29.33 Favored Glycine 0 N--CA 1.439 -1.13 0 C-N-CA 120.911 -0.662 . . . . 8.45 111.823 -178.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 146.98 -93.9 0.16 Allowed Glycine 0 N--CA 1.422 -2.273 0 N-CA-C 110.63 -0.988 . . . . 9.5 110.63 -178.702 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 7.0 t30 60.87 97.63 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.419 1.088 . . . . 10.0 112.228 -177.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -157.87 174.3 15.49 Favored 'General case' 0 C--N 1.311 -1.082 0 N-CA-C 108.309 -0.997 . . . . 11.12 108.309 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 29.1 pt20 -58.8 -34.81 71.91 Favored 'General case' 0 CA--C 1.558 1.253 0 CA-C-O 121.491 0.663 . . . . 15.84 111.444 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -88.27 21.24 2.9 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.014 -0.539 . . . . 15.7 110.914 -178.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 27.8 t -97.43 -18.77 18.87 Favored 'General case' 0 C--N 1.311 -1.103 0 O-C-N 121.814 -0.554 . . . . 11.31 111.402 -178.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -42.88 -34.91 1.04 Allowed 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 115.788 1.773 . . . . 13.54 115.788 -173.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 64.4 mtm -124.45 -40.09 2.26 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 121.635 -0.666 . . . . 14.44 112.059 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.65 -46.06 84.1 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.271 -0.422 . . . . 10.19 112.013 -177.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.96 24.99 10.51 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 122.914 0.486 . . . . 10.91 111.107 -176.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.16 -33.14 70.56 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-O 122.024 0.916 . . . . 9.53 111.327 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm -91.27 3.08 55.75 Favored 'General case' 0 CA--C 1.481 -1.692 0 CA-C-N 115.71 -0.677 . . . . 11.55 111.339 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -85.82 -53.69 4.97 Favored 'General case' 0 N--CA 1.416 -2.173 0 C-N-CA 118.424 -1.31 . . . . 6.8 108.28 -178.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 49.1 tp -178.04 114.01 0.08 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.281 -0.872 . . . . 7.19 110.616 178.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -112.85 -16.91 12.63 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-N 115.699 -0.682 . . . . 7.7 109.453 174.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 52.0 mttp 64.29 -85.19 0.02 OUTLIER 'General case' 0 C--N 1.352 0.716 0 CA-C-N 115.895 -0.593 . . . . 9.24 110.773 -170.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 164.12 -56.65 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 125.844 1.658 . . . . 6.55 108.012 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 35.3 mtmm -113.95 140.77 48.13 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 114.634 -1.166 . . . . 10.38 109.898 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.46 -19.08 64.54 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 112.832 0.678 . . . . 7.72 112.832 -175.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -135.8 -66.49 0.56 Allowed 'General case' 0 C--N 1.299 -1.59 0 CA-C-O 121.345 0.593 . . . . 8.49 109.916 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 157.83 -128.86 2.19 Favored Glycine 0 N--CA 1.422 -2.26 0 N-CA-C 110.737 -0.945 . . . . 7.69 110.737 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -155.66 -34.64 0.09 Allowed 'General case' 0 C--N 1.297 -1.674 0 N-CA-C 108.595 -0.891 . . . . 9.15 108.595 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 163.87 -154.43 25.31 Favored Glycine 0 N--CA 1.418 -2.506 0 N-CA-C 107.984 -2.046 . . . . 8.66 107.984 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.463 ' HA ' ' HG3' ' A' ' 38' ' ' GLU . 32.2 t 69.85 88.57 0.11 Allowed 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 123.634 0.773 . . . . 9.53 112.14 177.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.452 ' C ' ' H ' ' A' ' 38' ' ' GLU . 18.1 tm0? -132.4 124.15 28.11 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 105.701 -1.963 . . . . 12.43 105.701 178.207 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 49.1 tp 69.73 -3.81 1.59 Allowed 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 124.065 0.946 . . . . 10.35 110.913 -176.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.463 ' HG3' ' HA ' ' A' ' 35' ' ' SER . 6.8 mm-40 -73.73 170.44 15.26 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 125.507 1.523 . . . . 7.86 111.35 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -89.99 168.88 11.67 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.468 -0.787 . . . . 6.22 109.024 178.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -62.86 113.48 3.08 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.985 0.898 . . . . 7.34 111.909 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -117.32 17.97 14.54 Favored 'General case' 0 N--CA 1.427 -1.623 0 CA-C-O 121.543 0.687 . . . . 8.26 109.996 -177.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.1 8.33 18.45 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 108.844 -0.799 . . . . 8.58 108.844 177.036 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -85.62 -5.69 59.24 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.353 -0.84 . . . . 6.63 111.78 -175.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 65.7 mtt 67.71 79.1 0.23 Allowed 'General case' 0 N--CA 1.465 0.296 0 O-C-N 124.08 0.862 . . . . 7.93 109.062 -174.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.8 p -71.95 -87.33 0.02 OUTLIER 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 115.308 1.595 . . . . 4.16 115.308 -176.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.511 ' O ' ' HA ' ' A' ' 54' ' ' THR . 80.6 mt -131.62 124.6 54.5 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.739 0 CA-C-N 116.036 -0.529 . . . . 3.76 110.641 -175.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.727 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 39.7 tt0 -86.49 137.46 32.52 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.149 0.5 . . . . 7.28 110.078 177.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.596 ' SG ' HG23 ' A' ' 50' ' ' VAL . 42.4 t -77.76 130.7 37.06 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 115.015 -0.993 . . . . 5.75 111.17 178.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.54 ' HD2' ' O ' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -58.51 -27.99 65.0 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-N 113.593 -1.639 . . . . 5.98 111.124 -178.092 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.596 HG23 ' SG ' ' A' ' 48' ' ' CYS . 8.1 m -61.19 -31.29 49.75 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 N-CA-C 112.084 0.402 . . . . 7.94 112.084 -176.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.8 t -161.37 -82.01 0.04 OUTLIER 'General case' 0 N--CA 1.44 -0.96 0 CA-C-O 120.779 0.323 . . . . 9.38 110.863 -179.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 37.6 tpp -164.38 22.1 0.06 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 121.568 0.699 . . . . 9.71 109.267 -175.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.727 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 20.7 mm-40 -84.09 -167.81 1.9 Allowed 'General case' 0 CA--C 1.492 -1.282 0 C-N-CA 120.436 -0.506 . . . . 9.17 109.946 -171.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.511 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 11.3 t -141.46 161.08 38.78 Favored 'General case' 0 N--CA 1.419 -2.002 0 C-N-CA 118.521 -1.271 . . . . 6.39 112.833 -175.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.42 ' CE2' ' HB2' ' A' ' 48' ' ' CYS . 87.3 m-85 -140.04 153.18 46.72 Favored 'General case' 0 N--CA 1.436 -1.15 0 C-N-CA 126.732 2.013 . . . . 5.78 107.55 178.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 6.9 tp -73.39 136.13 26.11 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.473 0 CA-C-O 121.218 0.532 . . . . 5.53 112.081 -177.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 53.8 t -78.27 74.13 4.81 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-O 121.48 0.657 . . . . 4.52 110.443 176.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.3 m -87.03 -5.71 58.98 Favored 'General case' 0 N--CA 1.428 -1.547 0 N-CA-C 107.77 -1.196 . . . . 6.29 107.77 171.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 92.2 m -148.18 138.7 22.88 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 107.805 -1.183 . . . . 6.33 107.805 178.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.3 p -71.36 -81.38 0.05 Allowed 'General case' 0 CA--C 1.55 0.954 0 O-C-N 123.523 0.514 . . . . 6.87 112.074 -177.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.85 ' HA ' ' SG ' ' A' ' 64' ' ' CYS . 42.8 tt0 178.99 -36.13 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.047 0 C-N-CA 124.873 1.269 . . . . 4.86 108.237 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.455 ' O ' ' HB3' ' A' ' 65' ' ' ARG . 80.8 t -70.49 -37.57 70.66 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 C-N-CA 120.569 -0.452 . . . . 7.56 110.865 175.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.588 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 1.0 OUTLIER -72.81 -26.68 61.59 Favored 'General case' 0 CA--C 1.553 1.079 0 N-CA-C 108.924 -0.769 . . . . 9.7 108.924 178.439 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . 0.85 ' SG ' ' HA ' ' A' ' 61' ' ' GLU . 28.9 p -82.71 -25.26 33.1 Favored 'General case' 0 C--O 1.205 -1.248 0 C-N-CA 118.634 -1.226 . . . . 6.07 110.26 176.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.455 ' HB3' ' O ' ' A' ' 62' ' ' VAL . 68.0 ttt180 -57.62 -47.71 81.45 Favored 'General case' 0 N--CA 1.441 -0.913 0 C-N-CA 123.869 0.867 . . . . 8.11 110.665 174.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -65.74 -35.62 81.25 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.496 0.665 . . . . 9.78 110.069 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -74.06 -24.14 59.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.733 -0.667 . . . . 9.61 111.066 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.604 ' HB3' ' N ' ' A' ' 86' ' ' LYS . . . -74.79 -56.81 4.39 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-N 115.891 -0.595 . . . . 6.53 110.617 -177.007 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.45 ' OE1' ' HD2' ' A' ' 86' ' ' LYS . 5.5 mm-40 -58.52 -34.51 71.05 Favored 'General case' 0 C--N 1.317 -0.813 0 O-C-N 123.751 0.657 . . . . 8.5 111.561 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -77.26 -12.45 59.95 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 115.118 -0.946 . . . . 9.9 112.568 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm -132.58 -84.57 0.48 Allowed 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 112.866 0.691 . . . . 10.62 112.866 -176.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.614 ' HB3' ' N ' ' A' ' 86' ' ' LYS . 25.6 p80 42.49 60.26 9.91 Favored Pre-proline 0 N--CA 1.479 1.015 0 N-CA-C 113.97 1.1 . . . . 8.11 113.97 -175.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.44 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 24.9 Cg_exo -64.7 -60.65 0.13 Allowed 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.143 1.895 . . . . 7.3 111.412 -178.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 23.5 pttm -165.21 20.41 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.183 -0.462 . . . . 7.81 110.701 -179.542 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.517 ' HA ' ' CG2' ' A' ' 78' ' ' VAL . . . 64.07 -82.3 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.594 -0.73 . . . . 4.52 109.254 -172.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.4 t70 53.78 -88.43 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.538 1.135 . . . . 6.83 113.693 175.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.7 m -73.35 -24.01 20.14 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.05 0 N-CA-C 109.585 -0.524 . . . . 8.44 109.585 177.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.517 ' CG2' ' HA ' ' A' ' 75' ' ' ALA . 19.0 m -104.43 13.96 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.376 0 CA-C-N 115.872 -0.603 . . . . 6.03 110.439 176.498 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.35 -14.58 62.64 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 121.484 0.659 . . . . 4.71 110.153 177.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 82.5 m -76.8 -19.65 57.32 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 114.908 -1.042 . . . . 6.16 110.491 177.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.601 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 34.4 t80 -155.58 83.97 3.55 Favored Pre-proline 0 N--CA 1.447 -0.615 0 N-CA-C 107.353 -1.351 . . . . 6.08 107.353 176.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -63.19 3.44 0.58 Allowed 'Trans proline' 0 C--O 1.197 -1.552 0 C-N-CA 123.676 2.917 . . . . 3.27 115.312 -172.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 66.6 m-70 -72.73 -8.44 55.43 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 119.177 0.899 . . . . 4.77 110.842 174.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 81' ' ' PHE . 11.0 mt -94.92 2.4 55.39 Favored 'General case' 0 N--CA 1.416 -2.155 0 N-CA-C 107.15 -1.426 . . . . 5.47 107.15 -178.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.675 ' HD3' ' O ' ' A' ' 85' ' ' LYS . 2.3 tmtm? -141.46 105.16 4.71 Favored 'General case' 0 CA--C 1.558 1.259 0 C-N-CA 124.773 1.229 . . . . 8.41 112.579 179.235 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.614 ' N ' ' HB3' ' A' ' 72' ' ' HIS . 16.9 tptp . . . . . 0 N--CA 1.498 1.964 0 CA-C-O 118.758 -0.639 . . . . 11.5 112.652 178.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.207 -1.556 0 N-CA-C 112.041 -0.424 . . . . 19.39 112.041 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -110.74 179.23 4.12 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 117.047 0.424 . . . . 20.25 109.86 -177.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 50.3 m80 -97.51 -56.35 2.55 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 112.256 0.465 . . . . 18.12 112.256 -177.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 41.1 t60 -132.37 119.0 20.11 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.562 0.696 . . . . 14.86 110.232 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -88.91 102.98 15.59 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.272 -0.876 . . . . 14.68 110.844 -179.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.0 p-80 -80.31 158.17 26.18 Favored 'General case' 0 C--O 1.244 0.779 0 N-CA-C 109.667 -0.494 . . . . 14.28 109.667 177.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -145.55 154.0 41.71 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 118.988 -0.53 . . . . 10.72 109.87 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 tm? 73.85 -68.31 0.23 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 124.31 1.006 . . . . 10.4 109.218 -178.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -85.48 100.17 11.71 Favored 'General case' 0 N--CA 1.433 -1.288 0 CA-C-O 121.853 0.835 . . . . 11.87 110.054 178.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.01 131.33 7.26 Favored Glycine 0 N--CA 1.42 -2.379 0 CA-C-N 114.275 -1.329 . . . . 10.09 111.079 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -138.37 -139.74 3.89 Favored Glycine 0 N--CA 1.429 -1.803 0 C-N-CA 119.981 -1.104 . . . . 8.45 111.794 -178.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 156.31 -69.47 0.28 Allowed Glycine 0 N--CA 1.438 -1.219 0 N-CA-C 109.968 -1.253 . . . . 9.5 109.968 -178.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 13.8 m120 72.63 147.25 0.08 Allowed 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 124.199 1.0 . . . . 10.0 112.049 179.199 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -169.91 -74.35 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.819 0 CA-C-O 121.015 0.436 . . . . 11.12 111.583 -178.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -114.0 137.34 51.83 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.05 -0.523 . . . . 15.84 110.601 -178.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.489 ' HA ' ' HE3' ' A' ' 16' ' ' LYS . 0.0 OUTLIER 68.04 -10.97 0.38 Allowed 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 123.996 0.918 . . . . 15.7 112.883 176.936 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 21.5 p -77.86 31.82 0.17 Allowed 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 113.56 0.948 . . . . 11.31 113.56 -176.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.04 -43.5 87.34 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 122.94 0.496 . . . . 13.54 111.073 -179.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 22.7 ptp -93.67 -19.43 21.13 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.092 0.472 . . . . 14.44 110.228 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.15 -33.77 73.94 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.562 -0.745 . . . . 10.19 111.134 -177.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.5 ptp180 -59.47 -28.98 67.49 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 111.727 0.269 . . . . 10.91 111.727 179.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -78.52 6.57 8.31 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 121.351 0.596 . . . . 9.53 111.015 -178.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -131.08 -0.46 4.13 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 108.627 -0.879 . . . . 11.55 108.627 175.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -109.55 -72.65 0.71 Allowed 'General case' 0 N--CA 1.435 -1.193 0 C-N-CA 119.635 -0.826 . . . . 6.8 111.571 -176.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 95.7 mt -142.31 127.4 18.5 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 116.202 -0.453 . . . . 7.19 110.358 -176.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -138.22 135.84 35.98 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 109.485 -0.561 . . . . 7.7 109.485 179.677 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -127.42 105.26 8.39 Favored 'General case' 0 N--CA 1.433 -1.298 0 N-CA-C 108.751 -0.833 . . . . 9.24 108.751 178.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.436 ' C ' ' HD2' ' A' ' 29' ' ' LYS . . . -127.74 -54.8 1.32 Allowed 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 108.962 -0.755 . . . . 6.55 108.962 176.596 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.436 ' HD2' ' C ' ' A' ' 28' ' ' ALA . 13.2 mptt -129.21 168.01 16.8 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.897 -0.592 . . . . 10.38 109.734 173.652 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.81 -27.99 62.3 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.014 0.435 . . . . 7.72 111.771 -178.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -155.85 -69.41 0.11 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.19 -0.459 . . . . 8.49 110.482 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 84.46 -66.11 3.95 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.941 -0.647 . . . . 7.69 111.498 179.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -162.47 168.79 21.43 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 108.232 -1.025 . . . . 9.15 108.232 179.153 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -132.93 -117.49 1.83 Allowed Glycine 0 N--CA 1.431 -1.651 0 N-CA-C 110.899 -0.88 . . . . 8.66 110.899 178.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 82.3 p 59.16 -166.56 0.17 Allowed 'General case' 0 CA--C 1.557 1.215 0 C-N-CA 125.144 1.378 . . . . 9.53 112.654 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -177.38 -33.47 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.313 0 CA-C-O 121.54 0.686 . . . . 12.43 109.531 -177.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.3 pp -79.23 10.23 3.84 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 113.992 1.108 . . . . 10.35 113.992 -179.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.407 ' HB2' ' HZ1' ' A' ' 41' ' ' LYS . 8.4 pt-20 -77.27 -20.05 55.65 Favored 'General case' 0 C--N 1.31 -1.126 0 C-N-CA 120.71 -0.396 . . . . 7.86 111.79 -177.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 70.35 -82.14 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.669 1.188 . . . . 6.22 112.464 -178.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 38.2 t30 -168.2 134.32 1.94 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.771 0.32 . . . . 7.34 110.181 -178.443 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.431 ' O ' ' HB2' ' A' ' 42' ' ' LYS . 48.3 mmtm -90.78 -32.65 16.03 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.166 -0.47 . . . . 8.26 110.324 -178.257 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.431 ' HB2' ' O ' ' A' ' 41' ' ' LYS . 30.4 mtpp 67.73 102.21 0.05 Allowed 'General case' 0 C--N 1.368 1.376 0 O-C-N 124.325 1.016 . . . . 8.58 110.582 -173.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . 68.97 9.1 7.23 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.752 0.821 . . . . 6.63 111.983 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 28.0 ttt 69.37 7.52 6.27 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 124.041 0.937 . . . . 7.93 112.128 177.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.472 ' HB3' ' O ' ' A' ' 55' ' ' PHE . 41.2 t 56.16 -96.78 0.07 Allowed 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.971 1.1 . . . . 4.16 113.971 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.463 HG13 ' OG ' ' A' ' 45' ' ' SER . 14.4 mt -124.67 160.96 28.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 C-N-CA 123.395 0.678 . . . . 3.76 109.989 -176.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.676 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 7.5 tt0 -120.11 131.22 54.97 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 123.227 0.611 . . . . 7.28 109.399 177.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.599 ' SG ' ' HB3' ' A' ' 80' ' ' CYS . 21.3 t -68.83 134.51 49.77 Favored 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 124.238 1.015 . . . . 5.75 111.91 -177.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.453 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -62.68 -29.35 70.58 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.82 1.648 . . . . 5.98 109.806 -177.731 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.593 HG23 ' SG ' ' A' ' 48' ' ' CYS . 11.6 m -62.14 -25.5 37.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.164 -0.471 . . . . 7.94 112.169 -174.243 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.462 ' SG ' ' HG2' ' A' ' 52' ' ' MET . 47.6 t -169.26 -77.2 0.02 OUTLIER 'General case' 0 N--CA 1.438 -1.032 0 O-C-N 123.406 0.442 . . . . 9.38 110.776 179.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.462 ' HG2' ' SG ' ' A' ' 51' ' ' CYS . 19.8 ptm -169.41 32.28 0.02 OUTLIER 'General case' 0 C--O 1.21 -1.025 0 CA-C-N 116.273 -0.421 . . . . 9.71 111.732 -176.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.676 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 17.2 mm-40 -90.82 -166.14 1.51 Allowed 'General case' 0 C--O 1.205 -1.276 0 N-CA-C 108.924 -0.769 . . . . 9.17 108.924 -173.496 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.8 t -135.99 167.39 21.31 Favored 'General case' 0 C--N 1.289 -2.031 0 C-N-CA 118.442 -1.303 . . . . 6.39 112.277 -175.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.472 ' O ' ' HB3' ' A' ' 45' ' ' SER . 89.5 m-85 -135.17 153.61 51.91 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 106.095 -1.817 . . . . 5.78 106.095 175.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 7.9 tp -83.81 133.67 28.67 Favored 'Isoleucine or valine' 0 C--O 1.251 1.145 0 O-C-N 123.644 0.59 . . . . 5.53 110.929 -177.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 49.0 t -71.6 74.4 0.8 Allowed 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 121.633 0.73 . . . . 4.52 112.217 176.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 18.0 p -82.11 -3.77 55.48 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 109.158 -0.682 . . . . 6.29 109.158 169.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 87.3 m -161.66 149.83 15.22 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.009 -1.478 . . . . 6.33 107.009 178.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.0 t -79.71 139.92 37.16 Favored 'General case' 0 N--CA 1.419 -1.983 0 N-CA-C 106.981 -1.489 . . . . 6.87 106.981 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -53.25 -32.91 50.74 Favored 'General case' 0 C--O 1.206 -1.218 0 O-C-N 123.826 0.704 . . . . 4.86 110.534 -178.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.452 ' O ' ' HB3' ' A' ' 65' ' ' ARG . 67.7 t -62.09 -31.8 52.5 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.096 0 N-CA-C 112.832 0.678 . . . . 7.56 112.832 -177.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.593 ' O ' ' HD2' ' A' ' 63' ' ' LYS . 1.0 OUTLIER -79.85 -35.88 37.56 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 118.171 -1.411 . . . . 9.7 107.338 179.216 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 69.1 m -67.15 -27.88 67.67 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 109.123 -0.695 . . . . 6.07 109.123 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.452 ' HB3' ' O ' ' A' ' 62' ' ' VAL . 72.7 ttt180 -60.61 -54.85 40.38 Favored 'General case' 0 N--CA 1.426 -1.666 0 C-N-CA 124.607 1.163 . . . . 8.11 112.17 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -63.68 -33.84 76.52 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-O 121.079 0.466 . . . . 9.78 110.39 -178.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -70.73 -37.36 73.47 Favored 'General case' 0 N--CA 1.438 -1.031 0 N-CA-C 109.167 -0.679 . . . . 9.61 109.167 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.72 -48.39 54.82 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-N 115.954 -0.567 . . . . 6.53 111.878 -178.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -71.73 -17.98 62.17 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.509 0.559 . . . . 8.5 112.509 -176.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -93.7 -18.17 22.42 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 116.417 -0.356 . . . . 9.9 111.28 176.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -118.27 -81.01 0.62 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.784 0.29 . . . . 10.62 111.784 -178.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.483 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 30.8 p80 44.47 54.21 11.99 Favored Pre-proline 0 N--CA 1.498 1.934 0 N-CA-C 114.449 1.277 . . . . 8.11 114.449 -178.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.483 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 5.3 Cg_exo -75.59 -58.87 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.126 0 C-N-CA 121.686 1.591 . . . . 7.3 113.17 -178.435 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -159.73 104.91 1.59 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.487 0.661 . . . . 7.81 112.066 -175.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.74 113.15 21.7 Favored 'General case' 0 C--N 1.292 -1.896 0 CA-C-N 116.057 -0.52 . . . . 4.52 109.788 175.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -115.12 -76.79 0.57 Allowed 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 111.89 0.33 . . . . 6.83 111.89 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 28.2 m -73.81 -18.94 17.57 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.743 0 CA-C-O 122.368 1.08 . . . . 8.44 108.977 176.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 35.5 m -105.59 15.83 6.71 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.37 0 CA-C-N 114.359 -1.292 . . . . 6.03 109.803 175.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.58 -15.89 59.33 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-O 121.905 0.859 . . . . 4.71 110.018 175.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.599 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 64.4 m -67.59 -16.78 64.36 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 114.285 -1.325 . . . . 6.16 110.49 176.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.485 ' CE2' ' HB2' ' A' ' 83' ' ' HIS . 14.2 t80 -167.85 89.32 0.69 Allowed Pre-proline 0 N--CA 1.444 -0.771 0 N-CA-C 108.052 -1.092 . . . . 6.08 108.052 171.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -63.91 3.91 0.63 Allowed 'Trans proline' 0 N--CA 1.505 2.206 0 C-N-CA 124.087 3.192 . . . . 3.27 114.504 -173.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.485 ' HB2' ' CE2' ' A' ' 81' ' ' PHE . 13.2 m-70 -88.92 -0.67 57.6 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 109.258 -0.645 . . . . 4.77 109.258 177.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 49.0 mt -109.5 8.11 25.05 Favored 'General case' 0 C--N 1.344 0.327 0 CA-C-N 116.413 -0.358 . . . . 5.47 111.748 -177.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.2 mmmt -67.61 155.93 37.99 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-O 122.259 1.028 . . . . 8.41 113.694 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 23.0 tptm . . . . . 0 C--N 1.292 -1.897 0 CA-C-N 112.988 -1.915 . . . . 11.5 109.227 -178.651 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.729 0 N-CA-C 110.945 -0.862 . . . . 19.39 110.945 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 14.6 t-80 -113.51 -48.72 2.93 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 117.09 0.445 . . . . 20.25 111.238 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 11.0 t-160 -108.19 127.9 54.23 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 109.343 -0.614 . . . . 18.12 109.343 -179.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -65.82 152.39 44.49 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 120.915 0.388 . . . . 14.86 111.456 -179.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 45.3 m80 -125.29 152.63 44.41 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 109.25 -0.648 . . . . 14.68 109.25 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.5 p80 -74.33 141.65 45.2 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 120.738 -0.385 . . . . 14.28 110.977 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 60.5 m80 -128.61 156.19 43.78 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 116.419 -0.355 . . . . 10.72 110.24 -177.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 49.6 tp 72.84 153.93 0.14 Allowed 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.583 1.153 . . . . 10.4 112.163 177.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 64.98 19.28 11.82 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.081 1.352 . . . . 11.87 109.24 178.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -176.38 171.84 44.82 Favored Glycine 0 N--CA 1.426 -1.981 0 N-CA-C 109.279 -1.529 . . . . 10.09 109.279 -178.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 156.8 -37.0 0.57 Allowed Glycine 0 C--O 1.216 -0.97 0 N-CA-C 111.27 -0.732 . . . . 8.45 111.27 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 113.16 -14.03 23.63 Favored Glycine 0 N--CA 1.443 -0.881 0 C-N-CA 120.404 -0.903 . . . . 9.5 112.765 178.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 15.2 m120 67.06 -170.65 0.19 Allowed 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.316 0.646 . . . . 10.0 110.473 179.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -167.05 -103.09 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 122.619 0.368 . . . . 11.12 111.565 178.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -107.97 -72.25 0.73 Allowed 'General case' 0 C--O 1.217 -0.611 0 CA-C-O 121.479 0.657 . . . . 15.84 110.612 -177.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -81.46 3.65 23.9 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-O 121.902 0.858 . . . . 15.7 110.508 -177.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 19.2 m -81.17 16.94 1.38 Allowed 'General case' 0 N--CA 1.428 -1.54 0 CA-C-N 114.888 -1.051 . . . . 11.31 110.526 -178.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.49 -24.32 60.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.342 -0.39 . . . . 13.54 110.532 178.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 23.1 ptp -160.91 -28.82 0.06 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.097 -0.501 . . . . 14.44 111.941 179.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.97 -45.77 87.61 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 120.292 -0.563 . . . . 10.19 109.483 178.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 69.5 mtp180 -137.38 72.69 1.42 Allowed 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.429 -0.805 . . . . 10.91 109.175 175.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.96 120.31 22.64 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.4 -0.592 . . . . 9.53 109.4 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.307 7.1 ptpp? 45.81 74.58 0.13 Allowed 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.4 1.259 . . . . 11.55 114.4 -175.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -148.09 151.77 36.21 Favored 'General case' 0 N--CA 1.411 -2.391 0 CA-C-N 115.467 -0.788 . . . . 6.8 109.403 -178.532 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 53.3 tp -135.29 -79.6 0.43 Allowed 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 108.858 -0.793 . . . . 7.19 108.858 177.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -117.74 173.06 6.96 Favored 'General case' 0 C--O 1.244 0.77 0 N-CA-C 108.368 -0.975 . . . . 7.7 108.368 177.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -116.93 104.78 11.63 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.178 -0.675 . . . . 9.24 109.178 177.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -160.32 176.6 11.51 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.795 -0.446 . . . . 6.55 109.795 -177.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -72.33 111.46 7.55 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.198 0.523 . . . . 10.38 111.679 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -148.92 166.61 28.07 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-N 115.954 -0.566 . . . . 7.72 109.802 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.64 -18.96 26.87 Favored 'General case' 0 C--O 1.245 0.825 0 CA-C-N 115.8 -0.636 . . . . 8.49 110.795 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 64.41 -114.97 7.3 Favored Glycine 0 C--N 1.339 0.723 0 CA-C-N 115.408 -0.814 . . . . 7.69 111.53 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm 72.9 -53.92 0.7 Allowed 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 125.478 1.511 . . . . 9.15 113.584 175.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 104.97 103.08 2.83 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 121.39 -0.434 . . . . 8.66 112.641 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.9 t -168.86 135.22 1.78 Allowed 'General case' 0 C--O 1.248 1.026 0 N-CA-C 108.996 -0.742 . . . . 9.53 108.996 179.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -153.22 142.23 21.28 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.638 -0.505 . . . . 12.43 109.638 178.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.3 mp 70.49 -45.25 0.59 Allowed 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 124.93 1.292 . . . . 10.35 113.552 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -72.26 -67.12 0.57 Allowed 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 123.591 0.756 . . . . 7.86 110.984 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 67.44 14.13 9.53 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.242 1.017 . . . . 6.22 112.431 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 53.9 m-80 -77.76 123.18 26.37 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.772 -0.195 . . . . 7.34 111.347 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -139.98 20.16 2.46 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 122.712 1.244 . . . . 8.26 108.698 178.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -69.47 153.26 43.79 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 115.091 -0.959 . . . . 8.58 110.104 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . 66.76 9.56 6.82 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.01 0.924 . . . . 6.63 113.022 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 65.8 mtt 72.32 16.78 5.0 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.303 0.641 . . . . 7.93 112.273 178.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.5 p 51.67 -104.76 0.19 Allowed 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 116.347 1.98 . . . . 4.16 116.347 177.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.422 ' O ' ' HA ' ' A' ' 54' ' ' THR . 59.0 mt -118.35 143.75 28.36 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 N-CA-C 109.657 -0.498 . . . . 3.76 109.657 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.604 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 1.1 tp-100 -112.19 133.82 54.09 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 106.549 -1.648 . . . . 7.28 106.549 178.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.608 ' SG ' HG22 ' A' ' 50' ' ' VAL . 35.7 t -66.28 135.72 54.82 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 124.512 1.125 . . . . 5.75 113.024 -175.545 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.408 ' HD2' ' O ' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -64.31 -26.59 68.55 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.1 1.36 . . . . 5.98 110.168 -178.266 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.608 HG22 ' SG ' ' A' ' 48' ' ' CYS . 5.4 m -66.52 -33.19 61.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 120.843 0.354 . . . . 7.94 111.797 -175.202 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 83.9 m -156.67 -83.11 0.06 Allowed 'General case' 0 N--CA 1.433 -1.318 0 CA-C-N 115.801 -0.636 . . . . 9.38 110.792 -174.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 52.1 ttp 179.9 47.51 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.768 0 N-CA-C 108.471 -0.937 . . . . 9.71 108.471 -178.478 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.604 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 21.2 mm-40 -101.56 -178.29 3.68 Favored 'General case' 0 C--O 1.173 -2.927 0 N-CA-C 107.263 -1.384 . . . . 9.17 107.263 -178.259 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.422 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 9.5 t -125.7 154.12 42.89 Favored 'General case' 0 C--N 1.286 -2.16 0 C-N-CA 117.53 -1.668 . . . . 6.39 113.574 -175.19 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.44 ' HE2' ' SG ' ' A' ' 48' ' ' CYS . 86.7 m-85 -137.59 147.9 45.43 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 113.867 -1.515 . . . . 5.78 107.634 177.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.431 HG13 ' H ' ' A' ' 58' ' ' THR . 9.2 tp -73.7 132.18 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 N-CA-C 109.402 -0.592 . . . . 5.53 109.402 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.426 ' C ' ' H ' ' A' ' 59' ' ' THR . 24.9 p -74.43 -18.98 60.57 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.03 0.381 . . . . 4.52 112.03 -176.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.431 ' H ' HG13 ' A' ' 56' ' ' ILE 0.25 13.6 t 54.34 -4.89 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 127.26 2.224 . . . . 6.29 115.152 177.739 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.426 ' H ' ' C ' ' A' ' 57' ' ' CYS . 87.0 m -155.93 -83.9 0.06 Allowed 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 109.319 -0.623 . . . . 6.33 109.319 178.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 18.0 p -161.2 10.36 0.09 Allowed 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 112.242 0.46 . . . . 6.87 112.242 -178.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.56 ' O ' ' HG3' ' A' ' 65' ' ' ARG . 26.7 tt0 68.51 -52.04 0.56 Allowed 'General case' 0 C--O 1.183 -2.416 0 C-N-CA 124.523 1.129 . . . . 4.86 110.806 -177.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.535 HG12 ' CZ ' ' A' ' 65' ' ' ARG . 35.7 m -55.37 -39.18 51.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 O-C-N 121.354 -0.841 . . . . 7.56 112.77 -178.322 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -60.46 -42.28 95.87 Favored 'General case' 0 C--N 1.306 -1.3 0 CA-C-N 115.357 -0.838 . . . . 9.7 109.496 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . 0.485 ' HG ' HD22 ' A' ' 84' ' ' LEU . 28.5 p -78.19 -31.81 49.71 Favored 'General case' 0 N--CA 1.428 -1.544 0 C-N-CA 119.85 -0.74 . . . . 6.07 109.621 178.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.56 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 22.3 mtm180 -59.68 -50.26 74.56 Favored 'General case' 0 CA--C 1.5 -0.966 0 N-CA-C 111.921 0.341 . . . . 8.11 111.921 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -66.73 -33.79 76.41 Favored 'General case' 0 C--O 1.236 0.366 0 O-C-N 123.741 0.65 . . . . 9.78 111.931 -178.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.437 ' CD2' ' HA ' ' A' ' 86' ' ' LYS . 4.9 t60 -74.39 -30.25 61.87 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 119.696 -0.802 . . . . 9.61 109.463 177.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.527 ' CB ' ' HA ' ' A' ' 83' ' ' HIS . . . -71.14 -46.86 60.7 Favored 'General case' 0 C--O 1.204 -1.333 0 CA-C-N 116.559 -0.291 . . . . 6.53 111.543 179.664 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 10.7 pt-20 -71.65 -11.6 60.92 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.417 0.627 . . . . 8.5 111.432 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.05 -32.06 59.13 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.009 -0.996 . . . . 9.9 109.798 173.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -120.65 -86.48 0.65 Allowed 'General case' 0 C--O 1.216 -0.698 0 CA-C-N 115.763 -0.653 . . . . 10.62 111.191 -177.184 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.483 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 20.4 t-80 45.49 55.58 14.74 Favored Pre-proline 0 CA--C 1.561 1.403 0 C-N-CA 123.85 0.86 . . . . 8.11 112.014 -178.859 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.483 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 34.6 Cg_exo -65.23 -44.93 8.33 Favored 'Trans proline' 0 C--N 1.37 1.661 0 C-N-CA 121.881 1.721 . . . . 7.3 110.341 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.45 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 24.5 pttm -170.03 106.14 0.33 Allowed 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 114.141 -1.391 . . . . 7.81 108.85 177.695 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -67.16 112.77 4.64 Favored 'General case' 0 C--N 1.302 -1.476 0 C-N-CA 119.427 -0.909 . . . . 4.52 109.153 171.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -86.94 -90.75 0.11 Allowed 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 122.003 0.906 . . . . 6.83 110.709 -174.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 28.2 m -89.49 -14.96 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.219 0 N-CA-C 108.546 -0.909 . . . . 8.44 108.546 177.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 24.4 m -87.03 7.44 2.54 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.833 0 CA-C-N 115.019 -0.991 . . . . 6.03 109.047 177.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.33 -2.77 3.38 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-N 115.185 -0.916 . . . . 4.71 112.003 178.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 25.3 p -73.51 -23.22 60.0 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 115.366 -0.833 . . . . 6.16 109.213 174.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.505 ' CE2' ' HB2' ' A' ' 83' ' ' HIS . 31.8 t80 -160.36 88.67 1.81 Allowed Pre-proline 0 N--CA 1.428 -1.528 0 N-CA-C 106.456 -1.683 . . . . 6.08 106.456 170.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -60.01 6.73 0.1 OUTLIER 'Trans proline' 0 N--CA 1.509 2.395 0 C-N-CA 124.435 3.423 . . . . 3.27 115.527 -173.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.527 ' HA ' ' CB ' ' A' ' 68' ' ' ALA . 83.2 m-70 -98.87 5.58 47.28 Favored 'General case' 0 C--N 1.286 -2.163 0 N-CA-C 110.075 -0.343 . . . . 4.77 110.075 177.841 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.485 HD22 ' HG ' ' A' ' 64' ' ' CYS . 74.9 mt -107.98 4.9 25.7 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 111.982 0.364 . . . . 5.47 111.982 -179.256 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.45 ' HE3' ' O ' ' A' ' 74' ' ' LYS . 6.8 mmtt -49.07 -62.15 1.69 Allowed 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 114.456 1.28 . . . . 8.41 114.456 178.448 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.437 ' HA ' ' CD2' ' A' ' 67' ' ' HIS . 61.2 tttm . . . . . 0 CA--C 1.554 1.12 0 N-CA-C 113.197 0.814 . . . . 11.5 113.197 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.933 0 N-CA-C 111.359 -0.696 . . . . 19.39 111.359 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 61.84 16.18 7.74 Favored 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 123.648 0.779 . . . . 20.25 112.722 176.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 43.4 m170 -82.17 85.35 6.81 Favored 'General case' 0 C--O 1.242 0.7 0 O-C-N 121.838 -0.539 . . . . 18.12 110.786 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 42.8 m80 68.58 -177.1 0.21 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.711 0.804 . . . . 14.86 110.279 -177.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 58.2 m80 -117.81 117.91 30.6 Favored 'General case' 0 C--N 1.309 -1.183 0 O-C-N 121.929 -0.482 . . . . 14.68 109.769 179.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -137.86 -38.78 0.57 Allowed 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 120.903 0.382 . . . . 14.28 110.994 179.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 34.7 m-70 -142.4 148.54 38.02 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 108.203 -1.036 . . . . 10.72 108.203 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 66.4 tp 68.4 106.8 0.05 Allowed 'General case' 0 N--CA 1.479 1.013 0 O-C-N 124.865 1.353 . . . . 10.4 113.571 175.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -121.5 -71.34 0.74 Allowed 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.378 -0.971 . . . . 11.87 108.378 173.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 179.99 76.07 0.06 OUTLIER Glycine 0 N--CA 1.437 -1.298 0 CA-C-N 115.579 -0.737 . . . . 10.09 111.384 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -79.57 -56.83 3.26 Favored Glycine 0 C--O 1.217 -0.929 0 C-N-CA 120.644 -0.788 . . . . 8.45 111.803 178.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 85.17 -38.06 2.99 Favored Glycine 0 C--O 1.22 -0.726 0 C-N-CA 121.108 -0.567 . . . . 9.5 112.861 177.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 75.65 94.99 0.07 Allowed 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.177 1.391 . . . . 10.0 110.738 -177.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.479 ' H ' ' HB1' ' A' ' 20' ' ' ALA . . . -109.62 -167.12 1.16 Allowed 'General case' 0 C--O 1.25 1.118 0 CA-C-N 115.194 -0.912 . . . . 11.12 111.146 -178.483 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -48.28 150.03 1.37 Allowed 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.931 1.292 . . . . 15.84 112.948 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? 74.74 -43.57 0.52 Allowed 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.486 1.115 . . . . 15.7 111.411 -175.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 66.0 m 63.05 7.3 2.64 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.792 0.837 . . . . 11.31 112.535 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -87.35 -71.4 0.56 Allowed 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 108.716 -0.846 . . . . 13.54 108.716 176.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 51.0 ttm -78.5 -17.48 56.19 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.43 -0.805 . . . . 14.44 109.586 178.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.479 ' HB1' ' H ' ' A' ' 14' ' ' ALA . . . -77.59 5.02 9.94 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.948 0.721 . . . . 10.19 112.948 -175.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 68.4 mtt180 -107.03 -45.34 4.17 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-O 119.497 -0.287 . . . . 10.91 110.416 176.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 55.38 28.31 11.31 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 113.477 0.917 . . . . 9.53 113.477 174.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt 68.52 14.73 9.12 Favored 'General case' 0 C--N 1.353 0.723 0 C-N-CA 124.708 1.203 . . . . 11.55 110.429 -179.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -77.78 -21.38 51.75 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.377 0.608 . . . . 6.8 109.717 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 95.3 mt -135.92 179.69 6.19 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-N 115.527 -0.761 . . . . 7.19 110.731 -176.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -84.24 -170.04 2.9 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.235 -0.893 . . . . 7.7 110.094 -179.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -91.62 144.07 25.92 Favored 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 107.921 -1.14 . . . . 9.24 107.921 176.112 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -94.66 -3.87 48.65 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.771 -0.372 . . . . 6.55 111.747 -179.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.45 ' HB2' ' HZ1' ' A' ' 29' ' ' LYS . 0.2 OUTLIER -172.59 150.15 2.18 Favored 'General case' 0 N--CA 1.437 -1.097 0 N-CA-C 106.9 -1.518 . . . . 10.38 106.9 -178.627 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -150.77 -40.34 0.13 Allowed 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.737 -0.385 . . . . 7.72 111.778 179.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -93.29 158.47 15.73 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 120.776 0.322 . . . . 8.49 111.15 -178.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -137.06 -167.77 11.19 Favored Glycine 0 N--CA 1.438 -1.168 0 N-CA-C 110.602 -0.999 . . . . 7.69 110.602 179.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -61.42 109.83 1.27 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.317 0.579 . . . . 9.15 110.525 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 116.84 -97.93 0.77 Allowed Glycine 0 N--CA 1.426 -2.023 0 N-CA-C 109.909 -1.276 . . . . 8.66 109.909 -178.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 38.1 m 58.96 -170.94 0.12 Allowed 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.383 0.673 . . . . 9.53 111.798 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -161.72 133.58 5.59 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.466 -0.568 . . . . 12.43 109.466 176.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.1 mt 66.85 14.11 9.68 Favored 'General case' 0 N--CA 1.485 1.301 0 O-C-N 123.98 0.8 . . . . 10.35 112.239 178.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -145.04 149.02 34.36 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 108.361 -0.977 . . . . 7.86 108.361 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 52.76 72.97 0.38 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.724 1.21 . . . . 6.22 113.406 -179.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -87.79 98.99 11.77 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.811 -0.632 . . . . 7.34 111.481 -179.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.555 ' H ' ' HD3' ' A' ' 41' ' ' LYS . 0.2 OUTLIER -56.95 -38.32 72.77 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.137 0.975 . . . . 8.26 111.12 178.944 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 38.1 mtmm 61.93 -82.67 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.053 0 N-CA-C 113.741 1.015 . . . . 8.58 113.741 176.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -85.06 27.65 0.76 Allowed 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 112.634 0.605 . . . . 6.63 112.634 -174.334 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 68.6 mtm 70.28 1.66 3.67 Favored 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 124.305 1.042 . . . . 7.93 113.21 179.01 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 67.1 m 52.0 -92.18 0.03 OUTLIER 'General case' 0 CA--C 1.561 1.387 0 N-CA-C 115.594 1.701 . . . . 4.16 115.594 176.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.507 ' O ' ' HA ' ' A' ' 54' ' ' THR . 66.2 mt -131.86 133.88 60.63 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.209 0 N-CA-C 108.894 -0.78 . . . . 3.76 108.894 -177.305 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.672 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 35.3 tt0 -100.81 138.83 37.34 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 120.918 0.39 . . . . 7.28 110.217 -179.027 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.599 ' SG ' HG11 ' A' ' 50' ' ' VAL . 44.8 t -77.86 143.96 37.37 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.709 -0.678 . . . . 5.75 111.152 178.237 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.414 ' HD2' ' O ' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -57.06 -39.07 74.19 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 126.06 1.744 . . . . 5.98 112.579 -174.37 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.607 HG23 ' SG ' ' A' ' 51' ' ' CYS . 2.1 p -49.0 -51.37 12.78 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 114.74 1.385 . . . . 7.94 114.74 -176.272 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.607 ' SG ' HG23 ' A' ' 50' ' ' VAL . 93.4 m -153.96 -67.73 0.14 Allowed 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 121.093 -0.243 . . . . 9.38 111.302 -173.104 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.434 ' HG3' ' NE2' ' A' ' 47' ' ' GLN . 39.1 ttp -174.86 35.4 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 120.109 -0.636 . . . . 9.71 109.653 -175.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.672 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 13.4 mm-40 -87.47 179.25 6.6 Favored 'General case' 0 CA--C 1.494 -1.199 0 C-N-CA 119.265 -0.974 . . . . 9.17 108.665 -174.371 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.507 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 7.5 t -137.99 154.31 49.35 Favored 'General case' 0 C--N 1.299 -1.597 0 C-N-CA 118.541 -1.264 . . . . 6.39 113.946 -175.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -132.94 151.55 52.04 Favored 'General case' 0 N--CA 1.409 -2.497 0 N-CA-C 105.877 -1.897 . . . . 5.78 105.877 175.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 10.8 tp -75.57 146.32 9.42 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.563 0 N-CA-C 109.459 -0.571 . . . . 5.53 109.459 -177.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 45.1 t -76.95 72.68 3.53 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 121.883 0.849 . . . . 4.52 110.941 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 8.9 t -84.94 -3.2 58.64 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.103 -0.953 . . . . 6.29 110.097 174.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 95.0 m -160.29 140.28 11.36 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 106.721 -1.585 . . . . 6.33 106.721 177.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 35.7 p -75.65 139.32 41.93 Favored 'General case' 0 N--CA 1.42 -1.946 0 N-CA-C 109.396 -0.594 . . . . 6.87 109.396 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.72 ' HA ' ' SG ' ' A' ' 64' ' ' CYS . 14.4 pt-20 -52.53 -35.02 52.56 Favored 'General case' 0 C--O 1.206 -1.184 0 C-N-CA 123.543 0.737 . . . . 4.86 111.824 178.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.418 ' O ' ' HB3' ' A' ' 65' ' ' ARG . 99.4 t -67.16 -38.97 82.12 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.844 0 C-N-CA 123.155 0.582 . . . . 7.56 112.494 178.001 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -73.01 -35.93 66.9 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 121.476 0.655 . . . . 9.7 109.683 -178.111 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . 0.72 ' SG ' ' HA ' ' A' ' 61' ' ' GLU . 1.8 p -74.52 -27.34 60.5 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 115.656 -0.702 . . . . 6.07 111.044 174.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.444 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 54.8 ttt180 -59.68 -52.65 64.58 Favored 'General case' 0 N--CA 1.439 -1.018 0 C-N-CA 123.627 0.771 . . . . 8.11 112.251 178.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -68.98 -30.24 68.61 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.37 -0.532 . . . . 9.78 110.99 -179.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 61.3 t60 -66.96 -37.96 85.22 Favored 'General case' 0 C--O 1.241 0.644 0 CA-C-N 116.158 -0.474 . . . . 9.61 109.805 176.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.25 -42.16 72.55 Favored 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 115.966 -0.561 . . . . 6.53 110.379 178.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 6.0 mm-40 -63.63 -17.95 63.43 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.157 0.503 . . . . 8.5 111.698 -179.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -84.46 -11.3 56.43 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.994 -0.548 . . . . 9.9 111.06 176.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -142.52 -84.83 0.17 Allowed 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.611 0.597 . . . . 10.62 112.611 -177.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.462 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 34.9 p80 41.76 47.81 2.65 Favored Pre-proline 0 N--CA 1.502 2.158 0 C-N-CA 125.357 1.463 . . . . 8.11 114.036 -176.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.462 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 1.3 Cg_endo -73.75 -41.75 1.01 Allowed 'Trans proline' 0 N--CA 1.444 -1.414 0 C-N-CA 121.015 1.143 . . . . 7.3 112.374 -175.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.502 ' HZ2' ' HB2' ' A' ' 74' ' ' LYS . 0.1 OUTLIER -160.53 116.16 2.29 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.48 -0.933 . . . . 7.81 108.48 -179.324 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.497 ' O ' HG21 ' A' ' 78' ' ' VAL . . . -73.05 -51.58 17.58 Favored 'General case' 0 C--N 1.286 -2.187 0 C-N-CA 118.738 -1.185 . . . . 4.52 108.654 173.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.442 ' OD1' HG12 ' A' ' 77' ' ' VAL . 11.3 t70 61.0 -86.5 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 124.111 0.965 . . . . 6.83 113.037 170.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . 0.442 HG12 ' OD1' ' A' ' 76' ' ' ASP . 35.6 m -92.63 -19.32 6.88 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.742 0 CA-C-O 121.166 0.508 . . . . 8.44 109.884 178.247 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.511 ' HB ' ' CE1' ' A' ' 81' ' ' PHE . 21.1 m -102.34 18.39 3.84 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.504 0 N-CA-C 107.973 -1.121 . . . . 6.03 107.973 174.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.48 -11.97 39.15 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-O 121.803 0.811 . . . . 4.71 111.496 178.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.533 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 89.2 m -75.4 -15.56 60.44 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-N 115.135 -0.939 . . . . 6.16 110.025 174.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.576 ' CD1' HD13 ' A' ' 84' ' ' LEU . 11.9 p90 -154.45 69.86 6.03 Favored Pre-proline 0 CA--C 1.563 1.47 0 C-N-CA 124.64 1.176 . . . . 6.08 111.401 178.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -64.22 -17.46 59.8 Favored 'Trans proline' 0 N--CA 1.5 1.854 0 C-N-CA 123.814 3.009 . . . . 3.27 115.375 -172.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -81.48 4.47 21.04 Favored 'General case' 0 C--N 1.31 -1.143 0 C-N-CA 120.549 -0.46 . . . . 4.77 111.601 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.576 HD13 ' CD1' ' A' ' 81' ' ' PHE . 17.0 mt -115.64 4.19 14.07 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 120.391 -0.524 . . . . 5.47 110.687 -177.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.509 ' HD2' ' H ' ' A' ' 86' ' ' LYS . 27.9 tptp -65.08 152.83 42.51 Favored 'General case' 0 C--O 1.244 0.787 0 CA-C-O 122.496 1.141 . . . . 8.41 112.172 -178.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.509 ' H ' ' HD2' ' A' ' 85' ' ' LYS . 22.0 pttp . . . . . 0 C--N 1.283 -2.321 0 N-CA-C 106.204 -1.776 . . . . 11.5 106.204 178.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.934 0 N-CA-C 111.534 -0.626 . . . . 19.39 111.534 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 19.2 p-80 -158.5 137.29 11.21 Favored 'General case' 0 C--O 1.214 -0.765 0 N-CA-C 107.424 -1.325 . . . . 20.25 107.424 176.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -128.68 18.87 6.21 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 119.243 -0.983 . . . . 18.12 112.998 -176.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -135.58 -73.02 0.46 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 119.847 -0.741 . . . . 14.86 112.474 177.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -139.42 -169.94 2.79 Favored 'General case' 0 C--O 1.242 0.697 0 C-N-CA 120.2 -0.6 . . . . 14.68 111.662 -176.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 57.5 m80 -70.73 165.02 23.89 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 124.011 0.819 . . . . 14.28 111.015 179.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.0 p-80 -105.26 163.53 12.53 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 108.74 -0.837 . . . . 10.72 108.74 177.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 58.5 tp 56.81 68.57 0.84 Allowed 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.998 0.904 . . . . 10.4 109.317 -176.455 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -122.93 -68.26 0.9 Allowed 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 114.678 -1.147 . . . . 11.87 108.606 -175.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -118.58 -76.48 0.53 Allowed Glycine 0 N--CA 1.438 -1.215 0 N-CA-C 110.844 -0.902 . . . . 10.09 110.844 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 108.53 164.37 20.86 Favored Glycine 0 CA--C 1.484 -1.876 0 C-N-CA 120.216 -0.992 . . . . 8.45 111.99 179.154 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -139.45 -78.46 0.06 OUTLIER Glycine 0 N--CA 1.425 -2.094 0 C-N-CA 120.341 -0.933 . . . . 9.5 111.35 179.119 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 29.2 p30 -154.94 154.62 32.89 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 112.048 0.388 . . . . 10.0 112.048 -175.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -175.2 129.94 0.29 Allowed 'General case' 0 C--O 1.245 0.854 0 C-N-CA 124.701 1.201 . . . . 11.12 108.275 178.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.508 ' C ' ' H ' ' A' ' 17' ' ' SER 0.363 22.2 mp0 41.33 83.34 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 115.686 1.735 . . . . 15.84 115.686 177.608 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.488 ' HZ3' ' HB2' ' A' ' 16' ' ' LYS . 10.3 mtmp? 71.81 -24.02 0.18 Allowed 'General case' 0 C--O 1.214 -0.783 0 CA-C-N 114.153 -1.385 . . . . 15.7 112.392 -177.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.508 ' H ' ' C ' ' A' ' 15' ' ' GLN . 43.2 p 59.88 1.02 0.29 Allowed 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 126.46 1.904 . . . . 11.31 114.242 178.037 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.432 ' H ' ' C ' ' A' ' 16' ' ' LYS . . . -64.29 -36.44 84.11 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.802 -0.635 . . . . 13.54 109.927 179.475 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 28.0 ttt -155.77 -30.62 0.1 Allowed 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.718 -0.674 . . . . 14.44 111.923 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.29 -19.77 37.35 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 113.037 0.755 . . . . 10.19 113.037 -176.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -66.05 -48.4 71.18 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 120.418 -0.513 . . . . 10.91 111.478 -179.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 46.62 32.2 1.61 Allowed 'General case' 0 N--CA 1.507 2.378 0 N-CA-C 112.906 0.706 . . . . 9.53 112.906 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt 69.4 88.74 0.11 Allowed 'General case' 0 CA--C 1.501 -0.925 0 C-N-CA 124.529 1.132 . . . . 11.55 112.09 -173.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -148.17 147.94 30.01 Favored 'General case' 0 C--N 1.295 -1.802 0 C-N-CA 120.04 -0.664 . . . . 6.8 109.535 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -157.65 114.87 2.99 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 105.948 -1.871 . . . . 7.19 105.948 178.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -108.0 -79.86 0.57 Allowed 'General case' 0 C--N 1.308 -1.2 0 O-C-N 123.644 0.59 . . . . 7.7 110.359 179.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -110.4 -9.32 14.62 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.745 -0.382 . . . . 9.24 112.026 -179.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 61.55 -169.87 0.17 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.732 0.813 . . . . 6.55 111.479 -178.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -94.88 -25.68 16.48 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.954 0.407 . . . . 10.38 110.582 179.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -127.33 113.26 16.03 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.582 -0.281 . . . . 7.72 110.912 -178.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -96.95 -49.32 5.07 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.179 0.514 . . . . 8.49 110.855 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 162.22 -133.5 3.14 Favored Glycine 0 N--CA 1.435 -1.417 0 N-CA-C 111.141 -0.784 . . . . 7.69 111.141 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 11.4 mptt -93.25 -1.77 55.79 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 121.104 0.478 . . . . 9.15 110.203 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 172.82 179.29 43.46 Favored Glycine 0 N--CA 1.425 -2.036 0 N-CA-C 110.212 -1.155 . . . . 8.66 110.212 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.9 m -68.75 -67.19 0.49 Allowed 'General case' 0 C--O 1.248 0.974 0 O-C-N 123.733 0.313 . . . . 9.53 110.925 179.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 177.35 -72.31 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 108.737 -0.838 . . . . 12.43 108.737 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.3 mt -107.35 106.4 16.8 Favored 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 108.022 -1.103 . . . . 10.35 108.022 176.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -146.17 -64.58 0.31 Allowed 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 109.307 -0.627 . . . . 7.86 109.307 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -132.87 179.71 6.0 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.898 -0.779 . . . . 6.22 108.898 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -69.16 138.26 54.0 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 109.806 -0.442 . . . . 7.34 109.806 179.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 50.3 mttp 76.68 -154.99 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.409 1.483 . . . . 8.26 108.078 -177.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp 78.9 -44.14 0.35 Allowed 'General case' 0 N--CA 1.484 1.266 0 N-CA-C 113.58 0.956 . . . . 8.58 113.58 176.363 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.58 -72.13 0.11 Allowed 'General case' 0 N--CA 1.469 0.482 0 O-C-N 123.424 0.452 . . . . 6.63 111.531 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.517 ' O ' HG22 ' A' ' 54' ' ' THR . 0.0 OUTLIER 178.99 -32.78 0.01 OUTLIER 'General case' 0 C--O 1.207 -1.159 0 C-N-CA 123.444 0.698 . . . . 7.93 111.742 177.208 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 54.7 m 60.84 -80.11 0.02 OUTLIER 'General case' 0 CA--C 1.563 1.479 0 N-CA-C 114.618 1.34 . . . . 4.16 114.618 178.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 57.2 mt -139.86 144.81 27.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 N-CA-C 109.053 -0.721 . . . . 3.76 109.053 -178.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.628 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 1.1 tp-100 -109.36 136.78 48.23 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-O 121.015 0.436 . . . . 7.28 110.592 -178.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.549 ' SG ' HG22 ' A' ' 50' ' ' VAL . 38.1 t -74.28 145.05 44.31 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 124.803 1.241 . . . . 5.75 113.483 -175.504 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.6 ttpt -63.86 -34.97 79.13 Favored 'General case' 0 C--O 1.216 -0.689 0 C-N-CA 125.796 1.639 . . . . 5.98 111.332 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.549 HG22 ' SG ' ' A' ' 48' ' ' CYS . 8.5 m -61.04 -25.05 34.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 N-CA-C 113.286 0.847 . . . . 7.94 113.286 -171.3 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.5 t -170.07 -76.25 0.02 OUTLIER 'General case' 0 N--CA 1.436 -1.149 0 N-CA-C 108.825 -0.805 . . . . 9.38 108.825 -178.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.414 ' C ' HE21 ' A' ' 53' ' ' GLN . 27.5 ttt -179.89 60.86 0.01 OUTLIER 'General case' 0 C--O 1.208 -1.11 0 N-CA-C 107.303 -1.369 . . . . 9.71 107.303 179.141 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.628 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 23.3 mm-40 -106.43 -174.24 2.49 Favored 'General case' 0 C--O 1.195 -1.809 0 N-CA-C 109.475 -0.565 . . . . 9.17 109.475 -176.009 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.517 HG22 ' O ' ' A' ' 44' ' ' MET . 97.4 m -120.57 142.89 48.95 Favored 'General case' 0 C--N 1.273 -2.718 0 N-CA-C 114.255 1.206 . . . . 6.39 114.255 -170.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.409 ' HE2' ' SG ' ' A' ' 48' ' ' CYS . 79.9 m-85 -130.41 172.75 11.53 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 125.698 1.599 . . . . 5.78 108.435 175.212 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.1 tp -100.21 137.36 27.97 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 CA-C-O 121.035 0.445 . . . . 5.53 112.114 -175.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 25.8 p -89.01 77.48 7.65 Favored 'General case' 0 N--CA 1.418 -2.031 0 CA-C-O 121.571 0.7 . . . . 4.52 110.258 176.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 8.2 m -67.47 -9.44 42.06 Favored 'General case' 0 CA--C 1.576 1.968 0 CA-C-O 122.29 1.043 . . . . 6.29 110.189 174.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.426 ' C ' ' H ' ' A' ' 61' ' ' GLU . 33.2 m -149.75 173.76 13.35 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 104.681 -2.34 . . . . 6.33 104.681 178.082 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.5 m -75.75 20.42 0.18 Allowed 'General case' 0 CA--C 1.552 1.051 0 CA-C-N 119.533 1.06 . . . . 6.87 112.517 -174.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.426 ' H ' ' C ' ' A' ' 59' ' ' THR . 29.7 tt0 65.23 -52.22 0.35 Allowed 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 126.929 2.092 . . . . 4.86 111.542 -178.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.577 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 28.3 m -55.47 -41.93 65.44 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.411 0 N-CA-C 113.388 0.884 . . . . 7.56 113.388 -177.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.457 ' HA ' ' OE1' ' A' ' 66' ' ' GLU . 0.6 OUTLIER -59.9 -35.26 74.49 Favored 'General case' 0 CA--C 1.55 0.953 0 CA-C-O 122.037 0.922 . . . . 9.7 109.466 178.34 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 55.7 m -73.7 -36.26 65.23 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 108.45 -0.944 . . . . 6.07 108.45 179.123 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -59.3 -42.76 92.08 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 115.615 -0.72 . . . . 8.11 110.93 178.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.577 ' HG3' ' O ' ' A' ' 62' ' ' VAL . 25.3 mt-10 -59.14 -45.46 90.89 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 124.35 1.031 . . . . 9.78 109.894 -177.29 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.449 ' CD2' ' HA ' ' A' ' 86' ' ' LYS . 7.4 t60 -75.65 -24.59 56.4 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.281 -0.872 . . . . 9.61 109.721 -178.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.97 -43.86 33.39 Favored 'General case' 0 C--O 1.206 -1.189 0 CA-C-N 116.179 -0.464 . . . . 6.53 111.485 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.93 -18.83 64.15 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.098 0.475 . . . . 8.5 110.186 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.09 -29.5 67.6 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.16 -0.927 . . . . 9.9 110.733 175.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -128.16 -76.13 0.56 Allowed 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 112.327 0.491 . . . . 10.62 112.327 -175.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.417 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 13.4 p80 39.13 60.62 5.63 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 125.148 1.379 . . . . 8.11 113.695 -175.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.417 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 51.1 Cg_exo -59.58 -51.43 6.19 Favored 'Trans proline' 0 C--N 1.358 1.057 0 C-N-CA 122.36 2.04 . . . . 7.3 112.483 -178.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.28 -32.03 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 113.619 0.97 . . . . 7.81 113.619 177.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 71.45 116.53 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.74 0.816 . . . . 4.52 109.956 -176.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -104.21 -80.87 0.53 Allowed 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.062 0.458 . . . . 6.83 111.129 -174.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.8 m -81.53 -18.06 11.64 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 121.657 0.741 . . . . 8.44 109.174 176.118 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 35.3 m -97.0 12.03 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.305 0 CA-C-N 115.003 -0.999 . . . . 6.03 109.514 176.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.99 -12.89 9.02 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-O 121.41 0.624 . . . . 4.71 111.996 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.475 ' HB3' ' HG ' ' A' ' 48' ' ' CYS . 71.2 m -84.16 -8.64 59.02 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 115.42 -0.809 . . . . 6.16 111.384 178.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.428 ' CE2' ' HB2' ' A' ' 83' ' ' HIS . 19.9 t80 -168.12 84.1 0.75 Allowed Pre-proline 0 N--CA 1.434 -1.269 0 N-CA-C 108.158 -1.053 . . . . 6.08 108.158 168.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -62.14 5.97 0.2 Allowed 'Trans proline' 0 N--CA 1.508 2.371 0 C-N-CA 124.57 3.513 . . . . 3.27 115.199 -174.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.428 ' HB2' ' CE2' ' A' ' 81' ' ' PHE . 90.3 m-70 -92.81 3.34 55.84 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 109.803 -0.443 . . . . 4.77 109.803 177.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 45.7 mt -111.54 10.33 21.25 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.96 -0.564 . . . . 5.47 110.641 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.495 ' HD3' ' N ' ' A' ' 86' ' ' LYS . 5.0 tmtm? -51.47 -60.7 2.85 Favored 'General case' 0 C--N 1.357 0.911 0 N-CA-C 113.376 0.88 . . . . 8.41 113.376 -179.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.495 ' N ' ' HD3' ' A' ' 85' ' ' LYS . 58.0 tttm . . . . . 0 C--N 1.355 0.819 0 CA-C-O 118.428 -0.796 . . . . 11.5 110.516 174.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.215 -1.042 0 CA-C-O 119.59 -0.561 . . . . 19.39 113.26 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 46.8 m-70 78.78 123.26 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 124.154 0.982 . . . . 20.25 109.5 -172.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 44.6 t-80 -126.51 98.36 5.38 Favored 'General case' 0 C--N 1.292 -1.903 0 CA-C-N 116.488 -0.324 . . . . 18.12 110.821 -174.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 42.4 t-80 -163.59 102.75 0.93 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 120.989 0.423 . . . . 14.86 111.192 178.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.0 m80 -88.33 172.41 9.43 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.468 -0.333 . . . . 14.68 110.602 175.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 69.21 116.25 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.198 0.999 . . . . 14.28 112.598 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 19.8 p-80 -176.39 21.86 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 107.67 -1.234 . . . . 10.72 107.67 174.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.5 pp -165.45 172.76 11.79 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-N 115.066 -0.97 . . . . 10.4 108.966 -173.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 66.19 99.07 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 O-C-N 125.168 1.542 . . . . 11.87 111.027 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 157.71 -117.67 0.79 Allowed Glycine 0 N--CA 1.434 -1.45 0 C-N-CA 119.982 -1.104 . . . . 10.09 112.686 -178.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -54.1 -31.94 49.37 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 115.191 0.837 . . . . 8.45 115.191 -176.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.84 -57.13 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 119.605 -1.283 . . . . 9.5 113.524 -177.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 60.3 t30 71.38 163.81 0.27 Allowed 'General case' 0 N--CA 1.499 2.004 0 C-N-CA 124.375 1.07 . . . . 10.0 109.694 -175.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -150.16 113.01 4.79 Favored 'General case' 0 C--N 1.321 -0.673 0 O-C-N 121.865 -0.522 . . . . 11.12 110.428 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -79.84 7.23 9.13 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 112.867 0.692 . . . . 15.84 112.867 -177.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.463 ' C ' ' H ' ' A' ' 18' ' ' ALA . 14.1 mptt -86.13 -5.19 59.25 Favored 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 120.647 -0.421 . . . . 15.7 110.028 172.253 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.6 m 71.17 -35.25 0.32 Allowed 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 125.216 1.406 . . . . 11.31 112.416 179.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.463 ' H ' ' C ' ' A' ' 16' ' ' LYS . . . -62.98 -31.32 72.41 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 123.614 0.766 . . . . 13.54 112.454 -177.019 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 26.1 mmt -107.66 17.68 22.32 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.723 -0.217 . . . . 14.44 111.399 -178.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.44 18.21 0.75 Allowed 'General case' 0 N--CA 1.486 1.37 0 CA-C-O 121.852 0.834 . . . . 10.19 111.567 -178.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.0 ptm180 -137.28 6.2 2.79 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 115.343 -0.844 . . . . 10.91 109.391 176.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -92.7 -45.4 8.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.898 0.856 . . . . 9.53 108.901 179.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -124.23 125.38 44.32 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 114.942 -1.026 . . . . 11.55 109.546 176.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -146.38 -29.51 0.39 Allowed 'General case' 0 C--N 1.3 -1.559 0 CA-C-N 116.047 -0.524 . . . . 6.8 110.981 -179.447 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -61.77 154.55 25.35 Favored 'General case' 0 C--N 1.316 -0.882 0 C-N-CA 123.71 0.804 . . . . 7.19 111.46 179.389 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -79.24 -72.4 0.39 Allowed 'General case' 0 C--O 1.219 -0.534 0 CA-C-O 121.944 0.878 . . . . 7.7 111.538 178.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.7 pttm -165.23 -177.09 4.36 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.207 -1.36 . . . . 9.24 109.127 -170.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -138.84 178.46 7.14 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 120.729 0.3 . . . . 6.55 111.079 -177.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -84.3 106.07 15.63 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.7 -0.481 . . . . 10.38 109.7 179.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -146.45 -177.72 5.78 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 109.711 -0.477 . . . . 7.72 109.711 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -104.26 -74.83 0.63 Allowed 'General case' 0 N--CA 1.444 -0.767 0 CA-C-O 120.755 0.312 . . . . 8.49 110.843 178.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 120.96 -132.5 9.2 Favored Glycine 0 N--CA 1.438 -1.224 0 N-CA-C 110.382 -1.087 . . . . 7.69 110.382 -179.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.8 ptpp? -154.06 118.83 4.95 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 116.939 0.37 . . . . 9.15 110.123 177.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.7 150.32 25.06 Favored Glycine 0 N--CA 1.44 -1.08 0 N-CA-C 110.89 -0.884 . . . . 8.66 110.89 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 42.1 t -117.01 8.64 13.44 Favored 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 120.338 -0.545 . . . . 9.53 110.196 -178.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -138.56 141.59 39.25 Favored 'General case' 0 C--O 1.245 0.829 0 C-N-CA 120.825 -0.35 . . . . 12.43 110.421 -178.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 95.5 mt 63.57 12.18 6.27 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.243 1.017 . . . . 10.35 113.28 176.813 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -85.62 138.98 31.78 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 109.61 -0.515 . . . . 7.86 109.61 178.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.91 -55.2 0.02 OUTLIER 'General case' 0 N--CA 1.439 -0.999 0 CA-C-N 115.185 -0.916 . . . . 6.22 110.047 -178.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . 0.465 HD22 ' HB2' ' A' ' 42' ' ' LYS . 8.3 t30 -167.17 142.28 4.02 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.16 -0.473 . . . . 7.34 111.223 -176.446 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.56 -53.38 4.83 Favored 'General case' 0 N--CA 1.483 1.22 0 CA-C-O 120.818 0.342 . . . . 8.26 110.267 178.38 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.465 ' HB2' HD22 ' A' ' 40' ' ' ASN . 36.9 ttpt 73.29 125.89 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 126.058 1.743 . . . . 8.58 112.266 -176.122 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . 61.73 12.06 4.4 Favored 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 124.264 1.026 . . . . 6.63 113.423 176.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 68.1 mtm 72.38 10.47 5.81 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 124.153 0.981 . . . . 7.93 112.002 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.7 p 48.25 -101.1 0.07 Allowed 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 115.666 1.728 . . . . 4.16 115.666 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.488 ' O ' ' HA ' ' A' ' 54' ' ' THR . 62.0 mt -122.83 136.64 58.98 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.059 0 N-CA-C 109.006 -0.738 . . . . 3.76 109.006 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.649 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 7.3 tt0 -102.89 141.84 35.02 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.779 0.324 . . . . 7.28 110.618 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.517 ' SG ' HG11 ' A' ' 50' ' ' VAL . 48.7 t -80.0 144.68 33.04 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.985 -0.552 . . . . 5.75 110.911 177.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.412 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 1.8 tmmm? -59.92 -44.67 94.18 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 125.061 1.344 . . . . 5.98 112.299 -174.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.517 HG11 ' SG ' ' A' ' 48' ' ' CYS . 7.5 p -46.95 -37.86 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 N-CA-C 114.885 1.439 . . . . 7.94 114.885 -171.811 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 50.1 t -159.96 -67.26 0.07 Allowed 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.388 -0.525 . . . . 9.38 110.072 -179.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.418 ' C ' HE21 ' A' ' 53' ' ' GLN . 27.5 ttt 178.21 60.24 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.417 0 O-C-N 123.758 0.662 . . . . 9.71 109.904 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.649 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 19.1 mm-40 -103.55 -170.78 1.83 Allowed 'General case' 0 C--O 1.203 -1.384 0 N-CA-C 107.478 -1.304 . . . . 9.17 107.478 -177.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.488 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 9.0 t -141.94 157.97 44.33 Favored 'General case' 0 N--CA 1.42 -1.952 0 C-N-CA 118.333 -1.347 . . . . 6.39 113.013 -178.205 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -140.39 139.98 35.41 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 106.026 -1.842 . . . . 5.78 106.026 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 7.1 tp -63.49 140.62 19.35 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 O-C-N 123.413 0.445 . . . . 5.53 111.623 -178.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 12.6 p -75.08 72.13 2.18 Favored 'General case' 0 N--CA 1.426 -1.638 0 CA-C-O 121.747 0.784 . . . . 4.52 112.71 178.16 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 24.5 p -82.46 -4.47 57.51 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.312 -0.858 . . . . 6.29 109.872 171.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.54 HG22 ' SG ' ' A' ' 64' ' ' CYS . 25.1 m -143.31 161.0 39.48 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 106.586 -1.635 . . . . 6.33 106.586 176.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.5 m -87.27 17.22 4.51 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 112.219 0.452 . . . . 6.87 112.219 -174.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.491 ' CD ' ' HE ' ' A' ' 65' ' ' ARG . 5.4 tp10 67.58 -64.85 0.26 Allowed 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 112.225 0.454 . . . . 4.86 112.225 179.229 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 5.4 p -63.9 -25.86 39.19 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 C-N-CA 123.014 0.526 . . . . 7.56 111.016 -175.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -62.28 -41.59 98.62 Favored 'General case' 0 C--O 1.25 1.104 0 N-CA-C 108.106 -1.072 . . . . 9.7 108.106 177.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . 0.54 ' SG ' HG22 ' A' ' 59' ' ' THR . 63.9 m -77.48 -29.42 52.65 Favored 'General case' 0 N--CA 1.424 -1.741 0 CA-C-N 115.058 -0.974 . . . . 6.07 108.904 176.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.491 ' HE ' ' CD ' ' A' ' 61' ' ' GLU . 97.1 mtt180 -57.78 -47.18 83.29 Favored 'General case' 0 CA--C 1.5 -0.957 0 N-CA-C 113.114 0.783 . . . . 8.11 113.114 179.047 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -65.35 -40.69 93.94 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 119.95 -0.7 . . . . 9.78 110.49 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.426 ' O ' ' HB3' ' A' ' 70' ' ' ALA . 3.7 t-160 -75.91 -26.95 57.44 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 115.937 -0.574 . . . . 9.61 110.725 -175.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.562 ' O ' ' HB2' ' A' ' 72' ' ' HIS . . . -77.62 -49.85 13.74 Favored 'General case' 0 C--O 1.186 -2.255 0 N-CA-C 109.935 -0.395 . . . . 6.53 109.935 178.804 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -67.81 -8.45 36.08 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.39 0.614 . . . . 8.5 111.049 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.426 ' HB3' ' O ' ' A' ' 67' ' ' HIS . . . -73.12 -31.37 64.26 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 115.047 -0.979 . . . . 9.9 109.446 173.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -131.39 -79.07 0.52 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.793 -0.64 . . . . 10.62 110.113 -176.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.562 ' HB2' ' O ' ' A' ' 68' ' ' ALA . 5.8 t-160 47.07 48.43 5.71 Favored Pre-proline 0 CA--C 1.566 1.587 0 C-N-CA 124.809 1.244 . . . . 8.11 111.643 176.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.434 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 45.7 Cg_exo -56.61 -51.09 9.89 Favored 'Trans proline' 0 C--N 1.387 2.556 0 C-N-CA 121.903 1.735 . . . . 7.3 111.789 -174.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -163.69 106.86 0.98 Allowed 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.68 -0.691 . . . . 7.81 109.727 178.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.27 111.35 2.57 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 120.039 -0.665 . . . . 4.52 109.338 173.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -107.01 -87.62 0.47 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 114.871 -1.058 . . . . 6.83 110.858 -170.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 30.3 m -82.16 -1.69 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-O 122.468 1.127 . . . . 8.44 108.973 174.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.453 HG23 ' HA ' ' A' ' 85' ' ' LYS . 32.7 m -110.01 10.05 8.83 Favored 'Isoleucine or valine' 0 C--O 1.183 -2.403 0 CA-C-N 113.286 -1.779 . . . . 6.03 108.517 176.697 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.57 -21.38 62.54 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-O 121.598 0.714 . . . . 4.71 112.156 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.451 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 72.3 m -76.37 -15.92 59.85 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.557 -0.747 . . . . 6.16 110.876 176.74 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.64 ' CD1' HD12 ' A' ' 84' ' ' LEU . 4.4 p90 -153.61 71.49 6.7 Favored Pre-proline 0 CA--C 1.555 1.164 0 C-N-CA 124.728 1.211 . . . . 6.08 111.119 -179.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -64.63 -1.56 4.17 Favored 'Trans proline' 0 C--N 1.364 1.371 0 C-N-CA 123.944 3.096 . . . . 3.27 116.239 -172.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -91.86 -0.49 57.51 Favored 'General case' 0 C--N 1.297 -1.688 0 C-N-CA 119.502 -0.879 . . . . 4.77 109.891 177.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.64 HD12 ' CD1' ' A' ' 81' ' ' PHE . 20.0 mt -116.28 17.24 15.69 Favored 'General case' 0 N--CA 1.425 -1.676 0 C-N-CA 121.011 -0.276 . . . . 5.47 111.347 -175.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.453 ' HA ' HG23 ' A' ' 78' ' ' VAL . 27.0 tptp -53.27 -50.55 64.62 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 112.908 0.707 . . . . 8.41 112.908 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt . . . . . 0 N--CA 1.417 -2.114 0 N-CA-C 106.904 -1.517 . . . . 11.5 106.904 178.611 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.223 -0.566 0 N-CA-C 112.909 -0.077 . . . . 19.39 112.909 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 59.8 m-70 -118.31 -17.53 9.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.08 0.467 . . . . 20.25 111.27 176.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -132.14 127.05 35.11 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.099 -1.075 . . . . 18.12 108.099 178.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 21.0 m-70 -99.22 -54.59 2.93 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-O 120.659 0.266 . . . . 14.86 111.344 -178.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 27.0 p80 -162.2 176.21 10.87 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 109.299 -0.63 . . . . 14.68 109.299 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 -125.13 -156.22 0.72 Allowed 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 107.324 -1.361 . . . . 14.28 107.324 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -139.96 169.24 18.08 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 106.776 -1.565 . . . . 10.72 106.776 175.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 60.1 tp 74.51 88.0 0.09 Allowed 'General case' 0 N--CA 1.455 -0.191 0 O-C-N 124.723 1.264 . . . . 10.4 110.075 -172.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -84.03 2.63 38.16 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.214 -0.903 . . . . 11.87 108.839 179.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 135.82 -35.63 2.12 Favored Glycine 0 N--CA 1.443 -0.884 0 N-CA-C 109.507 -1.437 . . . . 10.09 109.507 -176.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.404 ' HA2' ' OD1' ' A' ' 24' ' ' ASN . . . 118.23 170.22 14.88 Favored Glycine 0 N--CA 1.437 -1.288 0 C-N-CA 120.67 -0.776 . . . . 8.45 112.55 177.344 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 111.83 -90.13 0.55 Allowed Glycine 0 N--CA 1.435 -1.387 0 C-N-CA 120.707 -0.759 . . . . 9.5 113.048 176.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -154.02 154.72 34.21 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 119.806 -0.14 . . . . 10.0 110.646 -173.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -164.57 160.62 20.42 Favored 'General case' 0 C--O 1.255 1.357 0 O-C-N 124.013 0.82 . . . . 11.12 109.531 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -94.26 119.59 33.27 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 112.88 0.696 . . . . 15.84 112.88 -176.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt 167.58 -57.24 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 126.624 1.97 . . . . 15.7 107.802 173.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.433 ' H ' ' HB1' ' A' ' 22' ' ' ALA . 19.4 m -97.44 13.27 30.4 Favored 'General case' 0 CA--C 1.494 -1.183 0 CA-C-N 115.349 -0.841 . . . . 11.31 110.082 178.22 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 54.09 45.38 27.63 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 123.738 0.649 . . . . 13.54 110.72 -178.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 56.1 ttp 71.99 1.76 4.04 Favored 'General case' 0 CA--C 1.55 0.955 0 CA-C-N 114.507 -1.224 . . . . 14.44 112.079 -179.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.81 -36.61 78.43 Favored 'General case' 0 C--N 1.356 0.871 0 C-N-CA 119.215 -0.994 . . . . 10.19 111.236 -178.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 -170.38 27.38 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 116.089 -0.505 . . . . 10.91 111.333 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.433 ' HB1' ' H ' ' A' ' 17' ' ' SER . . . -77.09 96.47 4.46 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 112.35 0.5 . . . . 9.53 112.35 -174.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 93.8 mttt 68.38 -4.37 1.12 Allowed 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 114.907 1.447 . . . . 11.55 114.907 176.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.404 ' OD1' ' HA2' ' A' ' 11' ' ' GLY . 57.8 t30 -78.86 120.44 23.48 Favored 'General case' 0 C--N 1.282 -2.333 0 C-N-CA 119.132 -1.027 . . . . 6.8 111.832 -172.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 85.2 mt 63.4 -168.04 0.21 Allowed 'General case' 0 C--O 1.253 1.254 0 CA-C-N 114.504 -1.225 . . . . 7.19 112.928 176.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -132.01 -50.24 0.95 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.737 -0.665 . . . . 7.7 110.762 177.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -98.76 145.59 26.78 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 120.605 0.241 . . . . 9.24 110.593 176.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -107.34 2.98 24.87 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.336 0.588 . . . . 6.55 110.533 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.443 ' HZ1' ' CD ' ' A' ' 38' ' ' GLU . 12.3 ptmm? -82.61 161.36 22.25 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 115.5 -0.773 . . . . 10.38 110.498 178.542 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -78.39 112.25 15.22 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 116.02 -0.536 . . . . 7.72 110.684 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -100.15 141.07 33.48 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 108.63 -0.878 . . . . 8.49 108.63 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -83.6 49.56 4.25 Favored Glycine 0 C--N 1.315 -0.592 0 C-N-CA 120.748 -0.739 . . . . 7.69 111.854 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 49.7 mmtm 72.0 -15.11 0.48 Allowed 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 124.542 1.137 . . . . 9.15 113.042 -179.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 162.67 95.81 0.11 Allowed Glycine 0 N--CA 1.441 -1.033 0 N-CA-C 110.606 -0.998 . . . . 8.66 110.606 179.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.0 m -88.03 -40.07 14.14 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 112.89 0.7 . . . . 9.53 112.89 -176.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -159.38 -85.8 0.04 OUTLIER 'General case' 0 C--O 1.208 -1.132 0 N-CA-C 109.685 -0.487 . . . . 12.43 109.685 178.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 43.9 tp -102.56 -12.49 17.73 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 107.486 -1.302 . . . . 10.35 107.486 174.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.443 ' CD ' ' HZ1' ' A' ' 29' ' ' LYS . 40.9 tt0 -84.33 102.93 13.08 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 114.177 -1.374 . . . . 7.86 109.156 178.5 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -164.07 149.74 10.83 Favored 'General case' 0 N--CA 1.438 -1.06 0 C-N-CA 123.791 0.836 . . . . 6.22 108.907 179.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -101.32 -6.57 23.94 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 122.568 1.175 . . . . 7.34 108.8 177.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -117.34 88.36 2.89 Favored 'General case' 0 N--CA 1.413 -2.308 0 CA-C-N 114.936 -1.029 . . . . 8.26 110.427 -177.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.476 ' HD3' ' H ' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -78.31 152.99 32.12 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 114.16 -1.382 . . . . 8.58 110.589 -178.145 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . 65.04 14.11 9.13 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.509 1.124 . . . . 6.63 112.728 177.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 26.1 mmt 68.98 12.52 8.64 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.607 0.763 . . . . 7.93 111.889 178.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.7 p 46.69 -98.55 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.157 0 N-CA-C 116.485 2.032 . . . . 4.16 116.485 176.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.446 ' O ' ' HA ' ' A' ' 54' ' ' THR . 66.5 mt -119.99 149.87 22.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.024 0 N-CA-C 108.294 -1.002 . . . . 3.76 108.294 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.651 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 0.0 OUTLIER -119.22 141.33 49.0 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 108.841 -0.8 . . . . 7.28 108.841 -177.407 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.614 ' SG ' HG12 ' A' ' 50' ' ' VAL . 22.6 t -78.99 147.65 32.83 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 112.217 0.451 . . . . 5.75 112.217 -177.2 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 2.5 tmmm? -64.29 -46.37 83.94 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.827 1.251 . . . . 5.98 110.978 -177.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.614 HG12 ' SG ' ' A' ' 48' ' ' CYS . 8.5 p -51.19 -32.55 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 N-CA-C 113.962 1.097 . . . . 7.94 113.962 -173.172 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 41.9 t -159.01 -74.06 0.08 Allowed 'General case' 0 C--N 1.3 -1.583 0 C-N-CA 120.79 -0.364 . . . . 9.38 110.044 -177.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 35.2 ttp 176.38 40.64 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 108.967 -0.753 . . . . 9.71 108.967 -176.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.651 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 13.9 mm-40 -89.69 -176.22 4.91 Favored 'General case' 0 C--O 1.193 -1.894 0 N-CA-C 107.72 -1.215 . . . . 9.17 107.72 -174.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.446 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 5.2 t -133.17 152.19 51.95 Favored 'General case' 0 C--N 1.286 -2.185 0 C-N-CA 117.73 -1.588 . . . . 6.39 113.506 -175.076 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -135.18 156.55 48.8 Favored 'General case' 0 N--CA 1.427 -1.613 0 N-CA-C 106.489 -1.671 . . . . 5.78 106.489 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.2 tp -70.83 138.34 22.03 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.657 0 O-C-N 123.713 0.633 . . . . 5.53 111.88 -176.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 19.0 p -86.36 74.15 10.02 Favored 'General case' 0 N--CA 1.418 -2.064 0 CA-C-O 121.588 0.709 . . . . 4.52 111.132 178.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.1 p -70.78 -16.01 62.71 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.356 -0.838 . . . . 6.29 109.931 173.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 60.7 m -155.14 153.18 30.41 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 106.299 -1.741 . . . . 6.33 106.299 176.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.9 m -77.4 138.27 39.19 Favored 'General case' 0 N--CA 1.418 -2.03 0 N-CA-C 106.459 -1.682 . . . . 6.87 106.459 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -52.17 -39.31 59.86 Favored 'General case' 0 C--O 1.185 -2.291 0 C-N-CA 120.749 -0.381 . . . . 4.86 110.402 -179.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.497 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 17.2 m -53.38 -41.42 44.33 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.205 0 N-CA-C 114.403 1.26 . . . . 7.56 114.403 -178.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -72.37 -33.08 66.98 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 122.137 0.97 . . . . 9.7 108.851 -179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 60.0 m -73.48 -31.34 63.7 Favored 'General case' 0 C--N 1.31 -1.135 0 N-CA-C 108.39 -0.967 . . . . 6.07 108.39 178.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.439 ' HB3' ' O ' ' A' ' 62' ' ' VAL . 27.1 ttm180 -64.86 -42.85 94.53 Favored 'General case' 0 N--CA 1.426 -1.65 0 C-N-CA 125.472 1.509 . . . . 8.11 110.967 177.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.497 ' HG3' ' O ' ' A' ' 62' ' ' VAL . 27.9 mt-10 -55.43 -47.92 75.24 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 122.372 1.082 . . . . 9.78 108.44 178.645 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -75.59 -16.82 60.19 Favored 'General case' 0 C--N 1.293 -1.87 0 CA-C-N 113.768 -1.56 . . . . 9.61 110.943 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.596 ' HA ' ' CD2' ' A' ' 72' ' ' HIS . . . -88.56 -41.46 12.68 Favored 'General case' 0 CA--C 1.489 -1.386 0 N-CA-C 112.423 0.527 . . . . 6.53 112.423 -177.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.434 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 33.0 mm-40 -68.2 -25.06 65.04 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 107.854 -1.165 . . . . 8.5 107.854 178.405 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.482 ' O ' ' HD3' ' A' ' 71' ' ' LYS . . . -75.8 -31.24 59.35 Favored 'General case' 0 C--O 1.245 0.854 0 CA-C-N 114.783 -1.099 . . . . 9.9 111.192 176.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.482 ' HD3' ' O ' ' A' ' 70' ' ' ALA . 73.4 mmtt -135.43 -111.08 0.21 Allowed 'General case' 0 C--N 1.355 0.842 0 N-CA-C 109.682 -0.488 . . . . 10.62 109.682 -177.239 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.596 ' CD2' ' HA ' ' A' ' 68' ' ' ALA . 9.7 m170 29.23 51.62 0.4 Allowed Pre-proline 0 N--CA 1.501 2.086 0 N-CA-C 115.758 1.762 . . . . 8.11 115.758 178.336 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.566 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 1.0 OUTLIER -79.85 -3.35 12.75 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.375 2.05 . . . . 7.3 113.838 -175.069 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.557 ' O ' ' HG3' ' A' ' 85' ' ' LYS . 18.4 ptmt -161.45 109.3 1.47 Allowed 'General case' 0 C--O 1.199 -1.597 0 N-CA-C 111.987 0.365 . . . . 7.81 111.987 -177.198 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -97.62 122.04 40.24 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.221 -1.029 . . . . 4.52 108.221 174.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -98.95 -90.65 0.29 Allowed 'General case' 0 C--O 1.211 -0.942 0 CA-C-N 115.815 -0.629 . . . . 6.83 110.818 -173.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 32.7 m -82.44 -11.95 12.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 CA-C-O 122.284 1.04 . . . . 8.44 109.044 176.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.449 HG21 ' HA ' ' A' ' 85' ' ' LYS . 35.8 m -99.19 13.57 5.0 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 CA-C-N 113.881 -1.509 . . . . 6.03 108.707 177.382 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.85 -15.2 53.64 Favored 'General case' 0 C--O 1.251 1.132 0 CA-C-O 121.622 0.725 . . . . 4.71 111.539 178.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.402 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 73.6 m -75.56 -15.81 60.33 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-N 115.295 -0.866 . . . . 6.16 110.701 175.165 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.511 ' CD1' HD12 ' A' ' 84' ' ' LEU . 16.4 p90 -154.1 70.6 6.34 Favored Pre-proline 0 CA--C 1.561 1.382 0 C-N-CA 124.454 1.102 . . . . 6.08 111.527 179.068 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -57.38 -22.96 52.6 Favored 'Trans proline' 0 N--CA 1.495 1.589 0 C-N-CA 123.481 2.787 . . . . 3.27 114.478 -173.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -73.71 -1.38 18.86 Favored 'General case' 0 C--N 1.309 -1.181 0 C-N-CA 120.161 -0.615 . . . . 4.77 111.825 -178.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.511 HD12 ' CD1' ' A' ' 81' ' ' PHE . 19.3 mt -123.01 14.66 9.89 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 118.162 0.437 . . . . 5.47 111.011 -177.134 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.557 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 4.7 tmtt? -53.92 -83.38 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 113.764 1.024 . . . . 8.41 113.764 -177.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.441 ' HG2' ' HD2' ' A' ' 85' ' ' LYS . 31.9 mmmt . . . . . 0 CA--C 1.503 -0.861 0 CA-C-O 118.913 -0.565 . . . . 11.5 110.919 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.803 0 N-CA-C 111.991 -0.443 . . . . 19.39 111.991 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 63.37 14.29 7.77 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.427 1.091 . . . . 20.25 112.886 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -148.45 162.0 40.48 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.833 -0.803 . . . . 18.12 108.833 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -69.35 148.53 49.55 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 120.482 0.182 . . . . 14.86 110.563 178.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 27.3 p80 -131.45 138.79 49.19 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 120.622 0.249 . . . . 14.68 111.011 -176.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 15.1 t-80 -156.69 138.96 14.69 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 107.889 -1.152 . . . . 14.28 107.889 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 67.4 m-70 -133.74 128.94 35.93 Favored 'General case' 0 C--N 1.312 -1.059 0 N-CA-C 109.801 -0.444 . . . . 10.72 109.801 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.7 mp 62.46 -174.65 0.14 Allowed 'General case' 0 CA--C 1.557 1.242 0 O-C-N 124.336 1.022 . . . . 10.4 111.95 179.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 64.35 16.45 10.15 Favored 'General case' 0 N--CA 1.498 1.943 0 C-N-CA 124.252 1.021 . . . . 11.87 110.541 178.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 177.55 -167.43 38.44 Favored Glycine 0 N--CA 1.427 -1.941 0 N-CA-C 109.065 -1.614 . . . . 10.09 109.065 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -99.7 92.2 1.12 Allowed Glycine 0 N--CA 1.433 -1.518 0 C-N-CA 120.407 -0.901 . . . . 8.45 111.09 178.237 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -96.88 63.65 1.04 Allowed Glycine 0 C--N 1.312 -0.76 0 C-N-CA 121.025 -0.607 . . . . 9.5 111.796 -179.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -83.8 113.72 21.12 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 122.183 0.992 . . . . 10.0 111.667 -178.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -88.02 179.59 6.39 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 114.959 -1.019 . . . . 11.12 110.088 177.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . 0.513 ' C ' ' H ' ' A' ' 17' ' ' SER . 47.3 mt-30 -72.77 168.19 19.31 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-N 116.078 -0.51 . . . . 15.84 111.905 -179.773 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.402 ' HB2' ' NZ ' ' A' ' 16' ' ' LYS . 0.0 OUTLIER 79.02 -31.69 0.15 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.213 1.805 . . . . 15.7 108.363 -173.581 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.513 ' H ' ' C ' ' A' ' 15' ' ' GLN . 32.7 t 70.92 -38.34 0.42 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.665 1.986 . . . . 11.31 112.811 175.409 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.53 -51.92 65.44 Favored 'General case' 0 C--N 1.311 -1.105 0 C-N-CA 123.228 0.611 . . . . 13.54 112.553 -177.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -85.09 -1.81 57.28 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.447 -0.342 . . . . 14.44 111.264 -178.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.94 -28.92 17.75 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.622 0.725 . . . . 10.19 109.77 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 74.8 mtp180 -96.08 10.43 37.6 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 114.981 -1.009 . . . . 10.91 110.186 -178.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.55 -35.53 70.65 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.754 -0.657 . . . . 9.53 110.818 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -136.55 -90.67 0.27 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 109.036 -0.728 . . . . 11.55 109.036 178.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 54.7 t30 58.87 -71.42 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 114.636 1.347 . . . . 6.8 114.636 175.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 59.6 tp -121.39 116.29 24.51 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-O 121.378 0.609 . . . . 7.19 110.314 -175.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -84.11 -27.88 27.89 Favored 'General case' 0 C--N 1.3 -1.574 0 N-CA-C 113.761 1.022 . . . . 7.7 113.761 -176.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -82.1 16.48 1.93 Allowed 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 113.083 0.771 . . . . 9.24 113.083 -174.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -108.89 -171.88 1.94 Allowed 'General case' 0 C--N 1.303 -1.432 0 C-N-CA 122.76 0.424 . . . . 6.55 110.474 179.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -129.12 151.01 50.26 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 123.361 0.665 . . . . 10.38 109.358 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -113.63 -170.9 1.79 Allowed 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 109.608 -0.516 . . . . 7.72 109.608 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -91.54 -176.54 4.54 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.837 0.351 . . . . 8.49 110.636 -178.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -144.98 -60.47 0.02 OUTLIER Glycine 0 N--CA 1.439 -1.105 0 C-N-CA 120.8 -0.714 . . . . 7.69 111.393 -179.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -90.85 139.69 30.51 Favored 'General case' 0 C--O 1.25 1.114 0 N-CA-C 109.842 -0.429 . . . . 9.15 109.842 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -70.64 137.44 27.28 Favored Glycine 0 N--CA 1.439 -1.151 0 O-C-N 123.959 0.787 . . . . 8.66 112.902 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.433 ' HB2' ' HB3' ' A' ' 38' ' ' GLU . 22.9 p -89.64 169.39 11.36 Favored 'General case' 0 N--CA 1.425 -1.7 0 C-N-CA 123.051 0.54 . . . . 9.53 111.604 -178.103 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -126.15 -67.05 0.89 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.727 -0.471 . . . . 12.43 109.727 178.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.5 mt -104.35 -35.36 7.98 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.604 -0.517 . . . . 10.35 109.604 176.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.433 ' HB3' ' HB2' ' A' ' 35' ' ' SER . 12.2 pt-20 52.79 -168.78 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 125.494 1.518 . . . . 7.86 113.591 178.6 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 71.7 -17.28 0.35 Allowed 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.627 1.171 . . . . 6.22 113.763 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -73.71 18.19 0.14 Allowed 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 113.52 0.933 . . . . 7.34 113.52 -177.793 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.473 ' HE2' HG12 ' A' ' 56' ' ' ILE . 34.2 ttmt -131.26 -74.72 0.52 Allowed 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.345 -0.942 . . . . 8.26 109.58 178.133 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt 64.4 -33.63 0.15 Allowed 'General case' 0 CA--C 1.571 1.755 0 N-CA-C 114.855 1.428 . . . . 8.58 114.855 176.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -89.85 -15.82 31.41 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 113.464 0.913 . . . . 6.63 113.464 -175.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 1.3 mpt? 61.42 90.04 0.07 Allowed 'General case' 0 N--CA 1.473 0.696 0 O-C-N 123.898 0.748 . . . . 7.93 110.795 -173.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.47 ' OG ' HG13 ' A' ' 46' ' ' ILE . 22.7 t -60.0 -81.86 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 114.889 -1.05 . . . . 4.16 113.767 -178.263 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.47 HG13 ' OG ' ' A' ' 45' ' ' SER . 13.2 mt -129.41 159.34 41.55 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 CA-C-N 115.968 -0.56 . . . . 3.76 110.056 -172.368 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.631 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 34.9 tt0 -108.98 135.03 50.83 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.914 0.885 . . . . 7.28 109.196 178.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.653 ' SG ' HG13 ' A' ' 50' ' ' VAL . 47.6 t -77.55 144.81 37.31 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.516 -0.765 . . . . 5.75 111.06 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.48 ' HD3' ' O ' ' A' ' 79' ' ' ALA . 14.7 ttpt -59.13 -47.07 86.63 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 124.897 1.279 . . . . 5.98 112.426 -175.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.653 HG13 ' SG ' ' A' ' 48' ' ' CYS . 7.1 p -49.48 -32.84 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-N 114.542 -1.208 . . . . 7.94 113.902 -170.764 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.429 ' SG ' ' HG2' ' A' ' 52' ' ' MET . 52.7 t -160.02 -71.23 0.07 Allowed 'General case' 0 N--CA 1.419 -2.01 0 C-N-CA 119.915 -0.714 . . . . 9.38 110.492 -177.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.429 ' HG2' ' SG ' ' A' ' 51' ' ' CYS . 24.3 ptt? -178.95 28.12 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 O-C-N 123.5 0.5 . . . . 9.71 111.195 -174.568 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.631 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 10.6 mm-40 -83.95 178.6 7.81 Favored 'General case' 0 C--O 1.201 -1.456 0 N-CA-C 108.177 -1.045 . . . . 9.17 108.177 -171.36 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.47 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 9.5 t -134.86 145.1 47.97 Favored 'General case' 0 C--N 1.279 -2.483 0 C-N-CA 117.894 -1.523 . . . . 6.39 112.303 -175.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.448 ' O ' ' HB3' ' A' ' 45' ' ' SER . 96.8 m-85 -107.31 173.42 6.33 Favored 'General case' 0 N--CA 1.424 -1.762 0 CA-C-N 114.317 -1.311 . . . . 5.78 108.27 176.404 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.473 HG12 ' HE2' ' A' ' 41' ' ' LYS . 0.3 OUTLIER -104.51 148.79 8.7 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.547 0 N-CA-C 107.287 -1.375 . . . . 5.53 107.287 -177.217 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.428 ' H ' HD13 ' A' ' 56' ' ' ILE . 42.5 t -71.82 77.58 0.87 Allowed 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.895 0.855 . . . . 4.52 110.322 176.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 9.9 t -96.95 -11.02 25.15 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 114.859 -1.064 . . . . 6.29 108.706 174.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 47.2 m -161.95 150.81 15.47 Favored 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 106.76 -1.57 . . . . 6.33 106.76 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 11.3 m -89.4 131.16 35.59 Favored 'General case' 0 N--CA 1.406 -2.647 0 N-CA-C 105.719 -1.956 . . . . 6.87 105.719 178.279 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.537 ' O ' ' HG3' ' A' ' 65' ' ' ARG . 42.7 mt-10 -52.45 -29.98 27.35 Favored 'General case' 0 C--O 1.186 -2.256 0 N-CA-C 112.787 0.662 . . . . 4.86 112.787 -177.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 86.5 t -58.91 -36.86 63.77 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.4 0 N-CA-C 111.721 0.267 . . . . 7.56 111.721 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -71.56 -30.59 66.04 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 108.02 -1.104 . . . . 9.7 108.02 -179.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 69.8 m -80.2 -25.68 39.55 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 114.726 -1.125 . . . . 6.07 110.956 176.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.537 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 65.8 mtm180 -64.78 -49.12 71.95 Favored 'General case' 0 CA--C 1.5 -0.958 0 N-CA-C 111.972 0.36 . . . . 8.11 111.972 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -63.68 -39.48 94.42 Favored 'General case' 0 C--O 1.217 -0.617 0 C-N-CA 119.967 -0.693 . . . . 9.78 109.673 177.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -62.72 -30.85 71.73 Favored 'General case' 0 CA--C 1.558 1.271 0 CA-C-N 115.918 -0.583 . . . . 9.61 111.085 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -77.67 -50.36 12.62 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 116.295 -0.411 . . . . 6.53 111.17 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 10.8 pt-20 -69.17 -18.09 63.89 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 121.103 0.478 . . . . 8.5 111.743 -178.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.0 -17.56 59.64 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.424 -0.807 . . . . 9.9 111.287 176.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -138.19 -73.99 0.4 Allowed 'General case' 0 C--O 1.211 -0.93 0 CA-C-O 120.691 0.281 . . . . 10.62 111.31 -174.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 18.5 p80 43.5 63.06 8.36 Favored Pre-proline 0 N--CA 1.478 0.963 0 N-CA-C 114.864 1.431 . . . . 8.11 114.864 -178.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -79.74 -60.64 0.03 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.343 0 C-N-CA 121.244 1.296 . . . . 7.3 114.101 178.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -158.21 107.29 2.03 Favored 'General case' 0 N--CA 1.44 -0.942 0 C-N-CA 119.587 -0.845 . . . . 7.81 112.555 -173.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.54 ' HB2' ' HG2' ' A' ' 85' ' ' LYS . . . -85.0 89.96 7.72 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.374 -0.83 . . . . 4.52 110.201 176.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -113.98 -72.48 0.7 Allowed 'General case' 0 N--CA 1.482 1.165 0 CA-C-O 121.101 0.477 . . . . 6.83 111.647 -178.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 27.2 m -77.51 -14.56 14.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 122.079 0.942 . . . . 8.44 108.973 176.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.474 HG23 ' HA ' ' A' ' 85' ' ' LYS . 29.1 m -105.22 11.08 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.141 0 CA-C-N 114.346 -1.297 . . . . 6.03 108.979 175.141 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.48 ' O ' ' HD3' ' A' ' 49' ' ' LYS . . . -61.21 -18.2 57.06 Favored 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 112.076 0.398 . . . . 4.71 112.076 179.405 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.522 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 78.2 m -76.99 -13.1 60.0 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 116.212 -0.449 . . . . 6.16 111.293 178.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.404 ' CZ ' HG21 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -151.69 75.27 7.75 Favored Pre-proline 0 C--N 1.306 -1.29 0 N-CA-C 106.69 -1.596 . . . . 6.08 106.69 174.634 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -67.88 9.44 0.36 Allowed 'Trans proline' 0 C--N 1.367 1.538 0 C-N-CA 123.7 2.933 . . . . 3.27 114.345 -173.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 38.7 m170 -91.08 -4.6 56.15 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.946 -0.761 . . . . 4.77 108.946 175.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 13.4 mt -120.59 21.09 11.67 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.299 -0.409 . . . . 5.47 110.435 -174.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.54 ' HG2' ' HB2' ' A' ' 75' ' ' ALA . 58.6 mttp -36.86 -49.02 0.78 Allowed 'General case' 0 CA--C 1.561 1.375 0 N-CA-C 117.607 2.447 . . . . 8.41 117.607 -173.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 54.5 tptt . . . . . 0 C--N 1.326 -0.432 0 CA-C-O 118.752 -0.642 . . . . 11.5 112.712 -177.663 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.488 -1.616 0 N-CA-C 109.649 -1.38 . . . . 19.39 109.649 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 15.7 t60 -140.65 127.63 20.69 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 109.474 -0.565 . . . . 20.25 109.474 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 25.7 t-80 71.98 131.0 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.139 0.975 . . . . 18.12 112.298 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.46 ' HD1' ' HG2' ' A' ' 21' ' ' ARG . 74.1 m-70 -64.26 122.02 15.65 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 108.213 -1.032 . . . . 14.86 108.213 177.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 43.7 p-80 -155.41 161.33 41.02 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.685 -0.406 . . . . 14.68 111.026 -177.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.407 ' C ' ' HA ' ' A' ' 13' ' ' ASN . 30.4 m170 72.98 178.71 0.23 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 124.646 1.179 . . . . 14.28 112.384 -176.282 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.509 ' HD2' ' O ' ' A' ' 20' ' ' ALA . 25.4 t-80 -163.43 144.51 9.25 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 106.882 -1.525 . . . . 10.72 106.882 -178.387 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.536 ' HB2' ' O ' ' A' ' 23' ' ' LYS . 54.5 tp -54.36 -69.39 0.13 Allowed 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 121.321 0.581 . . . . 10.4 111.963 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -88.04 112.06 22.22 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-N 115.34 -0.845 . . . . 11.87 108.854 -177.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.88 -28.69 7.91 Favored Glycine 0 C--N 1.309 -0.943 0 C-N-CA 120.617 -0.801 . . . . 10.09 111.531 -178.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 73.94 -58.27 2.22 Favored Glycine 0 C--O 1.249 1.083 0 N-CA-C 115.388 0.915 . . . . 8.45 115.388 177.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -77.31 52.64 3.43 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 115.801 1.08 . . . . 9.5 115.801 -172.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.407 ' HA ' ' C ' ' A' ' 6' ' ' HIS . 2.3 t-20 65.52 -172.73 0.18 Allowed 'General case' 0 CA--C 1.559 1.322 0 C-N-CA 123.954 0.902 . . . . 10.0 110.759 174.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -179.33 164.11 1.32 Allowed 'General case' 0 C--O 1.249 1.077 0 C-N-CA 124.05 0.94 . . . . 11.12 109.09 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -73.03 176.59 5.63 Favored 'General case' 0 C--O 1.239 0.544 0 O-C-N 123.216 0.322 . . . . 15.84 110.46 177.163 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.3 pttt 47.65 43.3 16.36 Favored 'General case' 0 C--N 1.365 1.275 0 CA-C-O 122.333 1.063 . . . . 15.7 109.942 -173.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 14.3 m -57.22 -5.62 0.31 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 127.096 2.158 . . . . 11.31 113.927 -175.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.77 -59.41 4.59 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.69 -0.485 . . . . 13.54 109.69 177.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 26.2 mmt -101.32 -11.18 19.65 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.144 -0.48 . . . . 14.44 111.266 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.509 ' O ' ' HD2' ' A' ' 7' ' ' HIS . . . -72.08 -11.64 60.84 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.2 0.524 . . . . 10.19 111.258 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.46 ' HG2' ' HD1' ' A' ' 4' ' ' HIS . 0.0 OUTLIER -87.88 -1.65 58.11 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 112.557 0.577 . . . . 10.91 112.557 178.552 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.53 105.29 1.8 Allowed 'General case' 0 C--O 1.237 0.41 0 N-CA-C 109.06 -0.719 . . . . 9.53 109.06 177.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.536 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 13.7 mmmm 67.11 117.46 0.03 OUTLIER 'General case' 0 C--N 1.353 0.718 0 O-C-N 124.421 1.076 . . . . 11.55 111.262 -172.209 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -145.82 133.64 21.22 Favored 'General case' 0 C--N 1.297 -1.701 0 C-N-CA 120.243 -0.583 . . . . 6.8 109.735 175.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 88.3 mt 59.1 85.07 0.1 Allowed 'General case' 0 N--CA 1.468 0.447 0 O-C-N 124.643 1.215 . . . . 7.19 112.002 -177.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -79.11 149.34 32.09 Favored 'General case' 0 N--CA 1.427 -1.579 0 N-CA-C 108.797 -0.816 . . . . 7.7 108.797 -179.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -127.81 -73.49 0.6 Allowed 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 116.588 -0.278 . . . . 9.24 111.351 -176.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -144.87 100.14 3.45 Favored 'General case' 0 N--CA 1.431 -1.378 0 CA-C-O 120.868 0.366 . . . . 6.55 111.046 -177.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -100.31 142.97 31.05 Favored 'General case' 0 C--O 1.252 1.207 0 CA-C-N 115.365 -0.834 . . . . 10.38 109.651 176.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -77.99 123.9 27.37 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.647 -0.706 . . . . 7.72 110.879 -178.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -128.41 104.78 7.89 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 109.242 -0.651 . . . . 8.49 109.242 178.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -166.77 -62.85 0.03 OUTLIER Glycine 0 N--CA 1.442 -0.963 0 N-CA-C 110.858 -0.897 . . . . 7.69 110.858 -178.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 14.9 mmmm -86.15 -178.17 6.45 Favored 'General case' 0 C--O 1.247 0.923 0 N-CA-C 109.269 -0.641 . . . . 9.15 109.269 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -77.65 82.79 1.16 Allowed Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.921 -0.657 . . . . 8.66 113.366 -177.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 36.4 p -78.05 105.99 9.63 Favored 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 108.913 -0.773 . . . . 9.53 108.913 176.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -121.15 -76.26 0.59 Allowed 'General case' 0 C--N 1.31 -1.144 0 C-N-CA 120.562 -0.455 . . . . 12.43 110.687 -177.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.0 mp -100.26 -35.7 9.53 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.449 -0.501 . . . . 10.35 111.389 178.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.498 ' O ' ' HD2' ' A' ' 42' ' ' LYS . 30.9 tt0 59.59 94.54 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.083 0.953 . . . . 7.86 110.798 -177.125 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -158.07 -46.77 0.06 Allowed 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 116.142 -0.481 . . . . 6.22 110.24 -178.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 25.3 p-10 -47.17 -46.77 23.85 Favored 'General case' 0 C--O 1.215 -0.742 0 N-CA-C 114.513 1.301 . . . . 7.34 114.513 -176.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -136.84 32.95 2.68 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.624 -0.43 . . . . 8.26 111.946 -177.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.498 ' HD2' ' O ' ' A' ' 38' ' ' GLU . 20.2 ptmt -83.46 8.6 13.41 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 120.228 -0.589 . . . . 8.58 110.747 -179.049 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -98.65 0.16 44.16 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.413 -0.812 . . . . 6.63 110.085 178.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 1.3 mpt? 56.27 78.02 0.22 Allowed 'General case' 0 C--N 1.347 0.492 0 O-C-N 124.276 0.985 . . . . 7.93 111.496 -176.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.467 ' HB2' ' O ' ' A' ' 55' ' ' PHE . 62.6 m -61.26 -72.52 0.12 Allowed 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 114.816 -1.084 . . . . 4.16 112.253 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.516 ' O ' ' HA ' ' A' ' 54' ' ' THR . 75.4 mt -129.6 129.73 66.75 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 N-CA-C 108.019 -1.104 . . . . 3.76 108.019 -178.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.61 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 28.8 tt0 -97.9 130.33 44.79 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 108.728 -0.841 . . . . 7.28 108.728 178.265 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.584 ' SG ' HG21 ' A' ' 50' ' ' VAL . 41.9 t -67.56 123.6 20.89 Favored 'General case' 0 N--CA 1.421 -1.88 0 CA-C-N 115.708 -0.678 . . . . 5.75 110.479 178.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.451 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -50.07 -33.15 17.51 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 127.17 2.188 . . . . 5.98 111.608 -177.759 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.584 HG21 ' SG ' ' A' ' 48' ' ' CYS . 10.2 m -59.1 -23.18 23.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 N-CA-C 112.765 0.654 . . . . 7.94 112.765 -175.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.9 t -173.63 -81.93 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 120.734 0.302 . . . . 9.38 110.89 178.29 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.475 ' HA ' ' CG ' ' A' ' 47' ' ' GLN . 55.0 ttp -165.5 36.73 0.06 Allowed 'General case' 0 CA--C 1.547 0.832 0 CA-C-O 122.326 1.06 . . . . 9.71 109.736 -174.573 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.61 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 14.7 mm-40 -88.99 -177.27 5.42 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 107.302 -1.369 . . . . 9.17 107.302 -178.497 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.516 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 13.3 t -144.32 149.22 35.87 Favored 'General case' 0 N--CA 1.42 -1.952 0 C-N-CA 117.156 -1.817 . . . . 6.39 113.041 -177.613 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.467 ' O ' ' HB2' ' A' ' 45' ' ' SER . 98.4 m-85 -125.93 153.74 43.82 Favored 'General case' 0 N--CA 1.418 -2.068 0 N-CA-C 106.826 -1.546 . . . . 5.78 106.826 177.192 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 9.0 tp -79.32 139.72 17.91 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.342 0 O-C-N 123.411 0.444 . . . . 5.53 110.377 -178.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.0 t -81.16 74.7 8.16 Favored 'General case' 0 N--CA 1.429 -1.525 0 N-CA-C 108.683 -0.858 . . . . 4.52 108.683 177.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 9.8 t -92.26 1.14 57.4 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.406 -0.816 . . . . 6.29 109.951 177.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 92.5 m -156.54 137.26 13.29 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 108.014 -1.106 . . . . 6.33 108.014 178.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 17.9 m -78.72 138.23 38.16 Favored 'General case' 0 N--CA 1.419 -1.997 0 O-C-N 123.522 0.514 . . . . 6.87 110.038 -175.893 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -51.08 -29.33 12.73 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 124.915 1.286 . . . . 4.86 112.295 178.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 64.3 t -72.54 -32.42 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.78 0 CA-C-O 120.913 0.387 . . . . 7.56 111.384 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -71.52 -39.59 70.67 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 122.322 1.058 . . . . 9.7 108.96 177.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 55.6 m -62.47 -38.16 88.75 Favored 'General case' 0 C--N 1.271 -2.814 0 CA-C-N 113.885 -1.507 . . . . 6.07 109.462 174.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 23.5 ttt180 -57.68 -51.74 68.29 Favored 'General case' 0 N--CA 1.444 -0.768 0 C-N-CA 123.811 0.845 . . . . 8.11 112.895 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -61.7 -38.22 87.03 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-O 121.488 0.661 . . . . 9.78 111.346 -177.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 32.0 t60 -76.67 -31.8 57.53 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.857 -0.61 . . . . 9.61 109.898 -177.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.487 ' O ' ' HB3' ' A' ' 72' ' ' HIS . . . -75.99 -25.39 55.74 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 115.753 -0.658 . . . . 6.53 111.717 -177.624 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -83.17 -21.03 33.64 Favored 'General case' 0 C--N 1.294 -1.839 0 C-N-CA 120.03 -0.668 . . . . 8.5 111.512 176.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.47 -32.44 37.11 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.08 0.466 . . . . 9.9 110.493 175.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.409 ' HB3' ' HD3' ' A' ' 73' ' ' PRO . 13.5 mptt -101.45 -86.54 0.41 Allowed 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.948 0.721 . . . . 10.62 112.948 -179.002 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.487 ' HB3' ' O ' ' A' ' 68' ' ' ALA 0.256 23.9 p80 46.38 59.01 16.21 Favored Pre-proline 0 N--CA 1.485 1.276 0 N-CA-C 116.052 1.871 . . . . 8.11 116.052 -177.306 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.485 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 6.2 Cg_exo -82.34 -55.43 0.03 OUTLIER 'Trans proline' 0 N--CA 1.434 -2.016 0 C-N-CA 121.77 1.647 . . . . 7.3 112.063 175.235 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 12.7 ptmm? -160.84 108.82 1.56 Allowed 'General case' 0 N--CA 1.436 -1.16 0 CA-C-O 121.435 0.636 . . . . 7.81 111.819 -177.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -73.07 88.88 1.43 Allowed 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 106.777 -1.564 . . . . 4.52 106.777 171.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -113.19 -75.24 0.6 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.014 -0.994 . . . . 6.83 110.66 -172.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 34.8 m -78.64 -11.91 13.34 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.832 0 CA-C-O 121.893 0.854 . . . . 8.44 108.743 176.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 33.4 m -109.29 13.1 8.68 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.025 0 CA-C-N 114.393 -1.276 . . . . 6.03 109.246 177.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.32 -6.0 12.55 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 121.725 0.774 . . . . 4.71 110.604 177.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 18.4 p -70.85 -27.31 63.75 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-N 114.813 -1.085 . . . . 6.16 109.634 176.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -155.02 88.22 3.22 Favored Pre-proline 0 N--CA 1.439 -0.986 0 N-CA-C 106.866 -1.531 . . . . 6.08 106.866 174.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -60.6 5.49 0.14 Allowed 'Trans proline' 0 N--CA 1.503 2.061 0 C-N-CA 124.212 3.275 . . . . 3.27 115.063 -172.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 65.1 m-70 -87.96 -8.58 55.5 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 109.205 -0.665 . . . . 4.77 109.205 174.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 36.9 mt -99.32 8.77 44.4 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.848 -0.615 . . . . 5.47 111.128 -176.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.454 ' CG ' ' HB2' ' A' ' 68' ' ' ALA . 18.9 pttp -50.65 105.74 0.11 Allowed 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 122.003 0.906 . . . . 8.41 113.227 179.588 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 81.7 tttt . . . . . 0 N--CA 1.441 -0.908 0 CA-C-N 113.696 -1.593 . . . . 11.5 110.154 -175.087 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.215 -1.092 0 N-CA-C 110.714 -0.954 . . . . 19.39 110.714 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 9.1 p-80 -98.44 178.93 4.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 117.231 0.515 . . . . 20.25 111.652 -178.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 53.4 m80 -100.44 158.33 15.98 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.193 -0.458 . . . . 18.12 110.024 178.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 31.1 t60 -102.18 128.68 48.58 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 120.745 0.307 . . . . 14.86 110.49 -176.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 73.0 t60 -158.68 138.0 11.58 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 108.506 -0.924 . . . . 14.68 108.506 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 44.8 t-80 -61.29 128.36 36.01 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 108.906 -0.776 . . . . 14.28 108.906 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 39.9 m80 -67.49 156.97 35.38 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.698 -0.401 . . . . 10.72 110.608 178.919 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 84.2 mt 82.59 -17.08 0.54 Allowed 'General case' 0 N--CA 1.497 1.887 0 C-N-CA 125.555 1.542 . . . . 10.4 111.337 -176.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -87.15 100.54 12.74 Favored 'General case' 0 C--O 1.244 0.806 0 CA-C-O 119.356 -0.354 . . . . 11.87 110.292 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.92 129.71 0.38 Allowed Glycine 0 C--O 1.246 0.892 0 C-N-CA 120.82 -0.705 . . . . 10.09 112.934 177.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -76.18 80.62 1.1 Allowed Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 121.642 -0.313 . . . . 8.45 112.789 -176.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -113.3 41.93 2.08 Favored Glycine 0 C--N 1.316 -0.566 0 C-N-CA 120.852 -0.69 . . . . 9.5 112.678 179.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . 0.63 ' O ' ' HA ' ' A' ' 19' ' ' MET . 13.4 m120 -126.21 140.4 52.58 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 122.619 -0.342 . . . . 10.0 110.752 -179.067 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.473 ' HA ' ' HG2' ' A' ' 19' ' ' MET . . . -89.11 166.05 14.1 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 114.025 1.121 . . . . 11.12 114.025 -172.666 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 71.75 173.23 0.31 Allowed 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 125.421 1.489 . . . . 15.84 110.111 -179.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.531 ' HB3' ' HA ' ' A' ' 22' ' ' ALA . 23.0 tptm 75.32 -56.67 0.61 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.611 1.164 . . . . 15.7 113.369 174.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.458 ' HB2' ' H ' ' A' ' 21' ' ' ARG . 38.6 m -132.21 26.36 4.52 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 116.252 -0.431 . . . . 11.31 109.962 -178.578 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 55.06 41.66 31.55 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.647 -0.706 . . . . 13.54 109.679 -179.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' MET . . . . . 0.63 ' HA ' ' O ' ' A' ' 13' ' ' ASN . 65.5 mtt 78.97 6.27 2.22 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 114.637 -1.165 . . . . 14.44 112.335 -178.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.423 ' HB3' ' HB3' ' A' ' 17' ' ' SER . . . -75.9 -30.83 58.94 Favored 'General case' 0 C--O 1.225 -0.233 0 C-N-CA 118.512 -1.275 . . . . 10.19 109.477 178.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.458 ' H ' ' HB2' ' A' ' 17' ' ' SER . 25.1 ptt180 -178.2 83.71 0.02 OUTLIER 'General case' 0 C--O 1.206 -1.222 0 C-N-CA 124.204 1.002 . . . . 10.91 110.862 -178.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.531 ' HA ' ' HB3' ' A' ' 16' ' ' LYS . . . -63.53 -82.83 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 119.305 -0.958 . . . . 9.53 111.702 175.214 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -131.4 15.91 4.98 Favored 'General case' 0 CA--C 1.491 -1.31 0 N-CA-C 106.193 -1.78 . . . . 11.55 106.193 175.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -84.31 -35.84 23.02 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 113.724 -1.58 . . . . 6.8 112.411 -172.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -120.18 -79.03 0.6 Allowed 'General case' 0 C--O 1.213 -0.817 0 C-N-CA 120.163 -0.615 . . . . 7.19 110.123 -174.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 52.24 95.07 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 114.87 1.433 . . . . 7.7 114.87 -178.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt 70.37 102.16 0.06 Allowed 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.296 1.038 . . . . 9.24 111.49 179.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.93 -53.98 11.42 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 115.302 -0.863 . . . . 6.55 112.428 -175.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -113.69 8.46 17.54 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-O 121.334 0.588 . . . . 10.38 110.164 -177.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -117.87 20.54 13.31 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 115.437 -0.801 . . . . 7.72 109.776 179.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.01 141.44 43.93 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 115.039 -0.982 . . . . 8.49 111.108 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -102.01 -139.98 10.86 Favored Glycine 0 C--O 1.251 1.207 0 C-N-CA 120.976 -0.631 . . . . 7.69 113.472 -178.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 46.5 mmtm -147.71 31.95 0.87 Allowed 'General case' 0 C--O 1.244 0.815 0 C-N-CA 124.647 1.179 . . . . 9.15 109.776 -178.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -115.84 176.43 16.49 Favored Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.864 -0.607 . . . . 8.66 111.912 -178.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 31.3 t 174.47 -40.09 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 107.298 -1.371 . . . . 9.53 107.298 -178.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -78.53 -173.08 3.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.52 -1.218 . . . . 12.43 109.379 177.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 54.1 tp -55.67 -45.74 77.67 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 123.502 0.501 . . . . 10.35 110.432 177.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 66.95 118.5 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.245 0 CA-C-O 122.523 1.154 . . . . 7.86 114.062 175.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -87.51 149.99 24.02 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 115.284 -0.871 . . . . 6.22 110.885 -178.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -53.74 -45.78 70.66 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 123.562 0.539 . . . . 7.34 110.7 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -96.44 33.92 1.72 Allowed 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.228 0.455 . . . . 8.26 112.228 -179.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 79.0 tttt -59.91 -39.14 84.41 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 108.93 -0.767 . . . . 8.58 108.93 173.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . 176.62 -20.28 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.213 0 CA-C-N 115.02 -0.991 . . . . 6.63 110.978 178.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 72.1 mtm -70.19 89.35 0.64 Allowed 'General case' 0 CA--C 1.5 -0.963 0 CA-C-O 121.654 0.74 . . . . 7.93 109.122 178.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.561 ' HB2' ' O ' ' A' ' 55' ' ' PHE . 75.3 m -143.89 -73.04 0.27 Allowed 'General case' 0 N--CA 1.413 -2.321 0 CA-C-N 114.561 -1.2 . . . . 4.16 113.872 -174.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.568 ' O ' ' HA ' ' A' ' 54' ' ' THR . 44.3 mt -111.79 136.67 47.2 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.492 0 O-C-N 121.868 -0.52 . . . . 3.76 109.816 -177.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.642 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 19.3 tt0 -97.59 123.98 41.69 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 109.504 -0.554 . . . . 7.28 109.504 -176.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.697 ' SG ' HG21 ' A' ' 50' ' ' VAL . 34.2 t -60.46 141.78 55.98 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.725 1.61 . . . . 5.75 114.052 -173.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.432 ' HD2' ' O ' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -72.12 -31.96 66.51 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.338 1.455 . . . . 5.98 109.467 -177.77 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.697 HG21 ' SG ' ' A' ' 48' ' ' CYS . 5.9 m -61.28 -26.58 39.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 115.868 -0.606 . . . . 7.94 111.6 -174.488 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.7 t -161.86 -76.72 0.05 OUTLIER 'General case' 0 N--CA 1.426 -1.646 0 CA-C-N 115.967 -0.56 . . . . 9.38 109.97 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.501 ' HG2' ' NE2' ' A' ' 47' ' ' GLN . 34.3 ttp 178.51 35.75 0.0 OUTLIER 'General case' 0 C--O 1.212 -0.892 0 CA-C-O 121.925 0.869 . . . . 9.71 108.84 -175.49 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.642 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 14.4 mm-40 -93.92 -164.7 1.21 Allowed 'General case' 0 C--O 1.191 -1.983 0 N-CA-C 108.0 -1.111 . . . . 9.17 108.0 -172.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.568 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 15.3 t -137.14 162.41 33.49 Favored 'General case' 0 C--N 1.313 -0.999 0 C-N-CA 116.828 -1.949 . . . . 6.39 113.184 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.561 ' O ' ' HB2' ' A' ' 45' ' ' SER . 96.6 m-85 -144.18 177.9 8.27 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 126.626 1.97 . . . . 5.78 106.978 177.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 7.5 tp -86.95 134.73 26.81 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 CA-C-O 120.977 0.418 . . . . 5.53 111.994 -176.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.534 ' CB ' ' HB3' ' A' ' 45' ' ' SER . 10.3 t -110.4 85.0 2.02 Favored 'General case' 0 N--CA 1.413 -2.296 0 N-CA-C 107.353 -1.351 . . . . 4.52 107.353 175.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.9 p -55.27 -35.13 64.69 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.17 -0.923 . . . . 6.29 111.681 174.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.515 HG21 ' H ' ' A' ' 61' ' ' GLU . 14.2 t -109.09 -155.44 0.56 Allowed 'General case' 0 CA--C 1.556 1.176 0 N-CA-C 108.723 -0.843 . . . . 6.33 108.723 -178.105 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.0 t -100.07 21.74 12.36 Favored 'General case' 0 CA--C 1.554 1.097 0 N-CA-C 109.68 -0.489 . . . . 6.87 109.68 177.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.515 ' H ' HG21 ' A' ' 59' ' ' THR . 29.7 tt0 64.78 -50.88 0.32 Allowed 'General case' 0 N--CA 1.503 2.191 0 C-N-CA 126.361 1.864 . . . . 4.86 111.942 -175.163 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.473 ' O ' ' HB3' ' A' ' 65' ' ' ARG . 57.7 t -51.01 -29.49 7.9 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 C-N-CA 125.361 1.464 . . . . 7.56 112.956 -176.86 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.523 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 4.7 tmtm? -72.5 -38.07 68.23 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 122.038 0.923 . . . . 9.7 108.898 -179.311 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 85.6 m -75.78 -29.28 58.72 Favored 'General case' 0 C--N 1.284 -2.259 0 N-CA-C 109.038 -0.727 . . . . 6.07 109.038 176.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.473 ' HB3' ' O ' ' A' ' 62' ' ' VAL . 21.8 tpt180 -56.86 -55.34 35.65 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.421 1.088 . . . . 8.11 111.34 177.631 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -59.1 -37.61 77.55 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 123.981 0.801 . . . . 9.78 110.73 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 52.8 t60 -76.7 -26.77 55.08 Favored 'General case' 0 C--O 1.21 -1.023 0 C-N-CA 120.368 -0.533 . . . . 9.61 111.501 -178.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.449 ' O ' ' HB2' ' A' ' 72' ' ' HIS . . . -82.13 -38.03 25.38 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 111.771 0.286 . . . . 6.53 111.771 -177.08 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -73.49 -23.49 60.06 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.3 0.571 . . . . 8.5 110.297 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -89.63 -7.0 55.69 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.596 -0.729 . . . . 9.9 111.437 178.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -136.0 -85.87 0.36 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 111.962 0.356 . . . . 10.62 111.962 -177.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.467 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 44.3 t-80 51.25 51.8 10.95 Favored Pre-proline 0 CA--C 1.561 1.37 0 C-N-CA 123.743 0.817 . . . . 8.11 110.272 -178.197 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.467 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 31.4 Cg_exo -61.11 -46.67 14.7 Favored 'Trans proline' 0 C--N 1.382 2.301 0 C-N-CA 121.481 1.454 . . . . 7.3 110.79 -176.104 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.451 ' HG3' ' OD2' ' A' ' 76' ' ' ASP . 15.5 pttp -167.49 106.23 0.55 Allowed 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 115.196 -0.911 . . . . 7.81 109.075 179.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.476 ' HA ' ' CG ' ' A' ' 85' ' ' LYS . . . -57.7 -54.7 43.94 Favored 'General case' 0 CA--C 1.564 1.518 0 N-CA-C 114.494 1.294 . . . . 4.52 114.494 177.645 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.451 ' OD2' ' HG3' ' A' ' 74' ' ' LYS . 13.5 m-20 56.43 -94.73 0.05 OUTLIER 'General case' 0 N--CA 1.518 2.958 0 C-N-CA 124.455 1.102 . . . . 6.83 113.136 -178.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.6 m -85.66 -17.03 9.72 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.746 0 CA-C-N 115.353 -0.84 . . . . 8.44 110.894 -176.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.458 ' CG2' ' HG2' ' A' ' 85' ' ' LYS . 26.3 m -103.18 13.51 6.94 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.639 0 N-CA-C 109.079 -0.711 . . . . 6.03 109.079 175.154 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.9 -12.91 28.31 Favored 'General case' 0 N--CA 1.489 1.483 0 CA-C-O 121.429 0.633 . . . . 4.71 111.687 176.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 71.6 m -74.98 -11.59 60.14 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-N 115.803 -0.635 . . . . 6.16 110.262 176.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.469 ' CE2' ' HB2' ' A' ' 83' ' ' HIS . 25.8 t80 -167.78 83.37 0.8 Allowed Pre-proline 0 N--CA 1.435 -1.198 0 N-CA-C 108.226 -1.027 . . . . 6.08 108.226 172.108 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -63.07 11.26 0.09 OUTLIER 'Trans proline' 0 N--CA 1.498 1.741 0 C-N-CA 124.384 3.39 . . . . 3.27 116.053 -173.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.469 ' HB2' ' CE2' ' A' ' 81' ' ' PHE . 50.3 m170 -87.19 -1.62 58.03 Favored 'General case' 0 C--O 1.193 -1.908 0 N-CA-C 109.026 -0.731 . . . . 4.77 109.026 174.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 45.2 mt -101.54 0.17 36.05 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 113.556 0.947 . . . . 5.47 113.556 -172.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.476 ' CG ' ' HA ' ' A' ' 75' ' ' ALA 0.314 21.9 mmmt -67.86 156.85 36.2 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 117.308 2.336 . . . . 8.41 117.308 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.449 ' H ' ' HE3' ' A' ' 85' ' ' LYS . 14.0 mmmm . . . . . 0 C--N 1.297 -1.714 0 CA-C-N 111.753 -2.476 . . . . 11.5 108.068 -179.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.18 0 N-CA-C 111.409 -0.676 . . . . 19.39 111.409 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 37.0 m-70 -83.34 141.71 31.58 Favored 'General case' 0 C--O 1.247 0.932 0 CA-C-O 121.168 0.509 . . . . 20.25 110.912 -178.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 77.0 m-70 -93.12 157.98 16.0 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 115.723 -0.672 . . . . 18.12 109.498 -178.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 26.5 m80 68.05 83.63 0.16 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.183 0.993 . . . . 14.86 110.262 -179.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 13.6 p-80 -144.72 121.75 11.4 Favored 'General case' 0 C--O 1.207 -1.168 0 C-N-CA 119.724 -0.791 . . . . 14.68 111.588 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 35.7 m80 35.53 92.27 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.202 0 N-CA-C 115.181 1.549 . . . . 14.28 115.181 173.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 32.2 m-70 -105.7 152.64 22.9 Favored 'General case' 0 C--N 1.314 -0.948 0 O-C-N 121.643 -0.66 . . . . 10.72 112.599 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.408 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 2.7 pp -124.08 2.24 8.61 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 124.915 1.286 . . . . 10.4 108.622 174.72 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -112.76 129.52 56.39 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 105.128 -2.175 . . . . 11.87 105.128 -179.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 106.55 138.3 8.98 Favored Glycine 0 N--CA 1.431 -1.657 0 C-N-CA 120.918 -0.658 . . . . 10.09 111.539 -177.213 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -154.88 170.44 33.13 Favored Glycine 0 N--CA 1.435 -1.371 0 N-CA-C 109.919 -1.272 . . . . 8.45 109.919 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 110.02 -7.83 31.23 Favored Glycine 0 CA--C 1.502 -0.774 0 C-N-CA 120.716 -0.754 . . . . 9.5 111.801 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 71.05 175.09 0.29 Allowed 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.252 1.021 . . . . 10.0 112.026 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -147.85 26.89 0.99 Allowed 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 109.229 -0.656 . . . . 11.12 109.229 179.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 71.0 -64.33 0.38 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.083 1.353 . . . . 15.84 111.36 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.497 ' HZ3' ' HB3' ' A' ' 16' ' ' LYS . 8.2 mtpm? -89.18 21.73 3.11 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 121.734 0.778 . . . . 15.7 110.086 179.057 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.427 ' HA ' ' HB2' ' A' ' 20' ' ' ALA . 4.7 p -76.02 -3.59 36.57 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.389 1.076 . . . . 11.31 113.59 -177.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -45.13 -48.09 12.2 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.466 1.106 . . . . 13.54 113.161 -176.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 88.0 mtp -121.61 3.86 10.13 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.304 0.574 . . . . 14.44 110.563 178.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.427 ' HB2' ' HA ' ' A' ' 17' ' ' SER . . . -86.82 -23.95 25.17 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.662 -0.699 . . . . 10.19 110.1 -179.632 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.499 ' HE ' ' HA ' ' A' ' 21' ' ' ARG . 0.2 OUTLIER -101.76 -60.28 1.56 Allowed 'General case' 0 C--O 1.245 0.823 0 CA-C-N 116.224 -0.444 . . . . 10.91 110.348 178.747 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 67.59 -54.69 0.48 Allowed 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 124.893 1.277 . . . . 9.53 113.7 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.408 ' HD2' ' HB3' ' A' ' 8' ' ' LEU . 23.9 ttmm -98.17 -72.99 0.63 Allowed 'General case' 0 N--CA 1.412 -2.361 0 C-N-CA 122.878 0.471 . . . . 11.55 110.179 -179.17 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.415 ' HB3' ' HB3' ' A' ' 21' ' ' ARG . 3.3 p-10 47.8 -174.32 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 126.782 2.033 . . . . 6.8 114.826 178.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 62.9 tp -90.39 127.11 36.1 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-N 115.233 -0.894 . . . . 7.19 109.365 177.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -89.94 154.85 19.53 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.325 -0.852 . . . . 7.7 110.778 -178.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.527 ' HB3' ' HZ2' ' A' ' 27' ' ' LYS . 6.9 mtpm? -117.65 -83.67 0.64 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.241 0.543 . . . . 9.24 109.927 177.607 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -104.54 171.16 7.48 Favored 'General case' 0 N--CA 1.433 -1.282 0 N-CA-C 109.071 -0.715 . . . . 6.55 109.071 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.01 144.53 16.28 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.839 -0.619 . . . . 10.38 109.392 178.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -151.07 165.31 34.22 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 109.391 -0.596 . . . . 7.72 109.391 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -145.04 139.83 27.69 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 108.47 -0.937 . . . . 8.49 108.47 177.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 178.38 -159.0 24.07 Favored Glycine 0 N--CA 1.43 -1.761 0 N-CA-C 110.39 -1.084 . . . . 7.69 110.39 -178.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -135.59 104.83 5.95 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.351 -0.611 . . . . 9.15 109.351 -179.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -149.59 114.63 0.67 Allowed Glycine 0 N--CA 1.44 -1.038 0 C-N-CA 121.099 -0.572 . . . . 8.66 111.803 -178.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 43.0 m -152.84 172.7 16.34 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.594 -1.261 . . . . 9.53 107.594 179.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -154.88 134.42 12.68 Favored 'General case' 0 CA--C 1.502 -0.901 0 N-CA-C 109.945 -0.391 . . . . 12.43 109.945 -179.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 54.8 tp 69.63 -59.25 0.5 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.837 1.255 . . . . 10.35 111.004 -178.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -87.35 128.6 35.19 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 123.784 0.833 . . . . 7.86 110.147 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -159.87 110.75 1.94 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.027 -0.731 . . . . 6.22 109.027 178.813 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -108.92 21.04 17.75 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 120.907 0.384 . . . . 7.34 111.968 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -78.81 13.51 1.67 Allowed 'General case' 0 N--CA 1.482 1.171 0 O-C-N 121.938 -0.476 . . . . 8.26 112.264 -178.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -69.43 -19.75 63.79 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.19 0.519 . . . . 8.58 110.985 -179.335 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -91.82 12.58 20.98 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 116.145 -0.48 . . . . 6.63 111.64 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 47.2 tpp 75.33 -3.85 2.5 Favored 'General case' 0 N--CA 1.503 2.213 0 C-N-CA 124.486 1.114 . . . . 7.93 111.757 178.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . 0.264 32.6 p 48.02 -98.74 0.05 OUTLIER 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 116.177 1.917 . . . . 4.16 116.177 179.058 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.506 ' O ' ' HA ' ' A' ' 54' ' ' THR . 70.2 mt -127.32 127.07 68.77 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.251 0 N-CA-C 109.414 -0.587 . . . . 3.76 109.414 -177.524 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.641 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 26.1 tt0 -99.52 133.38 43.93 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 109.133 -0.691 . . . . 7.28 109.133 -178.025 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.492 ' SG ' HG21 ' A' ' 50' ' ' VAL . 49.5 t -72.53 131.75 42.91 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 115.69 -0.687 . . . . 5.75 112.584 -177.465 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 5.9 ttpt -52.9 -29.39 28.11 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 127.097 2.159 . . . . 5.98 112.465 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.492 HG21 ' SG ' ' A' ' 48' ' ' CYS . 14.6 m -63.58 -27.78 43.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.984 -0.553 . . . . 7.94 112.223 -172.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 48.2 t -170.72 -77.5 0.02 OUTLIER 'General case' 0 N--CA 1.434 -1.267 0 CA-C-N 116.208 -0.451 . . . . 9.38 110.047 -178.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.44 ' O ' ' HG2' ' A' ' 52' ' ' MET . 26.9 ttt -171.51 39.85 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.664 0 CA-C-O 121.965 0.888 . . . . 9.71 109.817 -175.172 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.641 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 18.4 mm-40 -92.52 -173.41 3.36 Favored 'General case' 0 C--O 1.203 -1.394 0 N-CA-C 108.38 -0.971 . . . . 9.17 108.38 -177.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.506 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 9.6 t -139.21 161.81 36.51 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 118.111 -1.436 . . . . 6.39 112.461 -177.589 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -141.1 148.62 40.42 Favored 'General case' 0 N--CA 1.433 -1.322 0 C-N-CA 126.244 1.818 . . . . 5.78 106.527 178.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.1 tp -70.43 136.37 26.16 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.694 0 CA-C-O 121.061 0.458 . . . . 5.53 111.975 -177.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 16.6 p -81.68 76.66 8.58 Favored 'General case' 0 N--CA 1.423 -1.78 0 CA-C-O 121.811 0.815 . . . . 4.52 110.534 175.096 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.5 m -63.46 -8.59 9.66 Favored 'General case' 0 CA--C 1.568 1.659 0 CA-C-N 114.817 -1.083 . . . . 6.29 110.752 175.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.408 ' C ' ' H ' ' A' ' 61' ' ' GLU . 32.9 m -146.21 172.99 12.63 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 105.555 -2.017 . . . . 6.33 105.555 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 12.5 m -74.54 15.85 0.32 Allowed 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 118.987 0.812 . . . . 6.87 112.233 -174.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.416 ' CD ' HH21 ' A' ' 65' ' ' ARG . 35.1 tt0 63.1 -61.67 0.13 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 125.195 1.398 . . . . 4.86 112.066 -177.246 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.0 p -61.06 -28.28 43.37 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.966 0 C-N-CA 123.679 0.792 . . . . 7.56 110.735 -176.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.7 tmtt? -66.2 -41.78 89.69 Favored 'General case' 0 C--O 1.249 1.078 0 N-CA-C 107.142 -1.429 . . . . 9.7 107.142 179.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 55.6 m -66.16 -33.52 75.96 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 114.663 -1.153 . . . . 6.07 108.073 176.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.642 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 94.0 mtt180 -62.01 -37.49 85.07 Favored 'General case' 0 C--O 1.199 -1.559 0 CA-C-N 115.405 -0.816 . . . . 8.11 111.769 178.552 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -56.37 -50.26 72.07 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.642 0.734 . . . . 9.78 109.227 -179.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 76.4 t60 -68.37 -32.13 71.99 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 114.517 -1.219 . . . . 9.61 111.229 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.8 -44.66 31.84 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 112.475 0.546 . . . . 6.53 112.475 -175.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.642 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 11.5 mm-40 -63.51 -32.66 74.18 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.362 0.601 . . . . 8.5 109.467 -178.154 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -88.74 7.97 31.17 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-N 115.312 -0.858 . . . . 9.9 111.628 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -144.17 -85.56 0.14 Allowed 'General case' 0 CA--C 1.508 -0.651 0 C-N-CA 122.501 0.321 . . . . 10.62 111.852 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.412 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 29.4 p80 43.05 57.88 11.74 Favored Pre-proline 0 CA--C 1.554 1.128 0 C-N-CA 124.013 0.925 . . . . 8.11 112.338 -177.143 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.412 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 53.6 Cg_exo -54.92 -36.53 92.13 Favored 'Trans proline' 0 C--N 1.37 1.68 0 C-N-CA 122.934 2.423 . . . . 7.3 113.694 -175.403 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 63.5 pttt -171.86 -40.41 0.02 OUTLIER 'General case' 0 C--N 1.348 0.518 0 N-CA-C 113.3 0.852 . . . . 7.81 113.3 -178.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.436 ' H ' ' HG3' ' A' ' 85' ' ' LYS . . . 76.03 108.66 0.08 Allowed 'General case' 0 C--O 1.212 -0.892 0 C-N-CA 124.387 1.075 . . . . 4.52 109.326 -172.336 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -87.47 -105.58 0.07 Allowed 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 113.899 -1.501 . . . . 6.83 110.102 -169.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.8 m -86.41 -7.65 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.838 0 N-CA-C 107.56 -1.274 . . . . 8.44 107.56 170.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 28.6 m -90.75 14.4 1.45 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.505 0 CA-C-N 113.766 -1.561 . . . . 6.03 109.266 177.2 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.409 ' HA ' ' HB3' ' A' ' 75' ' ' ALA . . . -71.35 1.05 6.77 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 122.079 0.942 . . . . 4.71 110.176 176.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.47 ' HB2' ' HG ' ' A' ' 48' ' ' CYS . 19.9 p -75.76 -22.14 56.77 Favored 'General case' 0 N--CA 1.423 -1.778 0 CA-C-N 114.217 -1.356 . . . . 6.16 109.503 174.188 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.459 ' HD2' ' HG ' ' A' ' 84' ' ' LEU . 27.2 t80 -157.57 91.32 2.31 Favored Pre-proline 0 C--N 1.309 -1.163 0 N-CA-C 106.413 -1.699 . . . . 6.08 106.413 170.59 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -62.04 5.13 0.24 Allowed 'Trans proline' 0 N--CA 1.491 1.326 0 C-N-CA 123.762 2.975 . . . . 3.27 115.41 -172.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.426 ' HB2' ' CE2' ' A' ' 81' ' ' PHE . 76.7 m-70 -100.85 9.99 41.67 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 108.789 -0.819 . . . . 4.77 108.789 177.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.459 ' HG ' ' HD2' ' A' ' 81' ' ' PHE . 60.8 mt -111.31 1.43 17.1 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 115.691 -0.686 . . . . 5.47 111.254 178.448 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.643 ' HD3' ' H ' ' A' ' 86' ' ' LYS . 5.7 tmtm? -74.58 157.55 35.24 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 105.509 -2.034 . . . . 8.41 105.509 177.375 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.643 ' H ' ' HD3' ' A' ' 85' ' ' LYS . 23.5 pttm . . . . . 0 C--N 1.248 -3.833 0 CA-C-O 117.523 -1.227 . . . . 11.5 110.88 -174.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.699 0 N-CA-C 111.349 -0.7 . . . . 19.39 111.349 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 42.0 m80 73.14 127.52 0.04 OUTLIER 'General case' 0 C--N 1.349 0.583 0 C-N-CA 124.263 1.025 . . . . 20.25 111.971 -178.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 74.98 -168.01 0.09 Allowed 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.97 0.908 . . . . 18.12 110.184 -177.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -93.42 166.89 12.06 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.579 -0.448 . . . . 14.86 111.253 -176.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -73.41 -28.67 62.12 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 112.596 0.591 . . . . 14.68 112.596 -177.535 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 46.0 m80 -123.18 130.97 53.47 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 120.251 -0.579 . . . . 14.28 111.232 -177.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 60.9 t60 -134.75 119.89 18.77 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.136 -0.484 . . . . 10.72 109.937 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.435 ' C ' ' H ' ' A' ' 10' ' ' GLY . 6.0 tt 68.56 -64.64 0.3 Allowed 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 125.696 1.598 . . . . 10.4 112.484 178.847 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -75.61 21.35 0.15 Allowed 'General case' 0 N--CA 1.486 1.336 0 CA-C-O 121.281 0.563 . . . . 11.87 112.213 -176.386 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.435 ' H ' ' C ' ' A' ' 8' ' ' LEU . . . -118.46 -40.51 0.67 Allowed Glycine 0 N--CA 1.424 -2.122 0 CA-C-N 115.884 -0.598 . . . . 10.09 112.619 -178.678 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 78.23 -131.56 11.0 Favored Glycine 0 CA--C 1.505 -0.585 0 C-N-CA 120.418 -0.896 . . . . 8.45 111.199 -176.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 76.74 62.53 2.5 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.65 -0.786 . . . . 9.5 113.822 177.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 39.2 t30 -80.0 102.63 9.37 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 108.618 -0.882 . . . . 10.0 108.618 175.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -141.38 91.55 2.39 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.074 0.464 . . . . 11.12 110.206 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 52.3 mt-30 64.23 169.23 0.17 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.35 1.06 . . . . 15.84 110.755 -177.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.449 ' HB2' ' HZ2' ' A' ' 16' ' ' LYS . 0.1 OUTLIER 60.65 24.06 13.85 Favored 'General case' 0 N--CA 1.486 1.337 0 CA-C-O 121.588 0.709 . . . . 15.7 109.719 -177.291 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.2 m -65.2 -3.42 3.87 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.55 1.14 . . . . 11.31 112.957 -175.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.61 -35.5 81.0 Favored 'General case' 0 N--CA 1.439 -1.017 0 N-CA-C 109.405 -0.591 . . . . 13.54 109.405 175.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 89.1 mtp -126.28 -19.1 4.77 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 112.557 0.577 . . . . 14.44 112.557 178.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.9 -7.95 49.37 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 112.456 0.539 . . . . 10.19 112.456 -178.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 85.3 mtm180 -100.08 -17.79 17.29 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.365 0.602 . . . . 10.91 109.815 176.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.432 ' C ' ' H ' ' A' ' 24' ' ' ASN . . . -77.13 133.24 39.05 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 115.825 -0.625 . . . . 9.53 109.453 -178.151 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.488 ' H ' ' HG3' ' A' ' 27' ' ' LYS . 40.2 tttp 71.13 -38.68 0.43 Allowed 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 125.755 1.622 . . . . 11.55 112.107 -178.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.432 ' H ' ' C ' ' A' ' 22' ' ' ALA . 53.8 t30 -57.09 -74.79 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.718 1.207 . . . . 6.8 112.513 -176.336 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.4 mt -115.42 -83.06 0.62 Allowed 'General case' 0 C--O 1.244 0.777 0 C-N-CA 120.27 -0.572 . . . . 7.19 112.257 -178.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -103.78 117.43 34.34 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 121.533 0.682 . . . . 7.7 111.247 179.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.488 ' HG3' ' H ' ' A' ' 23' ' ' LYS . 2.9 mppt? -83.42 97.79 9.15 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 114.949 -1.023 . . . . 9.24 111.067 -176.425 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.19 118.14 18.61 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.458 -0.792 . . . . 6.55 111.169 -179.078 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -137.74 133.8 34.55 Favored 'General case' 0 C--N 1.312 -1.033 0 C-N-CA 123.874 0.869 . . . . 10.38 108.709 176.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -133.0 8.89 4.1 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.048 0.452 . . . . 7.72 111.066 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -107.53 100.2 9.64 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-O 120.889 0.376 . . . . 8.49 110.927 -177.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -102.36 -85.32 1.86 Allowed Glycine 0 C--O 1.219 -0.844 0 N-CA-C 111.37 -0.692 . . . . 7.69 111.37 178.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -91.39 26.05 2.38 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 121.13 0.49 . . . . 9.15 109.982 178.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -78.79 100.24 1.7 Allowed Glycine 0 N--CA 1.443 -0.894 0 N-CA-C 111.183 -0.767 . . . . 8.66 111.183 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.0 p -61.3 -45.23 95.32 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 123.07 0.548 . . . . 9.53 111.211 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -171.2 105.18 0.23 Allowed 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 105.496 -2.039 . . . . 12.43 105.496 176.215 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 66.9 tp 68.52 -78.36 0.04 OUTLIER 'General case' 0 C--O 1.252 1.197 0 C-N-CA 123.856 0.862 . . . . 10.35 111.556 -178.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 53.61 83.43 0.07 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.498 0.719 . . . . 7.86 111.417 -175.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -75.52 124.61 27.48 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-N 115.924 -0.58 . . . . 6.22 111.417 -176.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 15.0 m120 64.98 -175.06 0.17 Allowed 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 115.262 -0.881 . . . . 7.34 111.281 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm 68.41 4.66 4.35 Favored 'General case' 0 N--CA 1.502 2.154 0 C-N-CA 124.543 1.137 . . . . 8.26 110.741 175.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 17.1 ttmm -93.17 10.86 29.99 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 122.017 0.913 . . . . 8.58 109.064 -172.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -98.6 9.43 43.28 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.027 -0.988 . . . . 6.63 110.569 -177.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 66.5 mtt 62.21 74.55 0.43 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.478 -0.783 . . . . 7.93 110.387 -176.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.41 ' HB3' ' CB ' ' A' ' 57' ' ' CYS . 31.0 m -52.33 -59.16 4.74 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 114.16 -1.382 . . . . 4.16 112.757 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.46 ' O ' ' HA ' ' A' ' 54' ' ' THR . 65.6 mt -127.88 128.39 69.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 109.294 -0.632 . . . . 3.76 109.294 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.624 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 1.6 tp60 -100.12 124.68 45.8 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 107.116 -1.439 . . . . 7.28 107.116 178.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.657 ' SG ' HG21 ' A' ' 50' ' ' VAL . 26.9 t -59.7 122.45 14.17 Favored 'General case' 0 C--N 1.307 -1.239 0 C-N-CA 124.135 0.974 . . . . 5.75 111.394 -176.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.58 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 1.5 tmmm? -52.02 -31.72 30.94 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 125.363 1.465 . . . . 5.98 111.411 -178.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.657 HG21 ' SG ' ' A' ' 48' ' ' CYS . 7.4 m -63.8 -28.15 44.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 112.176 0.435 . . . . 7.94 112.176 -174.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 54.1 t -161.17 -77.62 0.05 Allowed 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 120.969 -0.292 . . . . 9.38 110.863 -178.031 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.485 ' O ' ' HG2' ' A' ' 52' ' ' MET . 50.1 ttm -178.24 36.55 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.039 0 CA-C-O 121.523 0.678 . . . . 9.71 109.941 -176.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.624 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 22.1 mm-40 -91.99 178.73 5.8 Favored 'General case' 0 C--O 1.188 -2.145 0 O-C-N 121.13 -0.981 . . . . 9.17 109.569 -177.515 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.46 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 27.6 m -128.01 141.35 51.54 Favored 'General case' 0 N--CA 1.413 -2.276 0 C-N-CA 118.12 -1.432 . . . . 6.39 113.385 -173.371 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -126.24 172.55 9.98 Favored 'General case' 0 C--O 1.242 0.677 0 C-N-CA 125.275 1.43 . . . . 5.78 107.823 174.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.409 HD12 ' N ' ' A' ' 57' ' ' CYS . 0.1 OUTLIER -96.63 132.29 41.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 N-CA-C 109.434 -0.58 . . . . 5.53 109.434 -176.585 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.454 ' HB2' HG13 ' A' ' 46' ' ' ILE . 11.4 t -103.87 85.62 2.45 Favored 'General case' 0 N--CA 1.425 -1.704 0 N-CA-C 106.811 -1.551 . . . . 4.52 106.811 176.475 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 11.2 t -56.17 1.69 0.02 OUTLIER 'General case' 0 CA--C 1.579 2.072 0 N-CA-C 115.413 1.634 . . . . 6.29 115.413 178.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 14.9 t -155.33 -164.91 1.87 Allowed 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 106.919 -1.512 . . . . 6.33 106.919 178.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 41.6 t -85.05 135.39 34.02 Favored 'General case' 0 C--N 1.281 -2.375 0 N-CA-C 107.686 -1.227 . . . . 6.87 107.686 175.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.569 ' O ' ' HG3' ' A' ' 65' ' ' ARG . 42.3 tt0 -56.49 -26.89 55.69 Favored 'General case' 0 C--O 1.196 -1.76 0 N-CA-C 110.244 -0.28 . . . . 4.86 110.244 177.039 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 86.5 t -67.09 -30.31 49.02 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 O-C-N 122.06 -0.4 . . . . 7.56 110.722 179.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -71.89 -33.16 68.12 Favored 'General case' 0 C--O 1.257 1.457 0 N-CA-C 107.155 -1.424 . . . . 9.7 107.155 178.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 61' ' ' GLU . 82.1 m -69.21 -40.93 77.71 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-N 114.249 -1.342 . . . . 6.07 109.732 173.339 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.569 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 96.0 mtt180 -60.38 -50.69 72.59 Favored 'General case' 0 CA--C 1.508 -0.642 0 C-N-CA 123.271 0.628 . . . . 8.11 112.09 -177.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -62.49 -33.98 75.96 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.208 0.527 . . . . 9.78 110.687 -179.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 41.4 t60 -75.34 -31.81 60.69 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.093 -0.503 . . . . 9.61 110.936 178.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . 0.403 ' O ' ' HB3' ' A' ' 72' ' ' HIS . . . -73.66 -44.83 55.75 Favored 'General case' 0 CA--C 1.483 -1.615 0 N-CA-C 109.784 -0.45 . . . . 6.53 109.784 179.09 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -71.74 -7.64 49.37 Favored 'General case' 0 C--N 1.315 -0.902 0 O-C-N 123.541 0.525 . . . . 8.5 111.155 178.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.74 -54.32 4.99 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.731 -0.668 . . . . 9.9 109.862 172.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . 0.639 ' HG3' ' OXT' ' A' ' 86' ' ' LYS . 12.3 mmmm -88.05 -77.54 0.35 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.693 -0.685 . . . . 10.62 111.221 -177.36 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.403 ' HB3' ' O ' ' A' ' 68' ' ' ALA 0.25 16.8 p80 40.85 63.62 5.58 Favored Pre-proline 0 N--CA 1.468 0.463 0 N-CA-C 115.087 1.514 . . . . 8.11 115.087 -177.183 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -83.12 -61.04 0.02 OUTLIER 'Trans proline' 0 N--CA 1.431 -2.171 0 C-N-CA 120.951 1.101 . . . . 7.3 111.466 176.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 13.7 pttm -161.32 120.4 2.5 Favored 'General case' 0 N--CA 1.411 -2.421 0 N-CA-C 108.037 -1.097 . . . . 7.81 108.037 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.468 ' O ' ' HB2' ' A' ' 79' ' ' ALA . . . -73.6 100.78 3.42 Favored 'General case' 0 C--N 1.286 -2.172 0 N-CA-C 108.752 -0.833 . . . . 4.52 108.752 175.058 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -95.19 -91.82 0.21 Allowed 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.448 0.642 . . . . 6.83 111.272 -177.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.1 m -79.54 -13.81 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.073 0 N-CA-C 108.151 -1.055 . . . . 8.44 108.151 176.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.467 HG23 ' HA ' ' A' ' 85' ' ' LYS . 13.9 m -92.95 9.32 4.4 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.874 0 CA-C-N 114.635 -1.166 . . . . 6.03 108.603 176.424 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.468 ' HB2' ' O ' ' A' ' 75' ' ' ALA . . . -69.33 -11.15 60.57 Favored 'General case' 0 C--O 1.253 1.249 0 CA-C-O 121.104 0.478 . . . . 4.71 111.638 178.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 66.4 m -79.96 -23.43 41.66 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 115.627 -0.715 . . . . 6.16 109.122 174.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 3.7 p90 -140.74 67.39 28.95 Favored Pre-proline 0 CA--C 1.556 1.173 0 C-N-CA 124.547 1.139 . . . . 6.08 111.334 178.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . 0.403 ' O ' ' HG3' ' A' ' 85' ' ' LYS . 19.7 Cg_exo -69.03 7.45 0.79 Allowed 'Trans proline' 0 C--N 1.366 1.478 0 C-N-CA 123.645 2.897 . . . . 3.27 114.013 -174.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 49.5 m170 -90.84 -7.27 52.77 Favored 'General case' 0 C--O 1.202 -1.413 0 N-CA-C 109.171 -0.677 . . . . 4.77 109.171 177.463 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.432 ' HB3' ' HB3' ' A' ' 64' ' ' CYS . 0.2 OUTLIER -133.51 45.5 2.67 Favored 'General case' 0 N--CA 1.42 -1.929 0 CA-C-N 114.921 -1.036 . . . . 5.47 110.348 178.116 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.467 ' HA ' HG23 ' A' ' 78' ' ' VAL . 98.5 mttt -44.28 -26.03 0.29 Allowed 'General case' 0 CA--C 1.579 2.09 0 N-CA-C 114.822 1.415 . . . . 8.41 114.822 177.009 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.639 ' OXT' ' HG3' ' A' ' 71' ' ' LYS . 23.4 tptm . . . . . 0 N--CA 1.497 1.879 0 N-CA-C 114.053 1.131 . . . . 11.5 114.053 170.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.46 0.264 0 N-CA-C 111.838 -0.505 . . . . 19.39 111.838 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 49.9 t-80 -65.66 -25.75 67.49 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.22 1.008 . . . . 20.25 112.664 -176.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 38.8 m-70 80.7 146.62 0.09 Allowed 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 125.022 1.329 . . . . 18.12 108.872 -171.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 5.4 p-80 -159.29 143.99 15.5 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.684 -0.487 . . . . 14.86 109.684 178.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.4 m-70 -104.1 -18.92 14.35 Favored 'General case' 0 C--N 1.308 -1.218 0 O-C-N 122.993 0.183 . . . . 14.68 111.141 179.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 73.4 t60 75.78 112.04 0.07 Allowed 'General case' 0 C--O 1.211 -0.923 0 O-C-N 124.2 0.937 . . . . 14.28 110.206 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.9 t-80 -64.77 -44.57 89.61 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.847 -0.615 . . . . 10.72 112.0 -173.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 59.4 tp 69.82 -78.83 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.115 0.966 . . . . 10.4 112.56 176.307 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -91.26 133.53 35.32 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.703 -0.851 . . . . 11.87 108.703 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.1 74.98 1.08 Allowed Glycine 0 C--N 1.29 -1.999 0 N-CA-C 109.106 -1.598 . . . . 10.09 109.106 -174.446 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -100.33 58.06 0.76 Allowed Glycine 0 C--N 1.304 -1.232 0 C-N-CA 121.121 -0.561 . . . . 8.45 112.479 -177.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -86.61 -1.11 85.8 Favored Glycine 0 C--O 1.215 -1.037 0 C-N-CA 120.945 -0.645 . . . . 9.5 112.692 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.4 p30 59.2 -179.2 0.08 Allowed 'General case' 0 N--CA 1.505 2.319 0 C-N-CA 126.619 1.968 . . . . 10.0 111.378 -178.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -151.12 57.74 0.9 Allowed 'General case' 0 C--O 1.24 0.588 0 O-C-N 121.957 -0.465 . . . . 11.12 111.68 -178.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 64.12 -87.2 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 113.979 1.103 . . . . 15.84 113.979 175.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.432 ' C ' ' H ' ' A' ' 18' ' ' ALA . 62.4 pttt -84.91 19.49 2.09 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.331 0.586 . . . . 15.7 110.766 -177.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 69.8 p -81.54 32.05 0.35 Allowed 'General case' 0 N--CA 1.44 -0.943 0 C-N-CA 123.389 0.676 . . . . 11.31 109.806 177.397 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.435 ' O ' ' HG2' ' A' ' 21' ' ' ARG . . . -53.71 -42.48 68.1 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.475 0.71 . . . . 13.54 111.854 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 66.2 mtt -94.79 -13.04 25.99 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.836 0.351 . . . . 14.44 111.23 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.81 -10.86 46.58 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.094 0.473 . . . . 10.19 110.806 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.435 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 10.5 ptp180 -88.32 -7.26 57.0 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 109.663 -0.495 . . . . 10.91 109.663 178.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.6 -39.68 77.4 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.086 -0.961 . . . . 9.53 111.747 -178.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.47 ' HZ2' ' HB2' ' A' ' 23' ' ' LYS . 9.9 mtmp? -139.43 98.64 3.54 Favored 'General case' 0 CA--C 1.484 -1.576 0 N-CA-C 112.806 0.669 . . . . 11.55 112.806 178.439 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -141.04 -70.76 0.37 Allowed 'General case' 0 C--N 1.3 -1.554 0 CA-C-N 115.858 -0.61 . . . . 6.8 109.96 175.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 58.5 tp -96.76 -83.27 0.39 Allowed 'General case' 0 CA--C 1.551 0.99 0 CA-C-O 120.881 0.372 . . . . 7.19 110.829 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -141.7 163.57 32.55 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 108.006 -1.109 . . . . 7.7 108.006 178.377 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.7 pttt -118.79 -42.4 2.73 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 123.334 0.396 . . . . 9.24 111.938 -179.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -130.76 106.4 8.43 Favored 'General case' 0 CA--C 1.516 -0.357 0 O-C-N 121.93 -0.481 . . . . 6.55 111.368 -179.028 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -125.29 -11.43 6.93 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 121.315 0.578 . . . . 10.38 109.802 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -155.82 160.6 40.37 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 108.83 -0.804 . . . . 7.72 108.83 -177.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -92.99 100.59 13.0 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 123.368 0.418 . . . . 8.49 110.884 -178.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -71.41 -42.31 56.65 Favored Glycine 0 C--O 1.219 -0.788 0 CA-C-N 115.967 -0.561 . . . . 7.69 112.09 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 96.0 mttt 63.72 15.56 9.08 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 124.149 0.98 . . . . 9.15 113.226 177.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 152.25 84.0 0.04 OUTLIER Glycine 0 C--O 1.244 0.758 0 C-N-CA 120.54 -0.838 . . . . 8.66 111.768 178.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 22.4 t -81.86 92.52 6.71 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-O 122.225 1.012 . . . . 9.53 111.042 -176.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -138.84 -48.27 0.5 Allowed 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 106.573 -1.64 . . . . 12.43 106.573 175.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.2 mp -106.78 -57.52 2.05 Favored 'General case' 0 N--CA 1.436 -1.13 0 N-CA-C 106.804 -1.554 . . . . 10.35 106.804 173.449 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 67.46 92.88 0.08 Allowed 'General case' 0 C--N 1.351 0.644 0 C-N-CA 124.962 1.305 . . . . 7.86 110.619 177.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -120.95 127.33 51.72 Favored 'General case' 0 C--O 1.241 0.658 0 CA-C-N 115.49 -0.777 . . . . 6.22 111.905 -174.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -75.49 137.75 41.11 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.245 -0.889 . . . . 7.34 112.0 -179.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -113.98 -17.76 11.9 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.042 -1.095 . . . . 8.26 108.042 173.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt 65.32 -59.85 0.26 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.678 1.591 . . . . 8.58 112.635 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.418 ' C ' ' H ' ' A' ' 45' ' ' SER . . . -88.65 15.15 8.56 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 112.138 0.422 . . . . 6.63 112.138 -177.507 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . 0.262 23.1 ptp 60.11 -23.36 0.03 OUTLIER 'General case' 0 N--CA 1.516 2.858 0 C-N-CA 127.252 2.221 . . . . 7.93 115.682 179.431 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.418 ' H ' ' C ' ' A' ' 43' ' ' ALA . 41.2 m 70.47 -101.07 0.04 OUTLIER 'General case' 0 N--CA 1.413 -2.295 0 N-CA-C 114.91 1.448 . . . . 4.16 114.91 176.112 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.446 ' O ' ' HA ' ' A' ' 54' ' ' THR . 66.3 mt -133.52 148.45 30.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 N-CA-C 110.169 -0.308 . . . . 3.76 110.169 -172.749 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.605 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 46.3 tt0 -110.6 143.69 40.62 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 123.417 0.687 . . . . 7.28 109.993 177.6 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.51 ' SG ' HG22 ' A' ' 50' ' ' VAL . 49.0 t -82.55 129.92 35.02 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 122.986 0.514 . . . . 5.75 111.214 178.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.5 -35.19 52.47 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 127.791 2.436 . . . . 5.98 110.617 -178.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.51 HG22 ' SG ' ' A' ' 48' ' ' CYS . 9.6 m -58.32 -23.46 22.24 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 N-CA-C 112.798 0.666 . . . . 7.94 112.798 -174.376 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.8 t -172.11 -86.27 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.846 0 O-C-N 123.473 0.483 . . . . 9.38 110.532 179.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.429 ' HA ' ' CG ' ' A' ' 47' ' ' GLN . 50.0 ttp -164.68 40.51 0.08 Allowed 'General case' 0 C--O 1.239 0.544 0 CA-C-O 122.67 1.224 . . . . 9.71 110.207 -178.062 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.605 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 19.1 mm-40 -86.97 -167.77 2.0 Favored 'General case' 0 C--O 1.205 -1.25 0 N-CA-C 108.22 -1.029 . . . . 9.17 108.22 -177.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.446 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 12.9 t -144.42 154.57 43.1 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 117.536 -1.665 . . . . 6.39 112.955 -176.271 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -130.46 162.79 28.4 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 106.116 -1.809 . . . . 5.78 106.116 176.07 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.491 HD13 ' H ' ' A' ' 57' ' ' CYS . 0.3 OUTLIER -88.96 148.53 4.47 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 108.083 -1.08 . . . . 5.53 108.083 -177.264 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.491 ' H ' HD13 ' A' ' 56' ' ' ILE . 20.7 p -76.69 77.36 3.34 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 121.45 0.643 . . . . 4.52 111.485 179.088 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 31.7 p -60.28 -26.89 66.84 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.675 -1.148 . . . . 6.29 111.18 174.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.529 ' HB ' ' SG ' ' A' ' 64' ' ' CYS . 16.3 m -143.38 173.04 11.97 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 107.178 -1.415 . . . . 6.33 107.178 -177.327 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.4 m -76.47 18.52 0.31 Allowed 'General case' 0 CA--C 1.556 1.191 0 N-CA-C 112.875 0.695 . . . . 6.87 112.875 -174.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 64.04 -62.16 0.17 Allowed 'General case' 0 N--CA 1.503 2.221 0 C-N-CA 125.375 1.47 . . . . 4.86 111.24 -176.048 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . 0.661 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 92.9 t -57.01 -36.42 50.75 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.477 0 C-N-CA 123.966 0.906 . . . . 7.56 111.575 -178.026 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.484 ' HA ' ' CG ' ' A' ' 66' ' ' GLU . 4.5 mptp? -68.28 -25.93 65.4 Favored 'General case' 0 C--O 1.244 0.815 0 CA-C-O 122.076 0.941 . . . . 9.7 112.296 177.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . 0.529 ' SG ' ' HB ' ' A' ' 59' ' ' THR . 57.3 m -77.41 -38.78 49.01 Favored 'General case' 0 C--N 1.272 -2.765 0 N-CA-C 107.029 -1.471 . . . . 6.07 107.029 175.089 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 57.5 mtp180 -63.53 -38.39 90.96 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 114.234 -1.348 . . . . 8.11 111.763 178.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . 0.661 ' HG2' ' O ' ' A' ' 62' ' ' VAL . 5.0 mm-40 -52.6 -55.17 24.26 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 107.471 -1.307 . . . . 9.78 107.471 176.423 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.493 ' CD2' ' HA ' ' A' ' 86' ' ' LYS . 48.8 t60 -76.14 -17.06 59.74 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-N 114.327 -1.306 . . . . 9.61 111.396 -176.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -77.92 -40.4 39.78 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 122.038 -0.414 . . . . 6.53 109.949 179.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -68.83 -16.97 63.93 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.76 0.79 . . . . 8.5 109.748 177.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.08 -18.24 60.32 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 114.568 -1.196 . . . . 9.9 112.058 175.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -141.04 -83.67 0.21 Allowed 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 111.987 0.366 . . . . 10.62 111.987 -178.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . 0.55 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 27.1 p80 44.48 43.43 1.2 Allowed Pre-proline 0 N--CA 1.507 2.383 0 C-N-CA 125.732 1.613 . . . . 8.11 114.682 -179.523 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.55 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 7.5 Cg_exo -71.88 -52.33 0.2 Allowed 'Trans proline' 0 C--N 1.368 1.57 0 C-N-CA 121.48 1.453 . . . . 7.3 111.818 -176.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -154.84 122.09 5.61 Favored 'General case' 0 N--CA 1.404 -2.743 0 N-CA-C 107.751 -1.203 . . . . 7.81 107.751 -178.716 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.06 120.78 30.77 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 107.88 -1.156 . . . . 4.52 107.88 171.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -96.95 -90.55 0.25 Allowed 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.31 0.576 . . . . 6.83 111.678 -172.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.2 m -86.66 -12.01 11.0 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 CA-C-O 122.259 1.028 . . . . 8.44 108.595 176.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.424 HG21 ' HA ' ' A' ' 85' ' ' LYS . 27.6 m -96.6 12.2 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 CA-C-N 113.954 -1.475 . . . . 6.03 108.94 176.827 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.94 -3.42 3.44 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-O 121.46 0.648 . . . . 4.71 110.951 177.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 17.8 p -71.11 -28.45 64.32 Favored 'General case' 0 N--CA 1.426 -1.643 0 CA-C-N 115.039 -0.982 . . . . 6.16 109.717 175.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.407 ' C ' ' H ' ' A' ' 83' ' ' HIS . 18.8 t80 -155.94 92.38 2.63 Favored Pre-proline 0 N--CA 1.44 -0.951 0 N-CA-C 107.195 -1.409 . . . . 6.08 107.195 171.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -63.49 8.4 0.15 Allowed 'Trans proline' 0 N--CA 1.5 1.904 0 C-N-CA 124.462 3.441 . . . . 3.27 114.603 -173.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.407 ' H ' ' C ' ' A' ' 81' ' ' PHE . 41.4 m80 -101.25 7.45 42.94 Favored 'General case' 0 C--N 1.287 -2.109 0 C-N-CA 120.469 -0.492 . . . . 4.77 110.022 176.444 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 37.6 mt -117.58 9.32 13.12 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 116.422 -0.353 . . . . 5.47 111.267 -178.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.424 ' HA ' HG21 ' A' ' 78' ' ' VAL . 19.8 tptm -52.89 -46.54 68.0 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 115.314 1.598 . . . . 8.41 115.314 -178.655 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.493 ' HA ' ' CD2' ' A' ' 67' ' ' HIS . 59.8 tttm . . . . . 0 C--N 1.353 0.728 0 O-C-N 123.381 0.426 . . . . 11.5 112.032 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.024 0 N-CA-C 112.351 -0.3 . . . . 19.39 112.351 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.6 t60 69.94 -52.27 0.63 Allowed 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 125.448 1.499 . . . . 20.25 111.118 -178.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -91.76 145.39 24.61 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.023 -1.103 . . . . 18.12 108.023 173.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 90.7 m-70 -126.11 -32.85 2.71 Favored 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 120.18 -0.608 . . . . 14.86 112.6 178.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 54.4 m80 -139.59 168.61 19.43 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 109.355 -0.609 . . . . 14.68 109.355 179.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.8 t-80 -87.56 -14.08 41.19 Favored 'General case' 0 C--N 1.321 -0.645 0 O-C-N 123.698 0.624 . . . . 14.28 109.38 177.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.8 p-80 -103.89 143.28 33.05 Favored 'General case' 0 C--O 1.21 -0.986 0 N-CA-C 109.17 -0.678 . . . . 10.72 109.17 178.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.0 tt 69.8 -72.61 0.1 Allowed 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.712 1.205 . . . . 10.4 111.414 176.483 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -58.46 -19.05 33.53 Favored 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 112.758 0.651 . . . . 11.87 112.758 -177.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -132.09 37.3 2.07 Favored Glycine 0 N--CA 1.443 -0.895 0 N-CA-C 111.191 -0.764 . . . . 10.09 111.191 177.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -109.45 -9.91 24.5 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.709 -0.757 . . . . 8.45 113.924 -177.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.3 -38.21 1.33 Allowed Glycine 0 CA--C 1.484 -1.883 0 N-CA-C 108.716 -1.753 . . . . 9.5 108.716 -178.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 65.72 -76.74 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 125.02 1.328 . . . . 10.0 113.201 173.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 58.53 176.34 0.07 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.637 1.175 . . . . 11.12 112.624 -177.145 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -139.32 11.41 2.56 Favored 'General case' 0 CA--C 1.508 -0.671 0 C-N-CA 120.051 -0.66 . . . . 15.84 111.557 178.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.407 ' C ' ' H ' ' A' ' 18' ' ' ALA . 3.7 mppt? -88.73 5.56 42.77 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 119.566 -0.854 . . . . 15.7 110.583 174.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 51.5 m 67.47 -41.61 0.43 Allowed 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 125.434 1.494 . . . . 11.31 114.525 177.212 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.407 ' H ' ' C ' ' A' ' 16' ' ' LYS . . . -56.33 -62.67 1.56 Allowed 'General case' 0 C--N 1.306 -1.299 0 C-N-CA 123.855 0.862 . . . . 13.54 112.485 -175.745 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 96.0 mmm -80.63 -9.88 59.76 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 116.307 -0.406 . . . . 14.44 111.801 -178.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.17 -46.97 81.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.491 0.663 . . . . 10.19 110.016 -178.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -96.5 11.18 35.97 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.665 -0.698 . . . . 10.91 111.235 -179.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -110.27 -53.12 2.72 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 116.238 -0.437 . . . . 9.53 111.817 -178.071 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 50.0 tttp -83.48 -7.77 59.48 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.866 0.365 . . . . 11.55 110.342 -175.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.87 163.38 9.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.656 -0.702 . . . . 6.8 111.624 -178.409 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 82.1 mt -88.95 114.46 25.6 Favored 'General case' 0 C--N 1.307 -1.261 0 C-N-CA 120.237 -0.585 . . . . 7.19 111.324 -177.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -62.13 146.73 49.7 Favored 'General case' 0 C--N 1.291 -1.937 0 CA-C-N 113.823 -1.535 . . . . 7.7 110.461 177.025 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.32 4.44 6.32 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.778 0.658 . . . . 9.24 112.778 -176.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -152.57 153.85 34.23 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.304 -0.999 . . . . 6.55 108.304 -179.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -112.7 -23.0 10.44 Favored 'General case' 0 C--N 1.316 -0.872 0 C-N-CA 120.853 -0.339 . . . . 10.38 111.421 -179.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 57.02 -152.34 0.4 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.647 0.779 . . . . 7.72 111.847 177.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -123.4 173.16 8.17 Favored 'General case' 0 N--CA 1.438 -1.05 0 N-CA-C 108.109 -1.071 . . . . 8.49 108.109 177.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 148.04 -14.4 1.31 Allowed Glycine 0 C--N 1.316 -0.556 0 C-N-CA 119.165 -1.493 . . . . 7.69 112.815 -178.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -78.17 -28.31 48.21 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.525 -0.546 . . . . 9.15 109.525 177.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.03 170.21 31.61 Favored Glycine 0 N--CA 1.431 -1.671 0 N-CA-C 108.843 -1.703 . . . . 8.66 108.843 179.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 20.7 m -89.7 -79.49 0.33 Allowed 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 117.67 0.735 . . . . 9.53 111.026 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -134.74 -64.1 0.68 Allowed 'General case' 0 C--O 1.219 -0.521 0 CA-C-O 120.648 0.261 . . . . 12.43 110.83 178.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -75.67 -40.58 55.78 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.927 0.394 . . . . 10.35 110.709 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -49.11 -53.78 19.1 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 114.662 -1.154 . . . . 7.86 112.156 -175.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -127.4 72.25 1.37 Allowed 'General case' 0 N--CA 1.418 -2.04 0 C-N-CA 119.548 -0.861 . . . . 6.22 112.483 -178.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -114.02 128.22 56.29 Favored 'General case' 0 C--N 1.283 -2.299 0 N-CA-C 106.336 -1.727 . . . . 7.34 106.336 174.264 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 48.8 mmtm -137.07 -56.55 0.72 Allowed 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 109.695 -0.483 . . . . 8.26 109.695 178.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt 68.91 -47.3 0.57 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.241 1.416 . . . . 8.58 113.109 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -80.54 -10.13 59.75 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 112.563 0.579 . . . . 6.63 112.563 -178.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 25.2 mmt 57.24 87.68 0.06 Allowed 'General case' 0 N--CA 1.472 0.633 0 O-C-N 123.916 0.76 . . . . 7.93 110.704 -173.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.51 ' HB2' ' O ' ' A' ' 55' ' ' PHE . 53.1 m -75.48 -84.35 0.05 Allowed 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 114.677 1.362 . . . . 4.16 114.677 -176.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 31.9 mt -139.95 159.29 26.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 N-CA-C 107.812 -1.181 . . . . 3.76 107.812 -174.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.611 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 32.4 tt0 -112.09 149.34 32.25 Favored 'General case' 0 CA--C 1.552 1.029 0 N-CA-C 109.335 -0.617 . . . . 7.28 109.335 -176.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.465 ' SG ' HG21 ' A' ' 50' ' ' VAL . 41.6 t -85.99 145.25 27.19 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 112.408 0.521 . . . . 5.75 112.408 -177.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.456 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -66.39 -23.15 66.28 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.392 1.477 . . . . 5.98 110.371 -175.235 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.465 HG21 ' SG ' ' A' ' 48' ' ' CYS . 20.4 m -62.11 -30.06 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 CA-C-N 115.169 -0.923 . . . . 7.94 112.431 -175.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 41.9 t -176.96 -110.57 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.494 0 N-CA-C 107.3 -1.37 . . . . 9.38 107.3 -175.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 4.8 mpp? -136.44 64.28 1.56 Allowed 'General case' 0 N--CA 1.427 -1.614 0 CA-C-O 121.044 0.45 . . . . 9.71 111.6 177.095 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.611 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 23.0 mm-40 -106.25 -165.05 1.06 Allowed 'General case' 0 C--O 1.19 -2.062 0 N-CA-C 108.672 -0.862 . . . . 9.17 108.672 -178.068 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 15.0 t -144.13 151.8 40.06 Favored 'General case' 0 N--CA 1.437 -1.12 0 C-N-CA 117.991 -1.484 . . . . 6.39 112.954 -178.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.51 ' O ' ' HB2' ' A' ' 45' ' ' SER . 89.1 m-85 -123.29 174.55 7.24 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 107.105 -1.443 . . . . 5.78 107.105 175.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 10.2 tp -100.41 142.46 15.53 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.21 0 N-CA-C 110.057 -0.349 . . . . 5.53 110.057 -178.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 49.7 t -86.37 78.35 9.29 Favored 'General case' 0 N--CA 1.415 -2.198 0 CA-C-O 121.565 0.697 . . . . 4.52 109.244 178.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 9.4 t -73.31 -12.81 60.97 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 114.993 -1.003 . . . . 6.29 111.097 175.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 28.6 m -143.79 -89.57 0.12 Allowed 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 109.767 -0.457 . . . . 6.33 109.767 178.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 65.2 p -173.06 5.03 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 112.851 0.686 . . . . 6.87 112.851 176.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.482 ' O ' ' HG3' ' A' ' 65' ' ' ARG . 36.9 tt0 67.75 -45.58 0.49 Allowed 'General case' 0 N--CA 1.498 1.937 0 C-N-CA 123.839 0.855 . . . . 4.86 111.187 -172.113 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 94.8 t -56.84 -40.18 69.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 O-C-N 121.627 -0.671 . . . . 7.56 112.468 -178.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.457 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 8.0 tmtt? -61.91 -37.74 85.78 Favored 'General case' 0 CA--C 1.561 1.392 0 CA-C-O 122.293 1.044 . . . . 9.7 109.008 179.294 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . 0.453 ' SG ' ' HA ' ' A' ' 61' ' ' GLU . 29.7 p -81.49 -19.41 42.33 Favored 'General case' 0 C--O 1.204 -1.293 0 CA-C-N 115.791 -0.641 . . . . 6.07 110.152 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.482 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 97.5 mtt180 -64.68 -39.8 94.3 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 108.736 -0.838 . . . . 8.11 108.736 175.198 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -60.13 -47.8 84.4 Favored 'General case' 0 C--O 1.245 0.867 0 CA-C-N 115.232 -0.894 . . . . 9.78 108.822 179.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.449 ' O ' ' HB3' ' A' ' 70' ' ' ALA . 41.8 t60 -74.44 -22.31 59.19 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-N 115.072 -0.967 . . . . 9.61 111.29 -178.088 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -74.67 -42.26 58.79 Favored 'General case' 0 CA--C 1.492 -1.265 0 C-N-CA 119.957 -0.697 . . . . 6.53 109.231 178.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -65.76 -13.89 60.26 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.824 0.821 . . . . 8.5 110.67 176.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.449 ' HB3' ' O ' ' A' ' 67' ' ' HIS . . . -76.23 -19.17 58.6 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.099 -0.955 . . . . 9.9 110.911 174.681 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -146.0 -82.89 0.14 Allowed 'General case' 0 C--O 1.211 -0.939 0 CA-C-O 121.042 0.449 . . . . 10.62 111.861 -177.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.372 4.6 p80 36.45 67.24 1.72 Allowed Pre-proline 0 N--CA 1.488 1.431 0 C-N-CA 126.58 1.952 . . . . 8.11 116.052 -173.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . 0.422 ' HD2' ' HG2' ' A' ' 85' ' ' LYS . 13.9 Cg_exo -70.02 -61.63 0.06 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 121.39 1.393 . . . . 7.3 111.214 174.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -158.56 120.05 3.47 Favored 'General case' 0 N--CA 1.418 -2.045 0 CA-C-N 115.558 -0.747 . . . . 7.81 108.986 178.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.438 ' O ' ' HB3' ' A' ' 79' ' ' ALA . . . -77.18 115.79 17.27 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 107.769 -1.197 . . . . 4.52 107.769 173.5 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -95.53 -87.1 0.29 Allowed 'General case' 0 C--O 1.201 -1.475 0 CA-C-O 121.012 0.434 . . . . 6.83 111.389 -173.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.8 m -84.6 -14.85 11.19 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.663 0 CA-C-O 122.128 0.966 . . . . 8.44 108.774 176.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 34.1 m -94.97 11.66 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.524 0 CA-C-N 114.681 -1.145 . . . . 6.03 109.223 177.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 75' ' ' ALA . . . -65.39 -6.82 11.22 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-O 121.767 0.794 . . . . 4.71 111.646 177.322 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 18.9 p -76.53 -17.67 59.13 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 115.144 -0.934 . . . . 6.16 109.701 175.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.505 ' CD1' ' HG ' ' A' ' 84' ' ' LEU . 1.6 t80 -161.93 80.13 1.95 Allowed Pre-proline 0 CA--C 1.555 1.14 0 N-CA-C 106.506 -1.665 . . . . 6.08 106.506 178.018 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -62.93 -3.85 5.25 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 124.265 3.31 . . . . 3.27 115.696 -171.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -84.77 -6.15 59.35 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 109.268 -0.641 . . . . 4.77 109.268 -179.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.505 ' HG ' ' CD1' ' A' ' 81' ' ' PHE . 42.6 mt -106.41 11.87 30.37 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.217 -0.447 . . . . 5.47 112.188 -174.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.422 ' HG2' ' HD2' ' A' ' 73' ' ' PRO . 56.9 tptt -50.38 -47.67 56.19 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 111.852 0.316 . . . . 8.41 111.852 176.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.415 ' HA ' ' CD2' ' A' ' 67' ' ' HIS . 40.4 ttmt . . . . . 0 C--O 1.266 1.961 0 CA-C-O 117.661 -1.162 . . . . 11.5 113.164 173.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.527 0 N-CA-C 111.694 -0.562 . . . . 19.39 111.694 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 4.4 p80 -74.33 86.29 1.97 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 113.035 0.754 . . . . 20.25 113.035 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 55.3 m-70 -142.92 18.36 1.96 Allowed 'General case' 0 N--CA 1.488 1.434 0 CA-C-N 115.264 -0.88 . . . . 18.12 110.523 175.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 83.5 m-70 -128.79 99.8 5.46 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.044 -0.724 . . . . 14.86 109.044 178.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 41.9 t60 -83.23 115.41 21.94 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 115.844 -0.616 . . . . 14.68 110.642 -176.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 38.1 t60 73.63 101.16 0.07 Allowed 'General case' 0 N--CA 1.487 1.422 0 O-C-N 123.799 0.687 . . . . 14.28 111.844 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.2 t-80 -121.92 17.22 10.95 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.486 -0.931 . . . . 10.72 108.486 177.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 64.1 tp -61.35 110.04 1.31 Allowed 'General case' 0 C--O 1.241 0.632 0 CA-C-N 114.877 -1.056 . . . . 10.4 109.978 176.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -162.61 -61.26 0.04 OUTLIER 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.164 -0.925 . . . . 11.87 109.156 -175.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -146.5 -47.0 0.03 OUTLIER Glycine 0 N--CA 1.443 -0.848 0 CA-C-N 115.401 -0.818 . . . . 10.09 111.868 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 168.31 -135.99 3.88 Favored Glycine 0 N--CA 1.435 -1.375 0 N-CA-C 110.659 -0.976 . . . . 8.45 110.659 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 80.8 66.27 1.64 Allowed Glycine 0 N--CA 1.436 -1.303 0 C-N-CA 120.899 -0.667 . . . . 9.5 112.218 178.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -108.42 129.76 55.25 Favored 'General case' 0 C--N 1.307 -1.241 0 C-N-CA 120.805 -0.358 . . . . 10.0 110.051 176.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -159.24 150.0 19.67 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 108.681 -0.859 . . . . 11.12 108.681 177.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 62.8 97.5 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 124.922 1.289 . . . . 15.84 113.861 176.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 99.5 mttt 67.01 1.54 2.37 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 114.258 1.207 . . . . 15.7 114.258 176.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.2 p -85.01 22.87 1.31 Allowed 'General case' 0 C--N 1.297 -1.693 0 N-CA-C 112.575 0.583 . . . . 11.31 112.575 -178.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.21 -39.61 63.84 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.775 0.83 . . . . 13.54 111.844 -179.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 72.4 mtm -106.58 -15.38 14.79 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 120.071 -0.652 . . . . 14.44 111.105 176.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.77 -21.13 61.05 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.028 0.442 . . . . 10.19 110.64 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.7 ptt180 -65.42 -21.84 66.71 Favored 'General case' 0 C--O 1.201 -1.483 0 CA-C-N 115.844 -0.616 . . . . 10.91 110.876 178.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -83.33 1.06 43.05 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.993 0.425 . . . . 9.53 110.979 -179.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.481 ' HE2' ' HA ' ' A' ' 23' ' ' LYS . 10.5 mmpt? -108.29 -31.21 7.96 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.923 -0.769 . . . . 11.55 108.923 177.371 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -92.75 -8.64 43.18 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.42 -0.809 . . . . 6.8 111.36 -177.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 92.8 mt -130.25 -169.37 2.12 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 108.292 -1.003 . . . . 7.19 108.292 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.93 -178.53 3.61 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.158 0.504 . . . . 7.7 112.297 -178.14 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -94.5 82.25 4.0 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-N 116.189 -0.459 . . . . 9.24 111.056 -177.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.49 154.77 37.63 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.029 0.443 . . . . 6.55 111.719 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.438 ' HD2' ' N ' ' A' ' 29' ' ' LYS . 3.2 mptp? -110.58 9.14 23.08 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.501 0.667 . . . . 10.38 110.037 -178.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.14 131.32 46.23 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.644 -0.707 . . . . 7.72 111.345 -178.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.91 -28.49 70.09 Favored 'General case' 0 C--O 1.253 1.288 0 CA-C-N 115.466 -0.788 . . . . 8.49 112.526 -178.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 87.15 -65.26 3.71 Favored Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 121.146 -0.549 . . . . 7.69 112.976 177.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -68.14 109.22 3.44 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.988 -0.375 . . . . 9.15 109.988 -178.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.38 -10.2 57.85 Favored Glycine 0 CA--C 1.501 -0.827 0 N-CA-C 111.114 -0.794 . . . . 8.66 111.114 178.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.2 t -86.81 110.75 20.15 Favored 'General case' 0 N--CA 1.418 -2.049 0 N-CA-C 108.083 -1.081 . . . . 9.53 108.083 -179.207 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.21 -59.53 0.06 Allowed 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 107.112 -1.44 . . . . 12.43 107.112 179.64 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.1 mt -84.76 -35.38 22.47 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.226 -0.443 . . . . 10.35 111.124 177.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 70.73 -39.45 0.45 Allowed 'General case' 0 N--CA 1.498 1.928 0 C-N-CA 125.151 1.38 . . . . 7.86 114.15 175.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.9 -24.06 61.86 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 113.542 0.942 . . . . 6.22 113.542 -177.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -79.55 93.29 5.42 Favored 'General case' 0 C--O 1.218 -0.604 0 CA-C-O 120.931 0.396 . . . . 7.34 110.953 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.526 ' HE3' ' O ' ' A' ' 57' ' ' CYS . 71.4 mmtt 66.66 86.65 0.13 Allowed 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 124.855 1.262 . . . . 8.26 111.766 -176.305 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -63.91 -9.6 16.27 Favored 'General case' 0 C--O 1.213 -0.834 0 N-CA-C 113.569 0.952 . . . . 8.58 113.569 -174.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -94.07 4.11 54.36 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 116.483 -0.326 . . . . 6.63 110.859 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 64.2 mtm 69.35 8.91 7.05 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 124.06 0.944 . . . . 7.93 111.417 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . 0.353 12.9 p 55.6 -108.2 0.42 Allowed 'General case' 0 N--CA 1.409 -2.49 0 N-CA-C 118.141 2.645 . . . . 4.16 118.141 177.482 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.554 ' O ' ' HA ' ' A' ' 54' ' ' THR . 68.7 mt -127.04 132.19 70.12 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.99 0 CA-C-N 116.604 -0.271 . . . . 3.76 110.395 -174.578 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.65 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 9.2 tt0 -98.1 135.12 40.22 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.222 0.534 . . . . 7.28 110.397 -178.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.575 ' SG ' HG23 ' A' ' 50' ' ' VAL . 12.9 t -70.86 133.04 46.14 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-N 115.053 -0.976 . . . . 5.75 111.913 -178.224 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.6 ttpt -57.21 -30.42 64.56 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.78 1.632 . . . . 5.98 111.599 -179.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.575 HG23 ' SG ' ' A' ' 48' ' ' CYS . 16.3 m -60.24 -27.89 40.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 N-CA-C 112.944 0.72 . . . . 7.94 112.944 -175.099 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 54.1 t -174.27 -99.84 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 109.076 -0.713 . . . . 9.38 109.076 -178.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.419 ' C ' HE21 ' A' ' 53' ' ' GLN . 2.2 mpt? -145.45 60.37 1.28 Allowed 'General case' 0 N--CA 1.426 -1.67 0 C-N-CA 122.543 0.337 . . . . 9.71 110.841 179.197 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.65 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 20.9 mm-40 -107.2 -172.49 2.09 Favored 'General case' 0 CA--C 1.481 -1.677 0 N-CA-C 108.064 -1.087 . . . . 9.17 108.064 -178.83 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.554 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 8.9 t -143.12 153.71 43.17 Favored 'General case' 0 N--CA 1.424 -1.773 0 C-N-CA 118.239 -1.384 . . . . 6.39 112.476 -177.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 99.7 m-85 -130.32 140.43 50.64 Favored 'General case' 0 C--N 1.298 -1.64 0 N-CA-C 105.489 -2.041 . . . . 5.78 105.489 176.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ILE . . . . . 0.441 HD13 ' HG2' ' A' ' 41' ' ' LYS . 8.9 tp -67.07 147.47 12.58 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 CA-C-O 121.225 0.536 . . . . 5.53 111.368 -173.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' CYS . . . . . 0.526 ' O ' ' HE3' ' A' ' 41' ' ' LYS . 43.6 t -78.34 73.13 4.9 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-O 121.52 0.676 . . . . 4.52 111.583 178.945 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 13.4 p -79.91 -22.27 42.95 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-O 121.483 0.658 . . . . 6.29 110.0 170.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' THR . . . . . 0.406 HG22 ' HB3' ' A' ' 64' ' ' CYS . 27.2 m -116.61 150.79 37.49 Favored 'General case' 0 N--CA 1.427 -1.595 0 N-CA-C 108.286 -1.005 . . . . 6.33 108.286 177.106 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 30.8 t -82.55 14.98 2.75 Favored 'General case' 0 CA--C 1.564 1.518 0 C-N-CA 122.7 0.4 . . . . 6.87 111.189 -176.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.665 ' HA ' ' SG ' ' A' ' 64' ' ' CYS . 5.5 tp10 64.96 -60.69 0.23 Allowed 'General case' 0 C--O 1.181 -2.509 0 C-N-CA 123.899 0.88 . . . . 4.86 111.858 -176.265 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 90.3 t -57.85 -29.07 34.61 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.329 0 O-C-N 121.577 -0.702 . . . . 7.56 111.956 -176.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.426 ' O ' ' HD2' ' A' ' 63' ' ' LYS . 3.2 tmmm? -77.79 -35.64 51.25 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 109.372 -0.603 . . . . 9.7 109.372 178.224 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . 0.665 ' SG ' ' HA ' ' A' ' 61' ' ' GLU . 23.1 p -76.54 -30.1 56.98 Favored 'General case' 0 C--O 1.197 -1.708 0 C-N-CA 119.514 -0.874 . . . . 6.07 109.47 177.111 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 65.0 ttt180 -56.61 -58.36 8.4 Favored 'General case' 0 N--CA 1.437 -1.118 0 C-N-CA 124.872 1.269 . . . . 8.11 112.103 177.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -62.26 -33.38 74.51 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 122.315 1.055 . . . . 9.78 109.728 -179.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.54 ' CD2' ' HD2' ' A' ' 85' ' ' LYS . 21.3 t60 -77.76 -13.38 59.91 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-N 113.933 -1.485 . . . . 9.61 110.75 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -98.24 -47.72 5.35 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 109.617 -0.512 . . . . 6.53 109.617 178.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -54.57 -37.88 66.01 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 123.757 0.661 . . . . 8.5 111.647 -179.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -87.77 2.71 50.53 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 116.076 -0.511 . . . . 9.9 112.376 -178.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -137.67 -81.9 0.34 Allowed 'General case' 0 C--N 1.343 0.287 0 CA-C-O 120.703 0.287 . . . . 10.62 111.431 -178.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.272 18.6 p80 41.99 62.88 7.18 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 125.381 1.473 . . . . 8.11 114.416 -176.262 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_exo -45.91 -56.52 2.79 Favored 'Trans proline' 0 C--N 1.378 2.089 0 C-N-CA 124.001 3.134 . . . . 7.3 114.031 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -177.39 -23.4 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 111.773 0.286 . . . . 7.81 111.773 -179.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 74.69 103.08 0.07 Allowed 'General case' 0 C--N 1.358 0.977 0 C-N-CA 124.222 1.009 . . . . 4.52 110.834 -179.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -100.18 -85.66 0.4 Allowed 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 114.867 -1.06 . . . . 6.83 111.298 -176.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.3 m -81.85 -15.65 12.15 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.749 0 CA-C-O 121.889 0.852 . . . . 8.44 108.836 176.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' VAL . . . . . 0.508 HG21 ' HA ' ' A' ' 85' ' ' LYS . 31.8 m -97.34 11.11 5.57 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.827 0 CA-C-N 114.707 -1.133 . . . . 6.03 109.25 177.348 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.09 -11.26 18.6 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.514 0.673 . . . . 4.71 111.663 176.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.467 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 76.9 m -82.9 -8.28 59.59 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 115.369 -0.832 . . . . 6.16 110.778 177.1 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -165.86 83.57 1.03 Allowed Pre-proline 0 C--N 1.32 -0.717 0 N-CA-C 107.734 -1.21 . . . . 6.08 107.734 171.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -58.08 1.73 0.22 Allowed 'Trans proline' 0 N--CA 1.498 1.755 0 C-N-CA 123.785 2.99 . . . . 3.27 116.487 -173.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 67.1 m-70 -88.73 -7.42 56.32 Favored 'General case' 0 CA--C 1.499 -0.984 0 C-N-CA 120.217 -0.593 . . . . 4.77 112.12 178.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 45.6 mt -89.23 -33.36 17.02 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.749 -0.78 . . . . 5.47 109.265 -178.667 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.54 ' HD2' ' CD2' ' A' ' 67' ' ' HIS 0.399 0.0 OUTLIER 41.88 166.53 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 119.137 3.014 . . . . 8.41 119.137 -176.146 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.437 ' C ' ' HZ3' ' A' ' 85' ' ' LYS . 86.4 tttt . . . . . 0 C--O 1.248 1.005 0 N-CA-C 107.93 -1.137 . . . . 11.5 107.93 176.515 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 65.7 mtt . . . . . 0 N--CA 1.465 0.296 0 CA-C-O 121.854 0.835 . . . . 7.6200000000000001 109.062 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.8 p -71.95 -87.33 0.02 OUTLIER 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 115.308 1.595 . . . . 3.9100000000000001 115.308 -176.204 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.572 ' O ' ' HA ' ' A' ' 54' ' ' THR . 80.6 mt -131.62 124.6 54.5 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.739 0 CA-C-N 116.036 -0.529 . . . . 3.7599999999999998 110.641 -175.373 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.694 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 39.7 tt0 -86.49 137.46 32.52 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.149 0.5 . . . . 6.79 110.078 177.504 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.603 ' SG ' HG22 ' A' ' 50' ' ' VAL . 42.4 t -77.76 130.7 37.06 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 115.015 -0.993 . . . . 5.4299999999999997 111.17 178.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.533 ' HD2' ' O ' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -58.51 -27.99 65.0 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-N 113.593 -1.639 . . . . 5.9100000000000001 111.124 -178.092 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.603 HG22 ' SG ' ' A' ' 48' ' ' CYS . 8.1 m -61.19 -31.29 49.75 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 N-CA-C 112.084 0.402 . . . . 7.9400000000000004 112.084 -176.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.8 t -161.37 -82.01 0.04 OUTLIER 'General case' 0 N--CA 1.44 -0.96 0 CA-C-O 120.779 0.323 . . . . 9.2799999999999994 110.863 -179.01 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 37.6 tpp -164.38 22.1 0.06 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 121.568 0.699 . . . . 9.4399999999999995 109.267 -175.629 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.694 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 8.7 mm100 -84.09 -167.81 1.9 Allowed 'General case' 0 CA--C 1.492 -1.282 0 C-N-CA 120.436 -0.506 . . . . 9.1099999999999994 109.946 -171.744 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.572 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 11.3 t -141.46 161.08 38.78 Favored 'General case' 0 N--CA 1.419 -2.002 0 C-N-CA 118.521 -1.271 . . . . 5.9299999999999997 112.833 -175.561 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -140.04 153.18 46.72 Favored 'General case' 0 N--CA 1.436 -1.15 0 C-N-CA 126.732 2.013 . . . . 5.2699999999999996 107.55 178.722 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 6.9 tp -73.39 136.13 26.11 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.473 0 CA-C-O 121.218 0.532 . . . . 5.2300000000000004 112.081 -177.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 53.8 t -78.27 74.13 4.81 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-O 121.48 0.657 . . . . 4.21 110.443 176.377 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.3 m -87.03 -5.71 58.98 Favored 'General case' 0 N--CA 1.428 -1.547 0 N-CA-C 107.77 -1.196 . . . . 6.0099999999999998 107.77 171.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 92.2 m -148.18 138.7 22.88 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 107.805 -1.183 . . . . 6.1900000000000004 107.805 178.168 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.3 p -71.36 -81.38 0.05 Allowed 'General case' 0 CA--C 1.55 0.954 0 O-C-N 123.523 0.514 . . . . 6.4699999999999998 112.074 -177.019 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.83 ' HA ' ' SG ' ' A' ' 64' ' ' CYS . 42.8 tt0 178.99 -36.13 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.047 0 C-N-CA 124.873 1.269 . . . . 4.8600000000000003 108.237 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.469 ' O ' ' HB3' ' A' ' 65' ' ' ARG . 80.8 t -70.49 -37.57 70.66 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 C-N-CA 120.569 -0.452 . . . . 7.2300000000000004 110.865 175.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.597 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 1.0 OUTLIER -72.81 -26.68 61.59 Favored 'General case' 0 CA--C 1.553 1.079 0 N-CA-C 108.924 -0.769 . . . . 9.3599999999999994 108.924 178.439 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 64' ' ' CYS . . . . . 0.83 ' SG ' ' HA ' ' A' ' 61' ' ' GLU . 28.9 p -82.71 -25.26 33.1 Favored 'General case' 0 C--O 1.205 -1.248 0 C-N-CA 118.634 -1.226 . . . . 5.9000000000000004 110.26 176.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.469 ' HB3' ' O ' ' A' ' 62' ' ' VAL . 68.0 ttt180 -57.62 -47.71 81.45 Favored 'General case' 0 N--CA 1.441 -0.913 0 C-N-CA 123.869 0.867 . . . . 7.6900000000000004 110.665 174.792 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -65.74 -35.62 81.25 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.496 0.665 . . . . 9.7799999999999994 110.069 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -74.06 -24.14 59.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.733 -0.667 . . . . 8.9700000000000006 111.066 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -74.79 -56.81 4.39 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-N 115.891 -0.595 . . . . 6.5300000000000002 110.617 -177.007 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -58.52 -34.51 71.05 Favored 'General case' 0 C--N 1.317 -0.813 0 O-C-N 123.751 0.657 . . . . 8.5 111.561 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -77.26 -12.45 59.95 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 115.118 -0.946 . . . . 9.4100000000000001 112.568 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm -132.58 -84.57 0.48 Allowed 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 112.866 0.691 . . . . 10.32 112.866 -176.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.433 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 23.9 p-80 42.49 60.26 9.91 Favored Pre-proline 0 N--CA 1.479 1.015 0 N-CA-C 113.97 1.1 . . . . 7.4699999999999998 113.97 -175.629 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.433 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 24.9 Cg_exo -64.7 -60.65 0.13 Allowed 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.143 1.895 . . . . 6.8099999999999996 111.412 -178.575 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 23.5 pttm -165.21 20.41 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.183 -0.462 . . . . 7.3200000000000003 110.701 -179.542 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.512 ' HB1' ' HA ' ' A' ' 79' ' ' ALA . . . 64.07 -82.3 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.594 -0.73 . . . . 4.5199999999999996 109.254 -172.589 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.4 t70 53.78 -88.43 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.538 1.135 . . . . 6.8200000000000003 113.693 175.365 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.7 m -73.35 -24.01 20.14 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.05 0 N-CA-C 109.585 -0.524 . . . . 8.1500000000000004 109.585 177.163 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.521 ' HB ' ' HB2' ' A' ' 84' ' ' LEU . 19.0 m -104.43 13.96 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.376 0 CA-C-N 115.872 -0.603 . . . . 5.6500000000000004 110.439 176.498 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.512 ' HA ' ' HB1' ' A' ' 75' ' ' ALA . . . -70.35 -14.58 62.64 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 121.484 0.659 . . . . 4.2400000000000002 110.153 177.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 82.5 m -76.8 -19.65 57.32 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 114.908 -1.042 . . . . 5.5999999999999996 110.491 177.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.596 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 34.4 t80 -155.58 83.97 3.55 Favored Pre-proline 0 N--CA 1.447 -0.615 0 N-CA-C 107.353 -1.351 . . . . 5.1299999999999999 107.353 176.53 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -63.19 3.44 0.58 Allowed 'Trans proline' 0 C--O 1.197 -1.552 0 C-N-CA 123.676 2.917 . . . . 3.27 115.312 -172.168 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 66.6 m-70 -72.73 -8.44 55.43 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 119.177 0.899 . . . . 4.25 110.842 174.443 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 81' ' ' PHE . 11.0 mt . . . . . 0 N--CA 1.416 -2.155 0 N-CA-C 107.15 -1.426 . . . . 5.4699999999999998 107.15 -178.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 CA--C 1.555 1.142 0 N-CA-C 112.128 0.418 . . . . 7.6200000000000001 112.128 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.484 ' OG ' HG13 ' A' ' 46' ' ' ILE . 41.2 t 56.16 -96.78 0.07 Allowed 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.971 1.1 . . . . 3.9100000000000001 113.971 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.484 HG13 ' OG ' ' A' ' 45' ' ' SER . 14.4 mt -124.67 160.96 28.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 C-N-CA 123.395 0.678 . . . . 3.7599999999999998 109.989 -176.3 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.659 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 7.5 tt0 -120.11 131.22 54.97 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 123.227 0.611 . . . . 6.79 109.399 177.936 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.651 ' SG ' HG22 ' A' ' 50' ' ' VAL . 21.3 t -68.83 134.51 49.77 Favored 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 124.238 1.015 . . . . 5.4299999999999997 111.91 -177.52 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.453 ' HD2' ' O ' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -62.68 -29.35 70.58 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.82 1.648 . . . . 5.9100000000000001 109.806 -177.731 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.651 HG22 ' SG ' ' A' ' 48' ' ' CYS . 11.6 m -62.14 -25.5 37.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.164 -0.471 . . . . 7.9400000000000004 112.169 -174.243 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.469 ' SG ' ' HG2' ' A' ' 52' ' ' MET . 47.6 t -169.26 -77.2 0.02 OUTLIER 'General case' 0 N--CA 1.438 -1.032 0 O-C-N 123.406 0.442 . . . . 9.2799999999999994 110.776 179.324 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.469 ' HG2' ' SG ' ' A' ' 51' ' ' CYS . 19.8 ptm -169.41 32.28 0.02 OUTLIER 'General case' 0 C--O 1.21 -1.025 0 CA-C-N 116.273 -0.421 . . . . 9.4399999999999995 111.732 -176.292 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.659 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 8.3 mm100 -90.82 -166.14 1.51 Allowed 'General case' 0 C--O 1.205 -1.276 0 N-CA-C 108.924 -0.769 . . . . 9.1099999999999994 108.924 -173.496 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.8 t -135.99 167.39 21.31 Favored 'General case' 0 C--N 1.289 -2.031 0 C-N-CA 118.442 -1.303 . . . . 5.9299999999999997 112.277 -175.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.448 ' O ' ' HB3' ' A' ' 45' ' ' SER . 89.5 m-85 -135.17 153.61 51.91 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 106.095 -1.817 . . . . 5.2699999999999996 106.095 175.917 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 7.9 tp -83.81 133.67 28.67 Favored 'Isoleucine or valine' 0 C--O 1.251 1.145 0 O-C-N 123.644 0.59 . . . . 5.2300000000000004 110.929 -177.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 49.0 t -71.6 74.4 0.8 Allowed 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 121.633 0.73 . . . . 4.21 112.217 176.585 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 18.0 p -82.11 -3.77 55.48 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 109.158 -0.682 . . . . 6.0099999999999998 109.158 169.013 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 87.3 m -161.66 149.83 15.22 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.009 -1.478 . . . . 6.1900000000000004 107.009 178.796 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.0 t -79.71 139.92 37.16 Favored 'General case' 0 N--CA 1.419 -1.983 0 N-CA-C 106.981 -1.489 . . . . 6.4699999999999998 106.981 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -53.25 -32.91 50.74 Favored 'General case' 0 C--O 1.206 -1.218 0 O-C-N 123.826 0.704 . . . . 4.8600000000000003 110.534 -178.381 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.459 ' O ' ' HB3' ' A' ' 65' ' ' ARG . 67.7 t -62.09 -31.8 52.5 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.096 0 N-CA-C 112.832 0.678 . . . . 7.2300000000000004 112.832 -177.4 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.587 ' O ' ' HD2' ' A' ' 63' ' ' LYS . 1.0 OUTLIER -79.85 -35.88 37.56 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 118.171 -1.411 . . . . 9.3599999999999994 107.338 179.216 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 69.1 m -67.15 -27.88 67.67 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 109.123 -0.695 . . . . 5.9000000000000004 109.123 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.459 ' HB3' ' O ' ' A' ' 62' ' ' VAL . 72.7 ttt180 -60.61 -54.85 40.38 Favored 'General case' 0 N--CA 1.426 -1.666 0 C-N-CA 124.607 1.163 . . . . 7.6900000000000004 112.17 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -63.68 -33.84 76.52 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-O 121.079 0.466 . . . . 9.7799999999999994 110.39 -178.37 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -70.73 -37.36 73.47 Favored 'General case' 0 N--CA 1.438 -1.031 0 N-CA-C 109.167 -0.679 . . . . 8.9700000000000006 109.167 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.72 -48.39 54.82 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-N 115.954 -0.567 . . . . 6.5300000000000002 111.878 -178.554 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -71.73 -17.98 62.17 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.509 0.559 . . . . 8.5 112.509 -176.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -93.7 -18.17 22.42 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 116.417 -0.356 . . . . 9.4100000000000001 111.28 176.548 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -118.27 -81.01 0.62 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.784 0.29 . . . . 10.32 111.784 -178.639 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.476 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 30.8 p80 44.47 54.21 11.99 Favored Pre-proline 0 N--CA 1.498 1.934 0 N-CA-C 114.449 1.277 . . . . 7.4699999999999998 114.449 -178.679 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.476 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 5.3 Cg_exo -75.59 -58.87 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.126 0 C-N-CA 121.686 1.591 . . . . 6.8099999999999996 113.17 -178.435 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -159.73 104.91 1.59 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.487 0.661 . . . . 7.3200000000000003 112.066 -175.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.74 113.15 21.7 Favored 'General case' 0 C--N 1.292 -1.896 0 CA-C-N 116.057 -0.52 . . . . 4.5199999999999996 109.788 175.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -115.12 -76.79 0.57 Allowed 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 111.89 0.33 . . . . 6.8200000000000003 111.89 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 28.2 m -73.81 -18.94 17.57 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.743 0 CA-C-O 122.368 1.08 . . . . 8.1500000000000004 108.977 176.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 35.5 m -105.59 15.83 6.71 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.37 0 CA-C-N 114.359 -1.292 . . . . 5.6500000000000004 109.803 175.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.58 -15.89 59.33 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-O 121.905 0.859 . . . . 4.2400000000000002 110.018 175.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' CYS . . . . . 0.61 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 64.4 m -67.59 -16.78 64.36 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 114.285 -1.325 . . . . 5.5999999999999996 110.49 176.392 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.487 ' CE2' ' HB2' ' A' ' 83' ' ' HIS . 14.2 t80 -167.85 89.32 0.69 Allowed Pre-proline 0 N--CA 1.444 -0.771 0 N-CA-C 108.052 -1.092 . . . . 5.1299999999999999 108.052 171.343 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -63.91 3.91 0.63 Allowed 'Trans proline' 0 N--CA 1.505 2.206 0 C-N-CA 124.087 3.192 . . . . 3.27 114.504 -173.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.487 ' HB2' ' CE2' ' A' ' 81' ' ' PHE . 13.2 m-70 -88.92 -0.67 57.6 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 109.258 -0.645 . . . . 4.25 109.258 177.779 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 49.0 mt . . . . . 0 C--N 1.344 0.327 0 CA-C-N 116.413 -0.358 . . . . 5.4699999999999998 111.748 -177.512 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 65.8 mtt . . . . . 0 N--CA 1.484 1.269 0 N-CA-C 112.273 0.471 . . . . 7.6200000000000001 112.273 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.5 p 51.67 -104.76 0.19 Allowed 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 116.347 1.98 . . . . 3.9100000000000001 116.347 177.557 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.433 ' O ' ' HA ' ' A' ' 54' ' ' THR . 59.0 mt -118.35 143.75 28.36 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 N-CA-C 109.657 -0.498 . . . . 3.7599999999999998 109.657 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.565 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 1.1 tp-100 -112.19 133.82 54.09 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 106.549 -1.648 . . . . 6.79 106.549 178.049 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.593 ' SG ' HG22 ' A' ' 50' ' ' VAL . 35.7 t -66.28 135.72 54.82 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 124.512 1.125 . . . . 5.4299999999999997 113.024 -175.545 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.403 ' HD2' ' O ' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -64.31 -26.59 68.55 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.1 1.36 . . . . 5.9100000000000001 110.168 -178.266 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.593 HG22 ' SG ' ' A' ' 48' ' ' CYS . 5.4 m -66.52 -33.19 61.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 120.843 0.354 . . . . 7.9400000000000004 111.797 -175.202 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 83.9 m -156.67 -83.11 0.06 Allowed 'General case' 0 N--CA 1.433 -1.318 0 CA-C-N 115.801 -0.636 . . . . 9.2799999999999994 110.792 -174.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 52.1 ttp 179.9 47.51 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.768 0 N-CA-C 108.471 -0.937 . . . . 9.4399999999999995 108.471 -178.478 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.565 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 10.3 mm100 -101.56 -178.29 3.68 Favored 'General case' 0 C--O 1.173 -2.927 0 N-CA-C 107.263 -1.384 . . . . 9.1099999999999994 107.263 -178.259 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.433 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 9.5 t -125.7 154.12 42.89 Favored 'General case' 0 C--N 1.286 -2.16 0 C-N-CA 117.53 -1.668 . . . . 5.9299999999999997 113.574 -175.19 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.453 ' HE2' ' SG ' ' A' ' 48' ' ' CYS . 86.7 m-85 -137.59 147.9 45.43 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 113.867 -1.515 . . . . 5.2699999999999996 107.634 177.817 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.495 HG13 ' H ' ' A' ' 58' ' ' THR . 9.2 tp -73.7 132.18 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 N-CA-C 109.402 -0.592 . . . . 5.2300000000000004 109.402 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 24.9 p -74.43 -18.98 60.57 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.03 0.381 . . . . 4.21 112.03 -176.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.495 ' H ' HG13 ' A' ' 56' ' ' ILE 0.25 13.6 t 54.34 -4.89 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 127.26 2.224 . . . . 6.0099999999999998 115.152 177.739 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 87.0 m -155.93 -83.9 0.06 Allowed 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 109.319 -0.623 . . . . 6.1900000000000004 109.319 178.09 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 18.0 p -161.2 10.36 0.09 Allowed 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 112.242 0.46 . . . . 6.4699999999999998 112.242 -178.202 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.568 ' O ' ' HG3' ' A' ' 65' ' ' ARG . 26.7 tt0 68.51 -52.04 0.56 Allowed 'General case' 0 C--O 1.183 -2.416 0 C-N-CA 124.523 1.129 . . . . 4.8600000000000003 110.806 -177.816 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.526 HG12 ' CZ ' ' A' ' 65' ' ' ARG . 35.7 m -55.37 -39.18 51.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 O-C-N 121.354 -0.841 . . . . 7.2300000000000004 112.77 -178.322 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -60.46 -42.28 95.87 Favored 'General case' 0 C--N 1.306 -1.3 0 CA-C-N 115.357 -0.838 . . . . 9.3599999999999994 109.496 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 28.5 p -78.19 -31.81 49.71 Favored 'General case' 0 N--CA 1.428 -1.544 0 C-N-CA 119.85 -0.74 . . . . 5.9000000000000004 109.621 178.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.568 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 22.3 mtm180 -59.68 -50.26 74.56 Favored 'General case' 0 CA--C 1.5 -0.966 0 N-CA-C 111.921 0.341 . . . . 7.6900000000000004 111.921 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -66.73 -33.79 76.41 Favored 'General case' 0 C--O 1.236 0.366 0 O-C-N 123.741 0.65 . . . . 9.7799999999999994 111.931 -178.067 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 21.5 t-80 -74.39 -30.25 61.87 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 119.696 -0.802 . . . . 8.9700000000000006 109.463 177.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.53 ' CB ' ' HA ' ' A' ' 83' ' ' HIS . . . -71.14 -46.86 60.7 Favored 'General case' 0 C--O 1.204 -1.333 0 CA-C-N 116.559 -0.291 . . . . 6.5300000000000002 111.543 179.664 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 10.7 pt-20 -71.65 -11.6 60.92 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.417 0.627 . . . . 8.5 111.432 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.05 -32.06 59.13 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.009 -0.996 . . . . 9.4100000000000001 109.798 173.42 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -120.65 -86.48 0.65 Allowed 'General case' 0 C--O 1.216 -0.698 0 CA-C-N 115.763 -0.653 . . . . 10.32 111.191 -177.184 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.471 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 20.4 t-80 45.49 55.58 14.74 Favored Pre-proline 0 CA--C 1.561 1.403 0 C-N-CA 123.85 0.86 . . . . 7.4699999999999998 112.014 -178.859 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.471 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 34.6 Cg_exo -65.23 -44.93 8.33 Favored 'Trans proline' 0 C--N 1.37 1.661 0 C-N-CA 121.881 1.721 . . . . 6.8099999999999996 110.341 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -170.03 106.14 0.33 Allowed 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 114.141 -1.391 . . . . 7.3200000000000003 108.85 177.695 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 79' ' ' ALA . . . -67.16 112.77 4.64 Favored 'General case' 0 C--N 1.302 -1.476 0 C-N-CA 119.427 -0.909 . . . . 4.5199999999999996 109.153 171.875 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.401 ' HB2' ' H ' ' A' ' 77' ' ' VAL . 8.9 m-20 -86.94 -90.75 0.11 Allowed 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 122.003 0.906 . . . . 6.8200000000000003 110.709 -174.145 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.401 ' H ' ' HB2' ' A' ' 76' ' ' ASP . 28.2 m -89.49 -14.96 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.219 0 N-CA-C 108.546 -0.909 . . . . 8.1500000000000004 108.546 177.057 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 24.4 m -87.03 7.44 2.54 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.833 0 CA-C-N 115.019 -0.991 . . . . 5.6500000000000004 109.047 177.828 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.432 ' HB2' ' O ' ' A' ' 75' ' ' ALA . . . -65.33 -2.77 3.38 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-N 115.185 -0.916 . . . . 4.2400000000000002 112.003 178.068 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 25.3 p -73.51 -23.22 60.0 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 115.366 -0.833 . . . . 5.5999999999999996 109.213 174.733 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.522 ' CE2' ' HB2' ' A' ' 83' ' ' HIS . 31.8 t80 -160.36 88.67 1.81 Allowed Pre-proline 0 N--CA 1.428 -1.528 0 N-CA-C 106.456 -1.683 . . . . 5.1299999999999999 106.456 170.564 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -60.01 6.73 0.1 OUTLIER 'Trans proline' 0 N--CA 1.509 2.395 0 C-N-CA 124.435 3.423 . . . . 3.27 115.527 -173.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.53 ' HA ' ' CB ' ' A' ' 68' ' ' ALA . 83.2 m-70 -98.87 5.58 47.28 Favored 'General case' 0 C--N 1.286 -2.163 0 N-CA-C 110.075 -0.343 . . . . 4.25 110.075 177.841 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.487 ' HG ' ' HD2' ' A' ' 81' ' ' PHE . 74.9 mt . . . . . 0 N--CA 1.43 -1.471 0 N-CA-C 111.982 0.364 . . . . 5.4699999999999998 111.982 -179.256 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 68.6 mtm . . . . . 0 N--CA 1.496 1.866 0 N-CA-C 113.21 0.819 . . . . 7.6200000000000001 113.21 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 67.1 m 52.0 -92.18 0.03 OUTLIER 'General case' 0 CA--C 1.561 1.387 0 N-CA-C 115.594 1.701 . . . . 3.9100000000000001 115.594 176.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.537 ' O ' ' HA ' ' A' ' 54' ' ' THR . 66.2 mt -131.86 133.88 60.63 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.209 0 N-CA-C 108.894 -0.78 . . . . 3.7599999999999998 108.894 -177.305 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.685 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 27.4 tt0 -100.81 138.83 37.34 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 120.918 0.39 . . . . 6.79 110.217 -179.027 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.635 ' SG ' HG12 ' A' ' 50' ' ' VAL . 44.8 t -77.86 143.96 37.37 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.709 -0.678 . . . . 5.4299999999999997 111.152 178.237 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.405 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -57.06 -39.07 74.19 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 126.06 1.744 . . . . 5.9100000000000001 112.579 -174.37 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.635 HG12 ' SG ' ' A' ' 48' ' ' CYS . 2.1 p -49.0 -51.37 12.78 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 114.74 1.385 . . . . 7.9400000000000004 114.74 -176.272 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.605 ' SG ' HG22 ' A' ' 50' ' ' VAL . 93.4 m -153.96 -67.73 0.14 Allowed 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 121.093 -0.243 . . . . 9.2799999999999994 111.302 -173.104 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.406 ' HA ' ' CG ' ' A' ' 47' ' ' GLN . 39.1 ttp -174.86 35.4 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 120.109 -0.636 . . . . 9.4399999999999995 109.653 -175.809 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.685 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 6.8 mm100 -87.47 179.25 6.6 Favored 'General case' 0 CA--C 1.494 -1.199 0 C-N-CA 119.265 -0.974 . . . . 9.1099999999999994 108.665 -174.371 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.537 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 7.5 t -137.99 154.31 49.35 Favored 'General case' 0 C--N 1.299 -1.597 0 C-N-CA 118.541 -1.264 . . . . 5.9299999999999997 113.946 -175.476 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -132.94 151.55 52.04 Favored 'General case' 0 N--CA 1.409 -2.497 0 N-CA-C 105.877 -1.897 . . . . 5.2699999999999996 105.877 175.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 10.8 tp -75.57 146.32 9.42 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.563 0 N-CA-C 109.459 -0.571 . . . . 5.2300000000000004 109.459 -177.574 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 45.1 t -76.95 72.68 3.53 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 121.883 0.849 . . . . 4.21 110.941 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 8.9 t -84.94 -3.2 58.64 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.103 -0.953 . . . . 6.0099999999999998 110.097 174.571 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 95.0 m -160.29 140.28 11.36 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 106.721 -1.585 . . . . 6.1900000000000004 106.721 177.09 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 35.7 p -75.65 139.32 41.93 Favored 'General case' 0 N--CA 1.42 -1.946 0 N-CA-C 109.396 -0.594 . . . . 6.4699999999999998 109.396 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.722 ' HA ' ' SG ' ' A' ' 64' ' ' CYS . 14.4 pt-20 -52.53 -35.02 52.56 Favored 'General case' 0 C--O 1.206 -1.184 0 C-N-CA 123.543 0.737 . . . . 4.8600000000000003 111.824 178.752 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.428 ' O ' ' HB3' ' A' ' 65' ' ' ARG . 99.4 t -67.16 -38.97 82.12 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.844 0 C-N-CA 123.155 0.582 . . . . 7.2300000000000004 112.494 178.001 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -73.01 -35.93 66.9 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 121.476 0.655 . . . . 9.3599999999999994 109.683 -178.111 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' CYS . . . . . 0.722 ' SG ' ' HA ' ' A' ' 61' ' ' GLU . 1.8 p -74.52 -27.34 60.5 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 115.656 -0.702 . . . . 5.9000000000000004 111.044 174.757 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.452 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 54.8 ttt180 -59.68 -52.65 64.58 Favored 'General case' 0 N--CA 1.439 -1.018 0 C-N-CA 123.627 0.771 . . . . 7.6900000000000004 112.251 178.523 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -68.98 -30.24 68.61 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.37 -0.532 . . . . 9.7799999999999994 110.99 -179.011 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 61.3 t60 -66.96 -37.96 85.22 Favored 'General case' 0 C--O 1.241 0.644 0 CA-C-N 116.158 -0.474 . . . . 8.9700000000000006 109.805 176.058 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.25 -42.16 72.55 Favored 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 115.966 -0.561 . . . . 6.5300000000000002 110.379 178.745 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 6.0 mm-40 -63.63 -17.95 63.43 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.157 0.503 . . . . 8.5 111.698 -179.655 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -84.46 -11.3 56.43 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.994 -0.548 . . . . 9.4100000000000001 111.06 176.703 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -142.52 -84.83 0.17 Allowed 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.611 0.597 . . . . 10.32 112.611 -177.358 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.469 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 34.9 p80 41.76 47.81 2.65 Favored Pre-proline 0 N--CA 1.502 2.158 0 C-N-CA 125.357 1.463 . . . . 7.4699999999999998 114.036 -176.072 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.469 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 1.3 Cg_endo -73.75 -41.75 1.01 Allowed 'Trans proline' 0 N--CA 1.444 -1.414 0 C-N-CA 121.015 1.143 . . . . 6.8099999999999996 112.374 -175.442 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -160.53 116.16 2.29 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.48 -0.933 . . . . 7.3200000000000003 108.48 -179.324 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.506 ' O ' HG22 ' A' ' 78' ' ' VAL . . . -73.05 -51.58 17.58 Favored 'General case' 0 C--N 1.286 -2.187 0 C-N-CA 118.738 -1.185 . . . . 4.5199999999999996 108.654 173.602 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.45 ' OD1' HG13 ' A' ' 77' ' ' VAL . 11.3 t70 61.0 -86.5 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 124.111 0.965 . . . . 6.8200000000000003 113.037 170.459 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.45 HG13 ' OD1' ' A' ' 76' ' ' ASP . 35.6 m -92.63 -19.32 6.88 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.742 0 CA-C-O 121.166 0.508 . . . . 8.1500000000000004 109.884 178.247 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.506 HG22 ' O ' ' A' ' 75' ' ' ALA . 21.1 m -102.34 18.39 3.84 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.504 0 N-CA-C 107.973 -1.121 . . . . 5.6500000000000004 107.973 174.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.423 ' HA ' ' HB1' ' A' ' 75' ' ' ALA . . . -64.48 -11.97 39.15 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-O 121.803 0.811 . . . . 4.2400000000000002 111.496 178.591 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' CYS . . . . . 0.548 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 89.2 m -75.4 -15.56 60.44 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-N 115.135 -0.939 . . . . 5.5999999999999996 110.025 174.139 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.586 ' CD1' HD12 ' A' ' 84' ' ' LEU . 11.9 p90 -154.45 69.86 6.03 Favored Pre-proline 0 CA--C 1.563 1.47 0 C-N-CA 124.64 1.176 . . . . 5.1299999999999999 111.401 178.501 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -64.22 -17.46 59.8 Favored 'Trans proline' 0 N--CA 1.5 1.854 0 C-N-CA 123.814 3.009 . . . . 3.27 115.375 -172.502 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -81.48 4.47 21.04 Favored 'General case' 0 C--N 1.31 -1.143 0 C-N-CA 120.549 -0.46 . . . . 4.25 111.601 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.586 HD12 ' CD1' ' A' ' 81' ' ' PHE . 17.0 mt . . . . . 0 N--CA 1.443 -0.779 0 C-N-CA 120.391 -0.524 . . . . 5.4699999999999998 110.687 -177.472 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.522 ' O ' HG23 ' A' ' 54' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.207 -1.159 0 N-CA-C 111.742 0.275 . . . . 7.6200000000000001 111.742 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.446 ' HB3' ' N ' ' A' ' 57' ' ' CYS . 54.7 m 60.84 -80.11 0.02 OUTLIER 'General case' 0 CA--C 1.563 1.479 0 N-CA-C 114.618 1.34 . . . . 3.9100000000000001 114.618 178.642 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.442 ' HB ' ' HB2' ' A' ' 55' ' ' PHE . 57.2 mt -139.86 144.81 27.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 N-CA-C 109.053 -0.721 . . . . 3.7599999999999998 109.053 -178.056 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.621 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 4.1 tp60 -109.36 136.78 48.23 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-O 121.015 0.436 . . . . 6.79 110.592 -178.09 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.563 ' SG ' HG22 ' A' ' 50' ' ' VAL . 38.1 t -74.28 145.05 44.31 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 124.803 1.241 . . . . 5.4299999999999997 113.483 -175.504 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.6 ttpt -63.86 -34.97 79.13 Favored 'General case' 0 C--O 1.216 -0.689 0 C-N-CA 125.796 1.639 . . . . 5.9100000000000001 111.332 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.563 HG22 ' SG ' ' A' ' 48' ' ' CYS . 8.5 m -61.04 -25.05 34.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 N-CA-C 113.286 0.847 . . . . 7.9400000000000004 113.286 -171.3 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.5 t -170.07 -76.25 0.02 OUTLIER 'General case' 0 N--CA 1.436 -1.149 0 N-CA-C 108.825 -0.805 . . . . 9.2799999999999994 108.825 -178.289 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 27.5 ttt -179.89 60.86 0.01 OUTLIER 'General case' 0 C--O 1.208 -1.11 0 N-CA-C 107.303 -1.369 . . . . 9.4399999999999995 107.303 179.141 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.621 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 11.3 mm100 -106.43 -174.24 2.49 Favored 'General case' 0 C--O 1.195 -1.809 0 N-CA-C 109.475 -0.565 . . . . 9.1099999999999994 109.475 -176.009 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.522 HG23 ' O ' ' A' ' 44' ' ' MET . 97.4 m -120.57 142.89 48.95 Favored 'General case' 0 C--N 1.273 -2.718 0 N-CA-C 114.255 1.206 . . . . 5.9299999999999997 114.255 -170.351 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.442 ' HB2' ' HB ' ' A' ' 46' ' ' ILE . 79.9 m-85 -130.41 172.75 11.53 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 125.698 1.599 . . . . 5.2699999999999996 108.435 175.212 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.1 tp -100.21 137.36 27.97 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 CA-C-O 121.035 0.445 . . . . 5.2300000000000004 112.114 -175.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.446 ' N ' ' HB3' ' A' ' 45' ' ' SER . 25.8 p -89.01 77.48 7.65 Favored 'General case' 0 N--CA 1.418 -2.031 0 CA-C-O 121.571 0.7 . . . . 4.21 110.258 176.828 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 8.2 m -67.47 -9.44 42.06 Favored 'General case' 0 CA--C 1.576 1.968 0 CA-C-O 122.29 1.043 . . . . 6.0099999999999998 110.189 174.425 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.443 HG22 ' H ' ' A' ' 60' ' ' SER . 33.2 m -149.75 173.76 13.35 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 104.681 -2.34 . . . . 6.1900000000000004 104.681 178.082 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.443 ' H ' HG22 ' A' ' 59' ' ' THR . 15.5 m -75.75 20.42 0.18 Allowed 'General case' 0 CA--C 1.552 1.051 0 CA-C-N 119.533 1.06 . . . . 6.4699999999999998 112.517 -174.042 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 65.23 -52.22 0.35 Allowed 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 126.929 2.092 . . . . 4.8600000000000003 111.542 -178.223 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.639 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 28.3 m -55.47 -41.93 65.44 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.411 0 N-CA-C 113.388 0.884 . . . . 7.2300000000000004 113.388 -177.865 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.481 ' HA ' ' OE1' ' A' ' 66' ' ' GLU . 0.6 OUTLIER -59.9 -35.26 74.49 Favored 'General case' 0 CA--C 1.55 0.953 0 CA-C-O 122.037 0.922 . . . . 9.3599999999999994 109.466 178.34 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 55.7 m -73.7 -36.26 65.23 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 108.45 -0.944 . . . . 5.9000000000000004 108.45 179.123 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -59.3 -42.76 92.08 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 115.615 -0.72 . . . . 7.6900000000000004 110.93 178.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.639 ' HG3' ' O ' ' A' ' 62' ' ' VAL . 25.3 mt-10 -59.14 -45.46 90.89 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 124.35 1.031 . . . . 9.7799999999999994 109.894 -177.29 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -75.65 -24.59 56.4 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.281 -0.872 . . . . 8.9700000000000006 109.721 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.97 -43.86 33.39 Favored 'General case' 0 C--O 1.206 -1.189 0 CA-C-N 116.179 -0.464 . . . . 6.5300000000000002 111.485 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.93 -18.83 64.15 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.098 0.475 . . . . 8.5 110.186 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.09 -29.5 67.6 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.16 -0.927 . . . . 9.4100000000000001 110.733 175.157 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -128.16 -76.13 0.56 Allowed 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 112.327 0.491 . . . . 10.32 112.327 -175.027 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.416 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 13.4 p80 39.13 60.62 5.63 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 125.148 1.379 . . . . 7.4699999999999998 113.695 -175.388 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.416 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 51.1 Cg_exo -59.58 -51.43 6.19 Favored 'Trans proline' 0 C--N 1.358 1.057 0 C-N-CA 122.36 2.04 . . . . 6.8099999999999996 112.483 -178.803 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.28 -32.03 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 113.619 0.97 . . . . 7.3200000000000003 113.619 177.577 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' A' ' 79' ' ' ALA . . . 71.45 116.53 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.74 0.816 . . . . 4.5199999999999996 109.956 -176.274 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -104.21 -80.87 0.53 Allowed 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.062 0.458 . . . . 6.8200000000000003 111.129 -174.231 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.8 m -81.53 -18.06 11.64 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 121.657 0.741 . . . . 8.1500000000000004 109.174 176.118 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 35.3 m -97.0 12.03 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.305 0 CA-C-N 115.003 -0.999 . . . . 5.6500000000000004 109.514 176.112 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.409 ' HB2' ' O ' ' A' ' 75' ' ' ALA . . . -59.99 -12.89 9.02 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-O 121.41 0.624 . . . . 4.2400000000000002 111.996 178.824 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' CYS . . . . . 0.442 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 71.2 m -84.16 -8.64 59.02 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 115.42 -0.809 . . . . 5.5999999999999996 111.384 178.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.469 ' HD2' ' HG ' ' A' ' 84' ' ' LEU . 19.9 t80 -168.12 84.1 0.75 Allowed Pre-proline 0 N--CA 1.434 -1.269 0 N-CA-C 108.158 -1.053 . . . . 5.1299999999999999 108.158 168.89 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -62.14 5.97 0.2 Allowed 'Trans proline' 0 N--CA 1.508 2.371 0 C-N-CA 124.57 3.513 . . . . 3.27 115.199 -174.125 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.434 ' HB2' ' CE2' ' A' ' 81' ' ' PHE . 90.3 m-70 -92.81 3.34 55.84 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 109.803 -0.443 . . . . 4.25 109.803 177.529 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.469 ' HG ' ' HD2' ' A' ' 81' ' ' PHE . 45.7 mt . . . . . 0 C--N 1.32 -0.716 0 CA-C-N 115.96 -0.564 . . . . 5.4699999999999998 110.641 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 68.1 mtm . . . . . 0 N--CA 1.486 1.357 0 N-CA-C 112.002 0.371 . . . . 7.6200000000000001 112.002 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.7 p 48.25 -101.1 0.07 Allowed 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 115.666 1.728 . . . . 3.9100000000000001 115.666 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.529 ' O ' ' HA ' ' A' ' 54' ' ' THR . 62.0 mt -122.83 136.64 58.98 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.059 0 N-CA-C 109.006 -0.738 . . . . 3.7599999999999998 109.006 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.632 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 7.3 tt0 -102.89 141.84 35.02 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.779 0.324 . . . . 6.79 110.618 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.552 ' SG ' HG12 ' A' ' 50' ' ' VAL . 48.7 t -80.0 144.68 33.04 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.985 -0.552 . . . . 5.4299999999999997 110.911 177.829 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.412 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 1.8 tmmm? -59.92 -44.67 94.18 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 125.061 1.344 . . . . 5.9100000000000001 112.299 -174.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.552 HG12 ' SG ' ' A' ' 48' ' ' CYS . 7.5 p -46.95 -37.86 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 N-CA-C 114.885 1.439 . . . . 7.9400000000000004 114.885 -171.811 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 50.1 t -159.96 -67.26 0.07 Allowed 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.388 -0.525 . . . . 9.2799999999999994 110.072 -179.383 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 27.5 ttt 178.21 60.24 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.417 0 O-C-N 123.758 0.662 . . . . 9.4399999999999995 109.904 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.632 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 9.2 mm100 -103.55 -170.78 1.83 Allowed 'General case' 0 C--O 1.203 -1.384 0 N-CA-C 107.478 -1.304 . . . . 9.1099999999999994 107.478 -177.496 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.529 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 9.0 t -141.94 157.97 44.33 Favored 'General case' 0 N--CA 1.42 -1.952 0 C-N-CA 118.333 -1.347 . . . . 5.9299999999999997 113.013 -178.205 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -140.39 139.98 35.41 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 106.026 -1.842 . . . . 5.2699999999999996 106.026 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 7.1 tp -63.49 140.62 19.35 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 O-C-N 123.413 0.445 . . . . 5.2300000000000004 111.623 -178.423 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 12.6 p -75.08 72.13 2.18 Favored 'General case' 0 N--CA 1.426 -1.638 0 CA-C-O 121.747 0.784 . . . . 4.21 112.71 178.16 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 24.5 p -82.46 -4.47 57.51 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.312 -0.858 . . . . 6.0099999999999998 109.872 171.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.553 HG21 ' SG ' ' A' ' 64' ' ' CYS . 25.1 m -143.31 161.0 39.48 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 106.586 -1.635 . . . . 6.1900000000000004 106.586 176.905 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.5 m -87.27 17.22 4.51 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 112.219 0.452 . . . . 6.4699999999999998 112.219 -174.051 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.527 ' CD ' ' HE ' ' A' ' 65' ' ' ARG . 5.4 tp10 67.58 -64.85 0.26 Allowed 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 112.225 0.454 . . . . 4.8600000000000003 112.225 179.229 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.403 ' HA ' ' HB2' ' A' ' 65' ' ' ARG . 5.4 p -63.9 -25.86 39.19 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 C-N-CA 123.014 0.526 . . . . 7.2300000000000004 111.016 -175.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -62.28 -41.59 98.62 Favored 'General case' 0 C--O 1.25 1.104 0 N-CA-C 108.106 -1.072 . . . . 9.3599999999999994 108.106 177.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' CYS . . . . . 0.553 ' SG ' HG21 ' A' ' 59' ' ' THR . 63.9 m -77.48 -29.42 52.65 Favored 'General case' 0 N--CA 1.424 -1.741 0 CA-C-N 115.058 -0.974 . . . . 5.9000000000000004 108.904 176.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.527 ' HE ' ' CD ' ' A' ' 61' ' ' GLU . 97.1 mtt180 -57.78 -47.18 83.29 Favored 'General case' 0 CA--C 1.5 -0.957 0 N-CA-C 113.114 0.783 . . . . 7.6900000000000004 113.114 179.047 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -65.35 -40.69 93.94 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 119.95 -0.7 . . . . 9.7799999999999994 110.49 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' HIS . . . . . 0.42 ' O ' ' HB3' ' A' ' 70' ' ' ALA . 13.8 t-80 -75.91 -26.95 57.44 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 115.937 -0.574 . . . . 8.9700000000000006 110.725 -175.775 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.599 ' O ' ' HB2' ' A' ' 72' ' ' HIS . . . -77.62 -49.85 13.74 Favored 'General case' 0 C--O 1.186 -2.255 0 N-CA-C 109.935 -0.395 . . . . 6.5300000000000002 109.935 178.804 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -67.81 -8.45 36.08 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.39 0.614 . . . . 8.5 111.049 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.42 ' HB3' ' O ' ' A' ' 67' ' ' HIS . . . -73.12 -31.37 64.26 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 115.047 -0.979 . . . . 9.4100000000000001 109.446 173.621 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -131.39 -79.07 0.52 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.793 -0.64 . . . . 10.32 110.113 -176.313 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.599 ' HB2' ' O ' ' A' ' 68' ' ' ALA . 5.8 t-160 47.07 48.43 5.71 Favored Pre-proline 0 CA--C 1.566 1.587 0 C-N-CA 124.809 1.244 . . . . 7.4699999999999998 111.643 176.801 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.441 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 45.7 Cg_exo -56.61 -51.09 9.89 Favored 'Trans proline' 0 C--N 1.387 2.556 0 C-N-CA 121.903 1.735 . . . . 6.8099999999999996 111.789 -174.579 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -163.69 106.86 0.98 Allowed 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.68 -0.691 . . . . 7.3200000000000003 109.727 178.309 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.27 111.35 2.57 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 120.039 -0.665 . . . . 4.5199999999999996 109.338 173.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -107.01 -87.62 0.47 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 114.871 -1.058 . . . . 6.8200000000000003 110.858 -170.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 30.3 m -82.16 -1.69 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-O 122.468 1.127 . . . . 8.1500000000000004 108.973 174.636 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 32.7 m -110.01 10.05 8.83 Favored 'Isoleucine or valine' 0 C--O 1.183 -2.403 0 CA-C-N 113.286 -1.779 . . . . 5.6500000000000004 108.517 176.697 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.57 -21.38 62.54 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-O 121.598 0.714 . . . . 4.2400000000000002 112.156 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' CYS . . . . . 0.466 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 72.3 m -76.37 -15.92 59.85 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.557 -0.747 . . . . 5.5999999999999996 110.876 176.74 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.65 ' CD1' HD12 ' A' ' 84' ' ' LEU . 4.4 p90 -153.61 71.49 6.7 Favored Pre-proline 0 CA--C 1.555 1.164 0 C-N-CA 124.728 1.211 . . . . 5.1299999999999999 111.119 -179.366 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -64.63 -1.56 4.17 Favored 'Trans proline' 0 C--N 1.364 1.371 0 C-N-CA 123.944 3.096 . . . . 3.27 116.239 -172.047 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -91.86 -0.49 57.51 Favored 'General case' 0 C--N 1.297 -1.688 0 C-N-CA 119.502 -0.879 . . . . 4.25 109.891 177.399 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.65 HD12 ' CD1' ' A' ' 81' ' ' PHE . 20.0 mt . . . . . 0 N--CA 1.425 -1.676 0 C-N-CA 121.011 -0.276 . . . . 5.4699999999999998 111.347 -175.6 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 26.1 mmt . . . . . 0 N--CA 1.487 1.401 0 N-CA-C 111.889 0.329 . . . . 7.6200000000000001 111.889 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.7 p 46.69 -98.55 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.157 0 N-CA-C 116.485 2.032 . . . . 3.9100000000000001 116.485 176.073 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.472 ' O ' ' HA ' ' A' ' 54' ' ' THR . 66.5 mt -119.99 149.87 22.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.024 0 N-CA-C 108.294 -1.002 . . . . 3.7599999999999998 108.294 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.638 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 1.2 tp60 -119.22 141.33 49.0 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 108.841 -0.8 . . . . 6.79 108.841 -177.407 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.695 ' SG ' HG12 ' A' ' 50' ' ' VAL . 22.6 t -78.99 147.65 32.83 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 112.217 0.451 . . . . 5.4299999999999997 112.217 -177.2 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 2.5 tmmm? -64.29 -46.37 83.94 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.827 1.251 . . . . 5.9100000000000001 110.978 -177.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.695 HG12 ' SG ' ' A' ' 48' ' ' CYS . 8.5 p -51.19 -32.55 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 N-CA-C 113.962 1.097 . . . . 7.9400000000000004 113.962 -173.172 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 41.9 t -159.01 -74.06 0.08 Allowed 'General case' 0 C--N 1.3 -1.583 0 C-N-CA 120.79 -0.364 . . . . 9.2799999999999994 110.044 -177.684 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.451 ' HG2' HE21 ' A' ' 47' ' ' GLN . 35.2 ttp 176.38 40.64 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 108.967 -0.753 . . . . 9.4399999999999995 108.967 -176.368 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.638 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 7.4 mm100 -89.69 -176.22 4.91 Favored 'General case' 0 C--O 1.193 -1.894 0 N-CA-C 107.72 -1.215 . . . . 9.1099999999999994 107.72 -174.819 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.472 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 5.2 t -133.17 152.19 51.95 Favored 'General case' 0 C--N 1.286 -2.185 0 C-N-CA 117.73 -1.588 . . . . 5.9299999999999997 113.506 -175.076 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -135.18 156.55 48.8 Favored 'General case' 0 N--CA 1.427 -1.613 0 N-CA-C 106.489 -1.671 . . . . 5.2699999999999996 106.489 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.2 tp -70.83 138.34 22.03 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.657 0 O-C-N 123.713 0.633 . . . . 5.2300000000000004 111.88 -176.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 19.0 p -86.36 74.15 10.02 Favored 'General case' 0 N--CA 1.418 -2.064 0 CA-C-O 121.588 0.709 . . . . 4.21 111.132 178.481 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.1 p -70.78 -16.01 62.71 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.356 -0.838 . . . . 6.0099999999999998 109.931 173.315 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 60.7 m -155.14 153.18 30.41 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 106.299 -1.741 . . . . 6.1900000000000004 106.299 176.778 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.9 m -77.4 138.27 39.19 Favored 'General case' 0 N--CA 1.418 -2.03 0 N-CA-C 106.459 -1.682 . . . . 6.4699999999999998 106.459 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -52.17 -39.31 59.86 Favored 'General case' 0 C--O 1.185 -2.291 0 C-N-CA 120.749 -0.381 . . . . 4.8600000000000003 110.402 -179.012 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.548 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 17.2 m -53.38 -41.42 44.33 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.205 0 N-CA-C 114.403 1.26 . . . . 7.2300000000000004 114.403 -178.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -72.37 -33.08 66.98 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 122.137 0.97 . . . . 9.3599999999999994 108.851 -179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 60.0 m -73.48 -31.34 63.7 Favored 'General case' 0 C--N 1.31 -1.135 0 N-CA-C 108.39 -0.967 . . . . 5.9000000000000004 108.39 178.227 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.45 ' HB3' ' O ' ' A' ' 62' ' ' VAL . 27.1 ttm180 -64.86 -42.85 94.53 Favored 'General case' 0 N--CA 1.426 -1.65 0 C-N-CA 125.472 1.509 . . . . 7.6900000000000004 110.967 177.764 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.548 ' HG3' ' O ' ' A' ' 62' ' ' VAL . 27.9 mt-10 -55.43 -47.92 75.24 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 122.372 1.082 . . . . 9.7799999999999994 108.44 178.645 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -75.59 -16.82 60.19 Favored 'General case' 0 C--N 1.293 -1.87 0 CA-C-N 113.768 -1.56 . . . . 8.9700000000000006 110.943 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.603 ' HA ' ' CD2' ' A' ' 72' ' ' HIS . . . -88.56 -41.46 12.68 Favored 'General case' 0 CA--C 1.489 -1.386 0 N-CA-C 112.423 0.527 . . . . 6.5300000000000002 112.423 -177.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 33.0 mm-40 -68.2 -25.06 65.04 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 107.854 -1.165 . . . . 8.5 107.854 178.405 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.483 ' O ' ' HD3' ' A' ' 71' ' ' LYS . . . -75.8 -31.24 59.35 Favored 'General case' 0 C--O 1.245 0.854 0 CA-C-N 114.783 -1.099 . . . . 9.4100000000000001 111.192 176.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.483 ' HD3' ' O ' ' A' ' 70' ' ' ALA . 73.4 mmtt -135.43 -111.08 0.21 Allowed 'General case' 0 C--N 1.355 0.842 0 N-CA-C 109.682 -0.488 . . . . 10.32 109.682 -177.239 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.603 ' CD2' ' HA ' ' A' ' 68' ' ' ALA . 9.7 m170 29.23 51.62 0.4 Allowed Pre-proline 0 N--CA 1.501 2.086 0 N-CA-C 115.758 1.762 . . . . 7.4699999999999998 115.758 178.336 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.535 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 1.0 OUTLIER -79.85 -3.35 12.75 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.375 2.05 . . . . 6.8099999999999996 113.838 -175.069 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.454 ' HE3' ' HB2' ' A' ' 74' ' ' LYS . 18.4 ptmt -161.45 109.3 1.47 Allowed 'General case' 0 C--O 1.199 -1.597 0 N-CA-C 111.987 0.365 . . . . 7.3200000000000003 111.987 -177.198 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -97.62 122.04 40.24 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.221 -1.029 . . . . 4.5199999999999996 108.221 174.421 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -98.95 -90.65 0.29 Allowed 'General case' 0 C--O 1.211 -0.942 0 CA-C-N 115.815 -0.629 . . . . 6.8200000000000003 110.818 -173.024 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 32.7 m -82.44 -11.95 12.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 CA-C-O 122.284 1.04 . . . . 8.1500000000000004 109.044 176.594 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 35.8 m -99.19 13.57 5.0 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 CA-C-N 113.881 -1.509 . . . . 5.6500000000000004 108.707 177.382 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.85 -15.2 53.64 Favored 'General case' 0 C--O 1.251 1.132 0 CA-C-O 121.622 0.725 . . . . 4.2400000000000002 111.539 178.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' CYS . . . . . 0.426 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 73.6 m -75.56 -15.81 60.33 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-N 115.295 -0.866 . . . . 5.5999999999999996 110.701 175.165 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.522 ' CD1' HD12 ' A' ' 84' ' ' LEU . 16.4 p90 -154.1 70.6 6.34 Favored Pre-proline 0 CA--C 1.561 1.382 0 C-N-CA 124.454 1.102 . . . . 5.1299999999999999 111.527 179.068 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -57.38 -22.96 52.6 Favored 'Trans proline' 0 N--CA 1.495 1.589 0 C-N-CA 123.481 2.787 . . . . 3.27 114.478 -173.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -73.71 -1.38 18.86 Favored 'General case' 0 C--N 1.309 -1.181 0 C-N-CA 120.161 -0.615 . . . . 4.25 111.825 -178.051 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.522 HD12 ' CD1' ' A' ' 81' ' ' PHE . 19.3 mt . . . . . 0 C--O 1.208 -1.11 0 CA-C-N 118.162 0.437 . . . . 5.4699999999999998 111.011 -177.134 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.473 0.696 0 CA-C-O 121.55 0.691 . . . . 7.6200000000000001 110.795 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.506 ' OG ' HG13 ' A' ' 46' ' ' ILE . 22.7 t -60.0 -81.86 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 114.889 -1.05 . . . . 3.9100000000000001 113.767 -178.263 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.506 HG13 ' OG ' ' A' ' 45' ' ' SER . 13.2 mt -129.41 159.34 41.55 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 CA-C-N 115.968 -0.56 . . . . 3.7599999999999998 110.056 -172.368 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.624 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 34.9 tt0 -108.98 135.03 50.83 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.914 0.885 . . . . 6.79 109.196 178.548 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.678 ' SG ' HG12 ' A' ' 50' ' ' VAL . 47.6 t -77.55 144.81 37.31 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.516 -0.765 . . . . 5.4299999999999997 111.06 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' A' ' 79' ' ' ALA . 14.7 ttpt -59.13 -47.07 86.63 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 124.897 1.279 . . . . 5.9100000000000001 112.426 -175.56 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.678 HG12 ' SG ' ' A' ' 48' ' ' CYS . 7.1 p -49.48 -32.84 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-N 114.542 -1.208 . . . . 7.9400000000000004 113.902 -170.764 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.436 ' SG ' ' HG2' ' A' ' 52' ' ' MET . 52.7 t -160.02 -71.23 0.07 Allowed 'General case' 0 N--CA 1.419 -2.01 0 C-N-CA 119.915 -0.714 . . . . 9.2799999999999994 110.492 -177.359 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.436 ' HG2' ' SG ' ' A' ' 51' ' ' CYS . 24.3 ptt? -178.95 28.12 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 O-C-N 123.5 0.5 . . . . 9.4399999999999995 111.195 -174.568 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.624 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 5.6 mm100 -83.95 178.6 7.81 Favored 'General case' 0 C--O 1.201 -1.456 0 N-CA-C 108.177 -1.045 . . . . 9.1099999999999994 108.177 -171.36 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.491 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 9.5 t -134.86 145.1 47.97 Favored 'General case' 0 C--N 1.279 -2.483 0 C-N-CA 117.894 -1.523 . . . . 5.9299999999999997 112.303 -175.697 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.487 ' O ' ' HB3' ' A' ' 45' ' ' SER . 96.8 m-85 -107.31 173.42 6.33 Favored 'General case' 0 N--CA 1.424 -1.762 0 CA-C-N 114.317 -1.311 . . . . 5.2699999999999996 108.27 176.404 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.613 HD13 ' H ' ' A' ' 57' ' ' CYS . 0.3 OUTLIER -104.51 148.79 8.7 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.547 0 N-CA-C 107.287 -1.375 . . . . 5.2300000000000004 107.287 -177.217 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.613 ' H ' HD13 ' A' ' 56' ' ' ILE . 42.5 t -71.82 77.58 0.87 Allowed 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.895 0.855 . . . . 4.21 110.322 176.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 9.9 t -96.95 -11.02 25.15 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 114.859 -1.064 . . . . 6.0099999999999998 108.706 174.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 47.2 m -161.95 150.81 15.47 Favored 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 106.76 -1.57 . . . . 6.1900000000000004 106.76 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 11.3 m -89.4 131.16 35.59 Favored 'General case' 0 N--CA 1.406 -2.647 0 N-CA-C 105.719 -1.956 . . . . 6.4699999999999998 105.719 178.279 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.545 ' O ' ' HG3' ' A' ' 65' ' ' ARG . 42.7 mt-10 -52.45 -29.98 27.35 Favored 'General case' 0 C--O 1.186 -2.256 0 N-CA-C 112.787 0.662 . . . . 4.8600000000000003 112.787 -177.253 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.406 HG22 ' NH2' ' A' ' 65' ' ' ARG . 86.5 t -58.91 -36.86 63.77 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.4 0 N-CA-C 111.721 0.267 . . . . 7.2300000000000004 111.721 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -71.56 -30.59 66.04 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 108.02 -1.104 . . . . 9.3599999999999994 108.02 -179.444 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 69.8 m -80.2 -25.68 39.55 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 114.726 -1.125 . . . . 5.9000000000000004 110.956 176.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.545 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 65.8 mtm180 -64.78 -49.12 71.95 Favored 'General case' 0 CA--C 1.5 -0.958 0 N-CA-C 111.972 0.36 . . . . 7.6900000000000004 111.972 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -63.68 -39.48 94.42 Favored 'General case' 0 C--O 1.217 -0.617 0 C-N-CA 119.967 -0.693 . . . . 9.7799999999999994 109.673 177.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -62.72 -30.85 71.73 Favored 'General case' 0 CA--C 1.558 1.271 0 CA-C-N 115.918 -0.583 . . . . 8.9700000000000006 111.085 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -77.67 -50.36 12.62 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 116.295 -0.411 . . . . 6.5300000000000002 111.17 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 10.8 pt-20 -69.17 -18.09 63.89 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 121.103 0.478 . . . . 8.5 111.743 -178.527 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.0 -17.56 59.64 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.424 -0.807 . . . . 9.4100000000000001 111.287 176.632 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -138.19 -73.99 0.4 Allowed 'General case' 0 C--O 1.211 -0.93 0 CA-C-O 120.691 0.281 . . . . 10.32 111.31 -174.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 18.5 p80 43.5 63.06 8.36 Favored Pre-proline 0 N--CA 1.478 0.963 0 N-CA-C 114.864 1.431 . . . . 7.4699999999999998 114.864 -178.009 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -79.74 -60.64 0.03 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.343 0 C-N-CA 121.244 1.296 . . . . 6.8099999999999996 114.101 178.664 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -158.21 107.29 2.03 Favored 'General case' 0 N--CA 1.44 -0.942 0 C-N-CA 119.587 -0.845 . . . . 7.3200000000000003 112.555 -173.695 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.0 89.96 7.72 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.374 -0.83 . . . . 4.5199999999999996 110.201 176.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -113.98 -72.48 0.7 Allowed 'General case' 0 N--CA 1.482 1.165 0 CA-C-O 121.101 0.477 . . . . 6.8200000000000003 111.647 -178.233 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 27.2 m -77.51 -14.56 14.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 122.079 0.942 . . . . 8.1500000000000004 108.973 176.032 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 29.1 m -105.22 11.08 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.141 0 CA-C-N 114.346 -1.297 . . . . 5.6500000000000004 108.979 175.141 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.514 ' O ' ' HD3' ' A' ' 49' ' ' LYS . . . -61.21 -18.2 57.06 Favored 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 112.076 0.398 . . . . 4.2400000000000002 112.076 179.405 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' CYS . . . . . 0.534 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 78.2 m -76.99 -13.1 60.0 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 116.212 -0.449 . . . . 5.5999999999999996 111.293 178.633 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.41 ' CZ ' HG21 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -151.69 75.27 7.75 Favored Pre-proline 0 C--N 1.306 -1.29 0 N-CA-C 106.69 -1.596 . . . . 5.1299999999999999 106.69 174.634 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -67.88 9.44 0.36 Allowed 'Trans proline' 0 C--N 1.367 1.538 0 C-N-CA 123.7 2.933 . . . . 3.27 114.345 -173.112 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 38.7 m170 -91.08 -4.6 56.15 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.946 -0.761 . . . . 4.25 108.946 175.263 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 13.4 mt . . . . . 0 N--CA 1.469 0.518 0 CA-C-N 116.299 -0.409 . . . . 5.4699999999999998 110.435 -174.974 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.452 -0.343 0 CA-C-O 121.513 0.673 . . . . 7.6200000000000001 111.496 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.508 ' HB2' ' O ' ' A' ' 55' ' ' PHE . 62.6 m -61.26 -72.52 0.12 Allowed 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 114.816 -1.084 . . . . 3.9100000000000001 112.253 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.525 ' O ' ' HA ' ' A' ' 54' ' ' THR . 75.4 mt -129.6 129.73 66.75 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 N-CA-C 108.019 -1.104 . . . . 3.7599999999999998 108.019 -178.727 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.584 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 28.8 tt0 -97.9 130.33 44.79 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 108.728 -0.841 . . . . 6.79 108.728 178.265 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.594 ' SG ' HG22 ' A' ' 50' ' ' VAL . 41.9 t -67.56 123.6 20.89 Favored 'General case' 0 N--CA 1.421 -1.88 0 CA-C-N 115.708 -0.678 . . . . 5.4299999999999997 110.479 178.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.444 ' HD2' ' O ' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -50.07 -33.15 17.51 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 127.17 2.188 . . . . 5.9100000000000001 111.608 -177.759 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.594 HG22 ' SG ' ' A' ' 48' ' ' CYS . 10.2 m -59.1 -23.18 23.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 N-CA-C 112.765 0.654 . . . . 7.9400000000000004 112.765 -175.809 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.9 t -173.63 -81.93 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 120.734 0.302 . . . . 9.2799999999999994 110.89 178.29 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.535 ' HA ' ' CG ' ' A' ' 47' ' ' GLN . 55.0 ttp -165.5 36.73 0.06 Allowed 'General case' 0 CA--C 1.547 0.832 0 CA-C-O 122.326 1.06 . . . . 9.4399999999999995 109.736 -174.573 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.584 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 7.4 mm100 -88.99 -177.27 5.42 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 107.302 -1.369 . . . . 9.1099999999999994 107.302 -178.497 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.525 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 13.3 t -144.32 149.22 35.87 Favored 'General case' 0 N--CA 1.42 -1.952 0 C-N-CA 117.156 -1.817 . . . . 5.9299999999999997 113.041 -177.613 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.508 ' O ' ' HB2' ' A' ' 45' ' ' SER . 98.4 m-85 -125.93 153.74 43.82 Favored 'General case' 0 N--CA 1.418 -2.068 0 N-CA-C 106.826 -1.546 . . . . 5.2699999999999996 106.826 177.192 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 9.0 tp -79.32 139.72 17.91 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.342 0 O-C-N 123.411 0.444 . . . . 5.2300000000000004 110.377 -178.099 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.443 ' HB2' ' HB3' ' A' ' 45' ' ' SER . 43.0 t -81.16 74.7 8.16 Favored 'General case' 0 N--CA 1.429 -1.525 0 N-CA-C 108.683 -0.858 . . . . 4.21 108.683 177.103 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 9.8 t -92.26 1.14 57.4 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.406 -0.816 . . . . 6.0099999999999998 109.951 177.718 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 92.5 m -156.54 137.26 13.29 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 108.014 -1.106 . . . . 6.1900000000000004 108.014 178.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 17.9 m -78.72 138.23 38.16 Favored 'General case' 0 N--CA 1.419 -1.997 0 O-C-N 123.522 0.514 . . . . 6.4699999999999998 110.038 -175.893 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -51.08 -29.33 12.73 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 124.915 1.286 . . . . 4.8600000000000003 112.295 178.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 64.3 t -72.54 -32.42 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.78 0 CA-C-O 120.913 0.387 . . . . 7.2300000000000004 111.384 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -71.52 -39.59 70.67 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 122.322 1.058 . . . . 9.3599999999999994 108.96 177.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 55.6 m -62.47 -38.16 88.75 Favored 'General case' 0 C--N 1.271 -2.814 0 CA-C-N 113.885 -1.507 . . . . 5.9000000000000004 109.462 174.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 23.5 ttt180 -57.68 -51.74 68.29 Favored 'General case' 0 N--CA 1.444 -0.768 0 C-N-CA 123.811 0.845 . . . . 7.6900000000000004 112.895 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -61.7 -38.22 87.03 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-O 121.488 0.661 . . . . 9.7799999999999994 111.346 -177.341 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 32.0 t60 -76.67 -31.8 57.53 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.857 -0.61 . . . . 8.9700000000000006 109.898 -177.099 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.439 ' O ' ' HB3' ' A' ' 72' ' ' HIS . . . -75.99 -25.39 55.74 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 115.753 -0.658 . . . . 6.5300000000000002 111.717 -177.624 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -83.17 -21.03 33.64 Favored 'General case' 0 C--N 1.294 -1.839 0 C-N-CA 120.03 -0.668 . . . . 8.5 111.512 176.497 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.47 -32.44 37.11 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.08 0.466 . . . . 9.4100000000000001 110.493 175.774 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . 0.441 ' HB3' ' HD3' ' A' ' 73' ' ' PRO . 13.5 mptt -101.45 -86.54 0.41 Allowed 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.948 0.721 . . . . 10.32 112.948 -179.002 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.461 ' N ' ' HD3' ' A' ' 73' ' ' PRO 0.256 23.9 p80 46.38 59.01 16.21 Favored Pre-proline 0 N--CA 1.485 1.276 0 N-CA-C 116.052 1.871 . . . . 7.4699999999999998 116.052 -177.306 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.461 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 6.2 Cg_exo -82.34 -55.43 0.03 OUTLIER 'Trans proline' 0 N--CA 1.434 -2.016 0 C-N-CA 121.77 1.647 . . . . 6.8099999999999996 112.063 175.235 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 12.7 ptmm? -160.84 108.82 1.56 Allowed 'General case' 0 N--CA 1.436 -1.16 0 CA-C-O 121.435 0.636 . . . . 7.3200000000000003 111.819 -177.402 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 79' ' ' ALA . . . -73.07 88.88 1.43 Allowed 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 106.777 -1.564 . . . . 4.5199999999999996 106.777 171.236 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -113.19 -75.24 0.6 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.014 -0.994 . . . . 6.8200000000000003 110.66 -172.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 34.8 m -78.64 -11.91 13.34 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.832 0 CA-C-O 121.893 0.854 . . . . 8.1500000000000004 108.743 176.247 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 33.4 m -109.29 13.1 8.68 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.025 0 CA-C-N 114.393 -1.276 . . . . 5.6500000000000004 109.246 177.06 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.414 ' HB2' ' O ' ' A' ' 75' ' ' ALA . . . -66.32 -6.0 12.55 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 121.725 0.774 . . . . 4.2400000000000002 110.604 177.577 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' CYS . . . . . 0.405 ' HB2' ' SG ' ' A' ' 48' ' ' CYS . 18.4 p -70.85 -27.31 63.75 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-N 114.813 -1.085 . . . . 5.5999999999999996 109.634 176.673 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -155.02 88.22 3.22 Favored Pre-proline 0 N--CA 1.439 -0.986 0 N-CA-C 106.866 -1.531 . . . . 5.1299999999999999 106.866 174.658 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -60.6 5.49 0.14 Allowed 'Trans proline' 0 N--CA 1.503 2.061 0 C-N-CA 124.212 3.275 . . . . 3.27 115.063 -172.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 65.1 m-70 -87.96 -8.58 55.5 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 109.205 -0.665 . . . . 4.25 109.205 174.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 36.9 mt . . . . . 0 CA--C 1.536 0.435 0 CA-C-N 115.848 -0.615 . . . . 5.4699999999999998 111.128 -176.83 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 72.1 mtm . . . . . 0 CA--C 1.5 -0.963 0 CA-C-O 121.654 0.74 . . . . 7.6200000000000001 109.122 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.584 ' HB2' ' O ' ' A' ' 55' ' ' PHE . 75.3 m -143.89 -73.04 0.27 Allowed 'General case' 0 N--CA 1.413 -2.321 0 CA-C-N 114.561 -1.2 . . . . 3.9100000000000001 113.872 -174.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.594 ' O ' ' HA ' ' A' ' 54' ' ' THR . 44.3 mt -111.79 136.67 47.2 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.492 0 O-C-N 121.868 -0.52 . . . . 3.7599999999999998 109.816 -177.836 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.641 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 4.4 tt0 -97.59 123.98 41.69 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 109.504 -0.554 . . . . 6.79 109.504 -176.75 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.698 ' SG ' HG22 ' A' ' 50' ' ' VAL . 34.2 t -60.46 141.78 55.98 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.725 1.61 . . . . 5.4299999999999997 114.052 -173.899 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.431 ' HD2' ' O ' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -72.12 -31.96 66.51 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.338 1.455 . . . . 5.9100000000000001 109.467 -177.77 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.698 HG22 ' SG ' ' A' ' 48' ' ' CYS . 5.9 m -61.28 -26.58 39.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 115.868 -0.606 . . . . 7.9400000000000004 111.6 -174.488 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.7 t -161.86 -76.72 0.05 OUTLIER 'General case' 0 N--CA 1.426 -1.646 0 CA-C-N 115.967 -0.56 . . . . 9.2799999999999994 109.97 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 34.3 ttp 178.51 35.75 0.0 OUTLIER 'General case' 0 C--O 1.212 -0.892 0 CA-C-O 121.925 0.869 . . . . 9.4399999999999995 108.84 -175.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.641 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 6.5 mm100 -93.92 -164.7 1.21 Allowed 'General case' 0 C--O 1.191 -1.983 0 N-CA-C 108.0 -1.111 . . . . 9.1099999999999994 108.0 -172.433 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.594 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 15.3 t -137.14 162.41 33.49 Favored 'General case' 0 C--N 1.313 -0.999 0 C-N-CA 116.828 -1.949 . . . . 5.9299999999999997 113.184 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.584 ' O ' ' HB2' ' A' ' 45' ' ' SER . 96.6 m-85 -144.18 177.9 8.27 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 126.626 1.97 . . . . 5.2699999999999996 106.978 177.829 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 7.5 tp -86.95 134.73 26.81 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 CA-C-O 120.977 0.418 . . . . 5.2300000000000004 111.994 -176.787 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.558 ' CB ' ' HB3' ' A' ' 45' ' ' SER . 10.3 t -110.4 85.0 2.02 Favored 'General case' 0 N--CA 1.413 -2.296 0 N-CA-C 107.353 -1.351 . . . . 4.21 107.353 175.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.9 p -55.27 -35.13 64.69 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.17 -0.923 . . . . 6.0099999999999998 111.681 174.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.65 HG23 ' H ' ' A' ' 61' ' ' GLU . 14.2 t -109.09 -155.44 0.56 Allowed 'General case' 0 CA--C 1.556 1.176 0 N-CA-C 108.723 -0.843 . . . . 6.1900000000000004 108.723 -178.105 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.0 t -100.07 21.74 12.36 Favored 'General case' 0 CA--C 1.554 1.097 0 N-CA-C 109.68 -0.489 . . . . 6.4699999999999998 109.68 177.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.65 ' H ' HG23 ' A' ' 59' ' ' THR . 29.7 tt0 64.78 -50.88 0.32 Allowed 'General case' 0 N--CA 1.503 2.191 0 C-N-CA 126.361 1.864 . . . . 4.8600000000000003 111.942 -175.163 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.518 ' HA ' ' HB3' ' A' ' 65' ' ' ARG . 57.7 t -51.01 -29.49 7.9 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 C-N-CA 125.361 1.464 . . . . 7.2300000000000004 112.956 -176.86 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.53 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 4.7 tmtm? -72.5 -38.07 68.23 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 122.038 0.923 . . . . 9.3599999999999994 108.898 -179.311 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 85.6 m -75.78 -29.28 58.72 Favored 'General case' 0 C--N 1.284 -2.259 0 N-CA-C 109.038 -0.727 . . . . 5.9000000000000004 109.038 176.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.518 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 21.8 tpt180 -56.86 -55.34 35.65 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.421 1.088 . . . . 7.6900000000000004 111.34 177.631 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -59.1 -37.61 77.55 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 123.981 0.801 . . . . 9.7799999999999994 110.73 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 52.8 t60 -76.7 -26.77 55.08 Favored 'General case' 0 C--O 1.21 -1.023 0 C-N-CA 120.368 -0.533 . . . . 8.9700000000000006 111.501 -178.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ALA . . . . . 0.457 ' O ' ' HB2' ' A' ' 72' ' ' HIS . . . -82.13 -38.03 25.38 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 111.771 0.286 . . . . 6.5300000000000002 111.771 -177.08 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -73.49 -23.49 60.06 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.3 0.571 . . . . 8.5 110.297 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -89.63 -7.0 55.69 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.596 -0.729 . . . . 9.4100000000000001 111.437 178.518 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -136.0 -85.87 0.36 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 111.962 0.356 . . . . 10.32 111.962 -177.624 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.457 ' HB2' ' O ' ' A' ' 68' ' ' ALA . 44.3 t-80 51.25 51.8 10.95 Favored Pre-proline 0 CA--C 1.561 1.37 0 C-N-CA 123.743 0.817 . . . . 7.4699999999999998 110.272 -178.197 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.45 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 31.4 Cg_exo -61.11 -46.67 14.7 Favored 'Trans proline' 0 C--N 1.382 2.301 0 C-N-CA 121.481 1.454 . . . . 6.8099999999999996 110.79 -176.104 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 15.5 pttp -167.49 106.23 0.55 Allowed 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 115.196 -0.911 . . . . 7.3200000000000003 109.075 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.433 ' O ' HG22 ' A' ' 78' ' ' VAL . . . -57.7 -54.7 43.94 Favored 'General case' 0 CA--C 1.564 1.518 0 N-CA-C 114.494 1.294 . . . . 4.5199999999999996 114.494 177.645 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 56.43 -94.73 0.05 OUTLIER 'General case' 0 N--CA 1.518 2.958 0 C-N-CA 124.455 1.102 . . . . 6.8200000000000003 113.136 -178.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.6 m -85.66 -17.03 9.72 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.746 0 CA-C-N 115.353 -0.84 . . . . 8.1500000000000004 110.894 -176.086 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.433 HG22 ' O ' ' A' ' 75' ' ' ALA . 26.3 m -103.18 13.51 6.94 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.639 0 N-CA-C 109.079 -0.711 . . . . 5.6500000000000004 109.079 175.154 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.9 -12.91 28.31 Favored 'General case' 0 N--CA 1.489 1.483 0 CA-C-O 121.429 0.633 . . . . 4.2400000000000002 111.687 176.357 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 71.6 m -74.98 -11.59 60.14 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-N 115.803 -0.635 . . . . 5.5999999999999996 110.262 176.224 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.455 ' CE2' ' HB2' ' A' ' 83' ' ' HIS . 25.8 t80 -167.78 83.37 0.8 Allowed Pre-proline 0 N--CA 1.435 -1.198 0 N-CA-C 108.226 -1.027 . . . . 5.1299999999999999 108.226 172.108 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -63.07 11.26 0.09 OUTLIER 'Trans proline' 0 N--CA 1.498 1.741 0 C-N-CA 124.384 3.39 . . . . 3.27 116.053 -173.82 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.455 ' HB2' ' CE2' ' A' ' 81' ' ' PHE . 50.3 m170 -87.19 -1.62 58.03 Favored 'General case' 0 C--O 1.193 -1.908 0 N-CA-C 109.026 -0.731 . . . . 4.25 109.026 174.501 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 45.2 mt . . . . . 0 C--O 1.241 0.647 0 N-CA-C 113.556 0.947 . . . . 5.4699999999999998 113.556 -172.952 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 47.2 tpp . . . . . 0 N--CA 1.503 2.213 0 CA-C-O 121.358 0.599 . . . . 7.6200000000000001 111.757 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . 0.264 32.6 p 48.02 -98.74 0.05 OUTLIER 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 116.177 1.917 . . . . 3.9100000000000001 116.177 179.058 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.54 ' O ' ' HA ' ' A' ' 54' ' ' THR . 70.2 mt -127.32 127.07 68.77 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.251 0 N-CA-C 109.414 -0.587 . . . . 3.7599999999999998 109.414 -177.524 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.611 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 26.1 tt0 -99.52 133.38 43.93 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 109.133 -0.691 . . . . 6.79 109.133 -178.025 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.495 ' SG ' HG22 ' A' ' 50' ' ' VAL . 49.5 t -72.53 131.75 42.91 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 115.69 -0.687 . . . . 5.4299999999999997 112.584 -177.465 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 5.9 ttpt -52.9 -29.39 28.11 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 127.097 2.159 . . . . 5.9100000000000001 112.465 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.495 HG22 ' SG ' ' A' ' 48' ' ' CYS . 14.6 m -63.58 -27.78 43.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.984 -0.553 . . . . 7.9400000000000004 112.223 -172.807 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 48.2 t -170.72 -77.5 0.02 OUTLIER 'General case' 0 N--CA 1.434 -1.267 0 CA-C-N 116.208 -0.451 . . . . 9.2799999999999994 110.047 -178.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.409 ' O ' ' HG2' ' A' ' 52' ' ' MET . 26.9 ttt -171.51 39.85 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.664 0 CA-C-O 121.965 0.888 . . . . 9.4399999999999995 109.817 -175.172 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.611 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 8.7 mm100 -92.52 -173.41 3.36 Favored 'General case' 0 C--O 1.203 -1.394 0 N-CA-C 108.38 -0.971 . . . . 9.1099999999999994 108.38 -177.785 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.54 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 9.6 t -139.21 161.81 36.51 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 118.111 -1.436 . . . . 5.9299999999999997 112.461 -177.589 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -141.1 148.62 40.42 Favored 'General case' 0 N--CA 1.433 -1.322 0 C-N-CA 126.244 1.818 . . . . 5.2699999999999996 106.527 178.446 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.1 tp -70.43 136.37 26.16 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.694 0 CA-C-O 121.061 0.458 . . . . 5.2300000000000004 111.975 -177.663 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 16.6 p -81.68 76.66 8.58 Favored 'General case' 0 N--CA 1.423 -1.78 0 CA-C-O 121.811 0.815 . . . . 4.21 110.534 175.096 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.5 m -63.46 -8.59 9.66 Favored 'General case' 0 CA--C 1.568 1.659 0 CA-C-N 114.817 -1.083 . . . . 6.0099999999999998 110.752 175.787 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.424 HG22 ' H ' ' A' ' 60' ' ' SER . 32.9 m -146.21 172.99 12.63 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 105.555 -2.017 . . . . 6.1900000000000004 105.555 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.424 ' H ' HG22 ' A' ' 59' ' ' THR . 12.5 m -74.54 15.85 0.32 Allowed 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 118.987 0.812 . . . . 6.4699999999999998 112.233 -174.302 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.428 ' CD ' HH21 ' A' ' 65' ' ' ARG . 35.1 tt0 63.1 -61.67 0.13 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 125.195 1.398 . . . . 4.8600000000000003 112.066 -177.246 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.0 p -61.06 -28.28 43.37 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.966 0 C-N-CA 123.679 0.792 . . . . 7.2300000000000004 110.735 -176.161 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.409 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 5.7 tmtt? -66.2 -41.78 89.69 Favored 'General case' 0 C--O 1.249 1.078 0 N-CA-C 107.142 -1.429 . . . . 9.3599999999999994 107.142 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 55.6 m -66.16 -33.52 75.96 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 114.663 -1.153 . . . . 5.9000000000000004 108.073 176.34 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.649 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 94.0 mtt180 -62.01 -37.49 85.07 Favored 'General case' 0 C--O 1.199 -1.559 0 CA-C-N 115.405 -0.816 . . . . 7.6900000000000004 111.769 178.552 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -56.37 -50.26 72.07 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.642 0.734 . . . . 9.7799999999999994 109.227 -179.364 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 76.4 t60 -68.37 -32.13 71.99 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 114.517 -1.219 . . . . 8.9700000000000006 111.229 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.8 -44.66 31.84 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 112.475 0.546 . . . . 6.5300000000000002 112.475 -175.534 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.649 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 11.5 mm-40 -63.51 -32.66 74.18 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.362 0.601 . . . . 8.5 109.467 -178.154 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -88.74 7.97 31.17 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-N 115.312 -0.858 . . . . 9.4100000000000001 111.628 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -144.17 -85.56 0.14 Allowed 'General case' 0 CA--C 1.508 -0.651 0 C-N-CA 122.501 0.321 . . . . 10.32 111.852 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.408 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 29.4 p80 43.05 57.88 11.74 Favored Pre-proline 0 CA--C 1.554 1.128 0 C-N-CA 124.013 0.925 . . . . 7.4699999999999998 112.338 -177.143 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.408 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 53.6 Cg_exo -54.92 -36.53 92.13 Favored 'Trans proline' 0 C--N 1.37 1.68 0 C-N-CA 122.934 2.423 . . . . 6.8099999999999996 113.694 -175.403 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 63.5 pttt -171.86 -40.41 0.02 OUTLIER 'General case' 0 C--N 1.348 0.518 0 N-CA-C 113.3 0.852 . . . . 7.3200000000000003 113.3 -178.43 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.583 ' HB1' ' HA ' ' A' ' 79' ' ' ALA . . . 76.03 108.66 0.08 Allowed 'General case' 0 C--O 1.212 -0.892 0 C-N-CA 124.387 1.075 . . . . 4.5199999999999996 109.326 -172.336 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.415 ' HB2' ' H ' ' A' ' 77' ' ' VAL . 1.7 m-20 -87.47 -105.58 0.07 Allowed 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 113.899 -1.501 . . . . 6.8200000000000003 110.102 -169.327 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.415 ' H ' ' HB2' ' A' ' 76' ' ' ASP . 26.8 m -86.41 -7.65 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.838 0 N-CA-C 107.56 -1.274 . . . . 8.1500000000000004 107.56 170.825 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' VAL . . . . . 0.409 HG22 ' H ' ' A' ' 76' ' ' ASP . 28.6 m -90.75 14.4 1.45 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.505 0 CA-C-N 113.766 -1.561 . . . . 5.6500000000000004 109.266 177.2 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.583 ' HA ' ' HB1' ' A' ' 75' ' ' ALA . . . -71.35 1.05 6.77 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 122.079 0.942 . . . . 4.2400000000000002 110.176 176.87 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' CYS . . . . . 0.413 ' HB2' ' SG ' ' A' ' 48' ' ' CYS . 19.9 p -75.76 -22.14 56.77 Favored 'General case' 0 N--CA 1.423 -1.778 0 CA-C-N 114.217 -1.356 . . . . 5.5999999999999996 109.503 174.188 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.519 ' HD2' ' HG ' ' A' ' 84' ' ' LEU . 27.2 t80 -157.57 91.32 2.31 Favored Pre-proline 0 C--N 1.309 -1.163 0 N-CA-C 106.413 -1.699 . . . . 5.1299999999999999 106.413 170.59 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -62.04 5.13 0.24 Allowed 'Trans proline' 0 N--CA 1.491 1.326 0 C-N-CA 123.762 2.975 . . . . 3.27 115.41 -172.504 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' HIS . . . . . 0.433 ' HB2' ' CE2' ' A' ' 81' ' ' PHE . 76.7 m-70 -100.85 9.99 41.67 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 108.789 -0.819 . . . . 4.25 108.789 177.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.519 ' HG ' ' HD2' ' A' ' 81' ' ' PHE . 60.8 mt . . . . . 0 C--O 1.242 0.68 0 CA-C-N 115.691 -0.686 . . . . 5.4699999999999998 111.254 178.448 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.403 ' HA ' HG21 ' A' ' 54' ' ' THR . 66.5 mtt . . . . . 0 C--O 1.223 -0.297 0 CA-C-O 121.727 0.775 . . . . 7.6200000000000001 110.387 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.434 ' HB3' ' CB ' ' A' ' 57' ' ' CYS . 31.0 m -52.33 -59.16 4.74 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 114.16 -1.382 . . . . 3.9100000000000001 112.757 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.543 HG13 ' HB2' ' A' ' 57' ' ' CYS . 65.6 mt -127.88 128.39 69.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 109.294 -0.632 . . . . 3.7599999999999998 109.294 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.6 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 1.6 tp60 -100.12 124.68 45.8 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 107.116 -1.439 . . . . 6.79 107.116 178.756 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.656 ' SG ' HG22 ' A' ' 50' ' ' VAL . 26.9 t -59.7 122.45 14.17 Favored 'General case' 0 C--N 1.307 -1.239 0 C-N-CA 124.135 0.974 . . . . 5.4299999999999997 111.394 -176.572 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.577 ' HD2' ' O ' ' A' ' 49' ' ' LYS . 1.5 tmmm? -52.02 -31.72 30.94 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 125.363 1.465 . . . . 5.9100000000000001 111.411 -178.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.656 HG22 ' SG ' ' A' ' 48' ' ' CYS . 7.4 m -63.8 -28.15 44.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 112.176 0.435 . . . . 7.9400000000000004 112.176 -174.633 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 54.1 t -161.17 -77.62 0.05 Allowed 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 120.969 -0.292 . . . . 9.2799999999999994 110.863 -178.031 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.464 ' O ' ' HG2' ' A' ' 52' ' ' MET . 50.1 ttm -178.24 36.55 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.039 0 CA-C-O 121.523 0.678 . . . . 9.4399999999999995 109.941 -176.562 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.6 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 10.5 mm100 -91.99 178.73 5.8 Favored 'General case' 0 C--O 1.188 -2.145 0 O-C-N 121.13 -0.981 . . . . 9.1099999999999994 109.569 -177.515 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.517 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 27.6 m -128.01 141.35 51.54 Favored 'General case' 0 N--CA 1.413 -2.276 0 C-N-CA 118.12 -1.432 . . . . 5.9299999999999997 113.385 -173.371 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -126.24 172.55 9.98 Favored 'General case' 0 C--O 1.242 0.677 0 C-N-CA 125.275 1.43 . . . . 5.2699999999999996 107.823 174.149 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.436 HD13 ' N ' ' A' ' 57' ' ' CYS . 0.1 OUTLIER -96.63 132.29 41.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 N-CA-C 109.434 -0.58 . . . . 5.2300000000000004 109.434 -176.585 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.543 ' HB2' HG13 ' A' ' 46' ' ' ILE . 11.4 t -103.87 85.62 2.45 Favored 'General case' 0 N--CA 1.425 -1.704 0 N-CA-C 106.811 -1.551 . . . . 4.21 106.811 176.475 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 11.2 t -56.17 1.69 0.02 OUTLIER 'General case' 0 CA--C 1.579 2.072 0 N-CA-C 115.413 1.634 . . . . 6.0099999999999998 115.413 178.262 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 14.9 t -155.33 -164.91 1.87 Allowed 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 106.919 -1.512 . . . . 6.1900000000000004 106.919 178.025 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 41.6 t -85.05 135.39 34.02 Favored 'General case' 0 C--N 1.281 -2.375 0 N-CA-C 107.686 -1.227 . . . . 6.4699999999999998 107.686 175.798 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.565 ' O ' ' HG3' ' A' ' 65' ' ' ARG . 42.3 tt0 -56.49 -26.89 55.69 Favored 'General case' 0 C--O 1.196 -1.76 0 N-CA-C 110.244 -0.28 . . . . 4.8600000000000003 110.244 177.039 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 86.5 t -67.09 -30.31 49.02 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 O-C-N 122.06 -0.4 . . . . 7.2300000000000004 110.722 179.512 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -71.89 -33.16 68.12 Favored 'General case' 0 C--O 1.257 1.457 0 N-CA-C 107.155 -1.424 . . . . 9.3599999999999994 107.155 178.487 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' CYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 61' ' ' GLU . 82.1 m -69.21 -40.93 77.71 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-N 114.249 -1.342 . . . . 5.9000000000000004 109.732 173.339 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.565 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 96.0 mtt180 -60.38 -50.69 72.59 Favored 'General case' 0 CA--C 1.508 -0.642 0 C-N-CA 123.271 0.628 . . . . 7.6900000000000004 112.09 -177.716 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -62.49 -33.98 75.96 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.208 0.527 . . . . 9.7799999999999994 110.687 -179.42 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 41.4 t60 -75.34 -31.81 60.69 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.093 -0.503 . . . . 8.9700000000000006 110.936 178.763 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -73.66 -44.83 55.75 Favored 'General case' 0 CA--C 1.483 -1.615 0 N-CA-C 109.784 -0.45 . . . . 6.5300000000000002 109.784 179.09 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -71.74 -7.64 49.37 Favored 'General case' 0 C--N 1.315 -0.902 0 O-C-N 123.541 0.525 . . . . 8.5 111.155 178.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.74 -54.32 4.99 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.731 -0.668 . . . . 9.4100000000000001 109.862 172.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.3 mmmm -88.05 -77.54 0.35 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.693 -0.685 . . . . 10.32 111.221 -177.36 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.25 54.7 p-80 40.85 63.62 5.58 Favored Pre-proline 0 N--CA 1.468 0.463 0 N-CA-C 115.087 1.514 . . . . 7.4699999999999998 115.087 -177.183 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -83.12 -61.04 0.02 OUTLIER 'Trans proline' 0 N--CA 1.431 -2.171 0 C-N-CA 120.951 1.101 . . . . 6.8099999999999996 111.466 176.546 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 13.7 pttm -161.32 120.4 2.5 Favored 'General case' 0 N--CA 1.411 -2.421 0 N-CA-C 108.037 -1.097 . . . . 7.3200000000000003 108.037 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.501 ' O ' ' HB2' ' A' ' 79' ' ' ALA . . . -73.6 100.78 3.42 Favored 'General case' 0 C--N 1.286 -2.172 0 N-CA-C 108.752 -0.833 . . . . 4.5199999999999996 108.752 175.058 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -95.19 -91.82 0.21 Allowed 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.448 0.642 . . . . 6.8200000000000003 111.272 -177.192 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.1 m -79.54 -13.81 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.073 0 N-CA-C 108.151 -1.055 . . . . 8.1500000000000004 108.151 176.237 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 13.9 m -92.95 9.32 4.4 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.874 0 CA-C-N 114.635 -1.166 . . . . 5.6500000000000004 108.603 176.424 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.501 ' HB2' ' O ' ' A' ' 75' ' ' ALA . . . -69.33 -11.15 60.57 Favored 'General case' 0 C--O 1.253 1.249 0 CA-C-O 121.104 0.478 . . . . 4.2400000000000002 111.638 178.793 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 66.4 m -79.96 -23.43 41.66 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 115.627 -0.715 . . . . 5.5999999999999996 109.122 174.905 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 3.7 p90 -140.74 67.39 28.95 Favored Pre-proline 0 CA--C 1.556 1.173 0 C-N-CA 124.547 1.139 . . . . 5.1299999999999999 111.334 178.638 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -69.03 7.45 0.79 Allowed 'Trans proline' 0 C--N 1.366 1.478 0 C-N-CA 123.645 2.897 . . . . 3.27 114.013 -174.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 49.5 m170 -90.84 -7.27 52.77 Favored 'General case' 0 C--O 1.202 -1.413 0 N-CA-C 109.171 -0.677 . . . . 4.25 109.171 177.463 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.447 ' HB3' ' HB3' ' A' ' 64' ' ' CYS . 0.2 OUTLIER . . . . . 0 N--CA 1.42 -1.929 0 CA-C-N 114.921 -1.036 . . . . 5.4699999999999998 110.348 178.116 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . 0.262 23.1 ptp . . . . . 0 N--CA 1.516 2.858 0 N-CA-C 115.682 1.734 . . . . 7.6200000000000001 115.682 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.413 ' HB3' ' N ' ' A' ' 57' ' ' CYS . 41.2 m 70.47 -101.07 0.04 OUTLIER 'General case' 0 N--CA 1.413 -2.295 0 N-CA-C 114.91 1.448 . . . . 3.9100000000000001 114.91 176.112 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.469 ' O ' ' HA ' ' A' ' 54' ' ' THR . 66.3 mt -133.52 148.45 30.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 N-CA-C 110.169 -0.308 . . . . 3.7599999999999998 110.169 -172.749 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.592 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 46.3 tt0 -110.6 143.69 40.62 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 123.417 0.687 . . . . 6.79 109.993 177.6 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.546 ' SG ' HG22 ' A' ' 50' ' ' VAL . 49.0 t -82.55 129.92 35.02 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 122.986 0.514 . . . . 5.4299999999999997 111.214 178.356 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.404 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -52.5 -35.19 52.47 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 127.791 2.436 . . . . 5.9100000000000001 110.617 -178.943 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.546 HG22 ' SG ' ' A' ' 48' ' ' CYS . 9.6 m -58.32 -23.46 22.24 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 N-CA-C 112.798 0.666 . . . . 7.9400000000000004 112.798 -174.376 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.8 t -172.11 -86.27 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.846 0 O-C-N 123.473 0.483 . . . . 9.2799999999999994 110.532 179.386 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.461 ' HA ' ' CG ' ' A' ' 47' ' ' GLN . 50.0 ttp -164.68 40.51 0.08 Allowed 'General case' 0 C--O 1.239 0.544 0 CA-C-O 122.67 1.224 . . . . 9.4399999999999995 110.207 -178.062 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.592 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 8.3 mm100 -86.97 -167.77 2.0 Favored 'General case' 0 C--O 1.205 -1.25 0 N-CA-C 108.22 -1.029 . . . . 9.1099999999999994 108.22 -177.546 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 12.9 t -144.42 154.57 43.1 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 117.536 -1.665 . . . . 5.9299999999999997 112.955 -176.271 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -130.46 162.79 28.4 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 106.116 -1.809 . . . . 5.2699999999999996 106.116 176.07 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.569 HD13 ' H ' ' A' ' 57' ' ' CYS . 0.3 OUTLIER -88.96 148.53 4.47 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 108.083 -1.08 . . . . 5.2300000000000004 108.083 -177.264 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 57' ' ' CYS . . . . . 0.569 ' H ' HD13 ' A' ' 56' ' ' ILE . 20.7 p -76.69 77.36 3.34 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 121.45 0.643 . . . . 4.21 111.485 179.088 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 31.7 p -60.28 -26.89 66.84 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.675 -1.148 . . . . 6.0099999999999998 111.18 174.548 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.523 ' HB ' ' SG ' ' A' ' 64' ' ' CYS . 16.3 m -143.38 173.04 11.97 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 107.178 -1.415 . . . . 6.1900000000000004 107.178 -177.327 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' SER . . . . . 0.455 ' H ' HG22 ' A' ' 59' ' ' THR . 5.4 m -76.47 18.52 0.31 Allowed 'General case' 0 CA--C 1.556 1.191 0 N-CA-C 112.875 0.695 . . . . 6.4699999999999998 112.875 -174.25 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 64.04 -62.16 0.17 Allowed 'General case' 0 N--CA 1.503 2.221 0 C-N-CA 125.375 1.47 . . . . 4.8600000000000003 111.24 -176.048 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.671 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 92.9 t -57.01 -36.42 50.75 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.477 0 C-N-CA 123.966 0.906 . . . . 7.2300000000000004 111.575 -178.026 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.475 ' HA ' ' CG ' ' A' ' 66' ' ' GLU . 4.5 mptp? -68.28 -25.93 65.4 Favored 'General case' 0 C--O 1.244 0.815 0 CA-C-O 122.076 0.941 . . . . 9.3599999999999994 112.296 177.665 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' CYS . . . . . 0.523 ' SG ' ' HB ' ' A' ' 59' ' ' THR . 57.3 m -77.41 -38.78 49.01 Favored 'General case' 0 C--N 1.272 -2.765 0 N-CA-C 107.029 -1.471 . . . . 5.9000000000000004 107.029 175.089 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.487 ' HD3' ' HA ' ' A' ' 62' ' ' VAL . 57.5 mtp180 -63.53 -38.39 90.96 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 114.234 -1.348 . . . . 7.6900000000000004 111.763 178.997 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.671 ' HG2' ' O ' ' A' ' 62' ' ' VAL . 5.0 mm-40 -52.6 -55.17 24.26 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 107.471 -1.307 . . . . 9.7799999999999994 107.471 176.423 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' HIS . . . . . 0.416 ' O ' ' HB3' ' A' ' 70' ' ' ALA . 48.8 t60 -76.14 -17.06 59.74 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-N 114.327 -1.306 . . . . 8.9700000000000006 111.396 -176.81 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -77.92 -40.4 39.78 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 122.038 -0.414 . . . . 6.5300000000000002 109.949 179.088 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -68.83 -16.97 63.93 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.76 0.79 . . . . 8.5 109.748 177.149 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 67' ' ' HIS . . . -75.08 -18.24 60.32 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 114.568 -1.196 . . . . 9.4100000000000001 112.058 175.194 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -141.04 -83.67 0.21 Allowed 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 111.987 0.366 . . . . 10.32 111.987 -178.051 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' HIS . . . . . 0.535 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 27.1 p80 44.48 43.43 1.2 Allowed Pre-proline 0 N--CA 1.507 2.383 0 C-N-CA 125.732 1.613 . . . . 7.4699999999999998 114.682 -179.523 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' PRO . . . . . 0.535 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 7.5 Cg_exo -71.88 -52.33 0.2 Allowed 'Trans proline' 0 C--N 1.368 1.57 0 C-N-CA 121.48 1.453 . . . . 6.8099999999999996 111.818 -176.967 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -154.84 122.09 5.61 Favored 'General case' 0 N--CA 1.404 -2.743 0 N-CA-C 107.751 -1.203 . . . . 7.3200000000000003 107.751 -178.716 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.06 120.78 30.77 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 107.88 -1.156 . . . . 4.5199999999999996 107.88 171.376 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -96.95 -90.55 0.25 Allowed 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.31 0.576 . . . . 6.8200000000000003 111.678 -172.542 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.2 m -86.66 -12.01 11.0 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 CA-C-O 122.259 1.028 . . . . 8.1500000000000004 108.595 176.828 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 27.6 m -96.6 12.2 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 CA-C-N 113.954 -1.475 . . . . 5.6500000000000004 108.94 176.827 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.94 -3.42 3.44 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-O 121.46 0.648 . . . . 4.2400000000000002 110.951 177.488 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 17.8 p -71.11 -28.45 64.32 Favored 'General case' 0 N--CA 1.426 -1.643 0 CA-C-N 115.039 -0.982 . . . . 5.5999999999999996 109.717 175.385 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -155.94 92.38 2.63 Favored Pre-proline 0 N--CA 1.44 -0.951 0 N-CA-C 107.195 -1.409 . . . . 5.1299999999999999 107.195 171.724 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -63.49 8.4 0.15 Allowed 'Trans proline' 0 N--CA 1.5 1.904 0 C-N-CA 124.462 3.441 . . . . 3.27 114.603 -173.051 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -101.25 7.45 42.94 Favored 'General case' 0 C--N 1.287 -2.109 0 C-N-CA 120.469 -0.492 . . . . 4.25 110.022 176.444 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 37.6 mt . . . . . 0 CA--C 1.542 0.64 0 CA-C-N 116.422 -0.353 . . . . 5.4699999999999998 111.267 -178.503 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 25.2 mmt . . . . . 0 N--CA 1.472 0.633 0 CA-C-O 121.532 0.682 . . . . 7.6200000000000001 110.704 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.549 ' HB2' ' O ' ' A' ' 55' ' ' PHE . 53.1 m -75.48 -84.35 0.05 Allowed 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 114.677 1.362 . . . . 3.9100000000000001 114.677 -176.858 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.435 ' O ' ' HA ' ' A' ' 54' ' ' THR . 31.9 mt -139.95 159.29 26.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 N-CA-C 107.812 -1.181 . . . . 3.7599999999999998 107.812 -174.258 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.607 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 32.4 tt0 -112.09 149.34 32.25 Favored 'General case' 0 CA--C 1.552 1.029 0 N-CA-C 109.335 -0.617 . . . . 6.79 109.335 -176.9 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.456 ' SG ' HG22 ' A' ' 50' ' ' VAL . 41.6 t -85.99 145.25 27.19 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 112.408 0.521 . . . . 5.4299999999999997 112.408 -177.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.457 ' HD2' ' O ' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -66.39 -23.15 66.28 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.392 1.477 . . . . 5.9100000000000001 110.371 -175.235 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.456 HG22 ' SG ' ' A' ' 48' ' ' CYS . 20.4 m -62.11 -30.06 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 CA-C-N 115.169 -0.923 . . . . 7.9400000000000004 112.431 -175.892 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 41.9 t -176.96 -110.57 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.494 0 N-CA-C 107.3 -1.37 . . . . 9.2799999999999994 107.3 -175.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 4.8 mpp? -136.44 64.28 1.56 Allowed 'General case' 0 N--CA 1.427 -1.614 0 CA-C-O 121.044 0.45 . . . . 9.4399999999999995 111.6 177.095 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.607 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 9.1 mm100 -106.25 -165.05 1.06 Allowed 'General case' 0 C--O 1.19 -2.062 0 N-CA-C 108.672 -0.862 . . . . 9.1099999999999994 108.672 -178.068 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.435 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 15.0 t -144.13 151.8 40.06 Favored 'General case' 0 N--CA 1.437 -1.12 0 C-N-CA 117.991 -1.484 . . . . 5.9299999999999997 112.954 -178.317 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.549 ' O ' ' HB2' ' A' ' 45' ' ' SER . 89.1 m-85 -123.29 174.55 7.24 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 107.105 -1.443 . . . . 5.2699999999999996 107.105 175.582 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 10.2 tp -100.41 142.46 15.53 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.21 0 N-CA-C 110.057 -0.349 . . . . 5.2300000000000004 110.057 -178.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 49.7 t -86.37 78.35 9.29 Favored 'General case' 0 N--CA 1.415 -2.198 0 CA-C-O 121.565 0.697 . . . . 4.21 109.244 178.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 9.4 t -73.31 -12.81 60.97 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 114.993 -1.003 . . . . 6.0099999999999998 111.097 175.181 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 28.6 m -143.79 -89.57 0.12 Allowed 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 109.767 -0.457 . . . . 6.1900000000000004 109.767 178.658 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 65.2 p -173.06 5.03 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 112.851 0.686 . . . . 6.4699999999999998 112.851 176.154 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.495 ' O ' ' HG3' ' A' ' 65' ' ' ARG . 36.9 tt0 67.75 -45.58 0.49 Allowed 'General case' 0 N--CA 1.498 1.937 0 C-N-CA 123.839 0.855 . . . . 4.8600000000000003 111.187 -172.113 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' VAL . . . . . 0.441 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 94.8 t -56.84 -40.18 69.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 O-C-N 121.627 -0.671 . . . . 7.2300000000000004 112.468 -178.79 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.461 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 8.0 tmtt? -61.91 -37.74 85.78 Favored 'General case' 0 CA--C 1.561 1.392 0 CA-C-O 122.293 1.044 . . . . 9.3599999999999994 109.008 179.294 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' CYS . . . . . 0.403 ' SG ' ' HA ' ' A' ' 61' ' ' GLU . 29.7 p -81.49 -19.41 42.33 Favored 'General case' 0 C--O 1.204 -1.293 0 CA-C-N 115.791 -0.641 . . . . 5.9000000000000004 110.152 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ARG . . . . . 0.495 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 97.5 mtt180 -64.68 -39.8 94.3 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 108.736 -0.838 . . . . 7.6900000000000004 108.736 175.198 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 62' ' ' VAL . 24.5 mt-10 -60.13 -47.8 84.4 Favored 'General case' 0 C--O 1.245 0.867 0 CA-C-N 115.232 -0.894 . . . . 9.7799999999999994 108.822 179.599 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' HIS . . . . . 0.484 ' O ' ' HB3' ' A' ' 70' ' ' ALA . 41.8 t60 -74.44 -22.31 59.19 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-N 115.072 -0.967 . . . . 8.9700000000000006 111.29 -178.088 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -74.67 -42.26 58.79 Favored 'General case' 0 CA--C 1.492 -1.265 0 C-N-CA 119.957 -0.697 . . . . 6.5300000000000002 109.231 178.441 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -65.76 -13.89 60.26 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.824 0.821 . . . . 8.5 110.67 176.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' A' ' 67' ' ' HIS . . . -76.23 -19.17 58.6 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.099 -0.955 . . . . 9.4100000000000001 110.911 174.681 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -146.0 -82.89 0.14 Allowed 'General case' 0 C--O 1.211 -0.939 0 CA-C-O 121.042 0.449 . . . . 10.32 111.861 -177.201 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.372 4.6 p80 36.45 67.24 1.72 Allowed Pre-proline 0 N--CA 1.488 1.431 0 C-N-CA 126.58 1.952 . . . . 7.4699999999999998 116.052 -173.053 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_exo -70.02 -61.63 0.06 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 121.39 1.393 . . . . 6.8099999999999996 111.214 174.725 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -158.56 120.05 3.47 Favored 'General case' 0 N--CA 1.418 -2.045 0 CA-C-N 115.558 -0.747 . . . . 7.3200000000000003 108.986 178.828 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.481 ' O ' ' HB2' ' A' ' 79' ' ' ALA . . . -77.18 115.79 17.27 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 107.769 -1.197 . . . . 4.5199999999999996 107.769 173.5 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -95.53 -87.1 0.29 Allowed 'General case' 0 C--O 1.201 -1.475 0 CA-C-O 121.012 0.434 . . . . 6.8200000000000003 111.389 -173.043 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.8 m -84.6 -14.85 11.19 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.663 0 CA-C-O 122.128 0.966 . . . . 8.1500000000000004 108.774 176.714 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 34.1 m -94.97 11.66 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.524 0 CA-C-N 114.681 -1.145 . . . . 5.6500000000000004 109.223 177.131 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.481 ' HB2' ' O ' ' A' ' 75' ' ' ALA . . . -65.39 -6.82 11.22 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-O 121.767 0.794 . . . . 4.2400000000000002 111.646 177.322 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 18.9 p -76.53 -17.67 59.13 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 115.144 -0.934 . . . . 5.5999999999999996 109.701 175.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.542 ' CD1' ' HG ' ' A' ' 84' ' ' LEU . 1.6 t80 -161.93 80.13 1.95 Allowed Pre-proline 0 CA--C 1.555 1.14 0 N-CA-C 106.506 -1.665 . . . . 5.1299999999999999 106.506 178.018 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -62.93 -3.85 5.25 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 124.265 3.31 . . . . 3.27 115.696 -171.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -84.77 -6.15 59.35 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 109.268 -0.641 . . . . 4.25 109.268 -179.496 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.542 ' HG ' ' CD1' ' A' ' 81' ' ' PHE . 42.6 mt . . . . . 0 CA--C 1.536 0.418 0 CA-C-N 116.217 -0.447 . . . . 5.4699999999999998 112.188 -174.89 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 64.2 mtm . . . . . 0 N--CA 1.497 1.883 0 CA-C-O 121.692 0.758 . . . . 7.6200000000000001 111.417 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . 0.353 12.9 p 55.6 -108.2 0.42 Allowed 'General case' 0 N--CA 1.409 -2.49 0 N-CA-C 118.141 2.645 . . . . 3.9100000000000001 118.141 177.482 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.584 ' O ' ' HA ' ' A' ' 54' ' ' THR . 68.7 mt -127.04 132.19 70.12 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.99 0 CA-C-N 116.604 -0.271 . . . . 3.7599999999999998 110.395 -174.578 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.635 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 9.2 tt0 -98.1 135.12 40.22 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.222 0.534 . . . . 6.79 110.397 -178.818 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.587 ' SG ' HG22 ' A' ' 50' ' ' VAL . 12.9 t -70.86 133.04 46.14 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-N 115.053 -0.976 . . . . 5.4299999999999997 111.913 -178.224 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.6 ttpt -57.21 -30.42 64.56 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.78 1.632 . . . . 5.9100000000000001 111.599 -179.413 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.587 HG22 ' SG ' ' A' ' 48' ' ' CYS . 16.3 m -60.24 -27.89 40.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 N-CA-C 112.944 0.72 . . . . 7.9400000000000004 112.944 -175.099 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 54.1 t -174.27 -99.84 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 109.076 -0.713 . . . . 9.2799999999999994 109.076 -178.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -145.45 60.37 1.28 Allowed 'General case' 0 N--CA 1.426 -1.67 0 C-N-CA 122.543 0.337 . . . . 9.4399999999999995 110.841 179.197 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.635 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 10.3 mm100 -107.2 -172.49 2.09 Favored 'General case' 0 CA--C 1.481 -1.677 0 N-CA-C 108.064 -1.087 . . . . 9.1099999999999994 108.064 -178.83 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.584 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 8.9 t -143.12 153.71 43.17 Favored 'General case' 0 N--CA 1.424 -1.773 0 C-N-CA 118.239 -1.384 . . . . 5.9299999999999997 112.476 -177.839 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 99.7 m-85 -130.32 140.43 50.64 Favored 'General case' 0 C--N 1.298 -1.64 0 N-CA-C 105.489 -2.041 . . . . 5.2699999999999996 105.489 176.661 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ILE . . . . . 0.482 HG23 HG23 ' A' ' 58' ' ' THR . 8.9 tp -67.07 147.47 12.58 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 CA-C-O 121.225 0.536 . . . . 5.2300000000000004 111.368 -173.722 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.6 t -78.34 73.13 4.9 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-O 121.52 0.676 . . . . 4.21 111.583 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.482 HG23 HG23 ' A' ' 56' ' ' ILE . 13.4 p -79.91 -22.27 42.95 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-O 121.483 0.658 . . . . 6.0099999999999998 110.0 170.921 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' THR . . . . . 0.419 HG21 ' HB3' ' A' ' 64' ' ' CYS . 27.2 m -116.61 150.79 37.49 Favored 'General case' 0 N--CA 1.427 -1.595 0 N-CA-C 108.286 -1.005 . . . . 6.1900000000000004 108.286 177.106 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 30.8 t -82.55 14.98 2.75 Favored 'General case' 0 CA--C 1.564 1.518 0 C-N-CA 122.7 0.4 . . . . 6.4699999999999998 111.189 -176.132 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.652 ' HA ' ' SG ' ' A' ' 64' ' ' CYS . 5.5 tp10 64.96 -60.69 0.23 Allowed 'General case' 0 C--O 1.181 -2.509 0 C-N-CA 123.899 0.88 . . . . 4.8600000000000003 111.858 -176.265 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 90.3 t -57.85 -29.07 34.61 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.329 0 O-C-N 121.577 -0.702 . . . . 7.2300000000000004 111.956 -176.094 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.433 ' O ' ' HD2' ' A' ' 63' ' ' LYS . 3.2 tmmm? -77.79 -35.64 51.25 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 109.372 -0.603 . . . . 9.3599999999999994 109.372 178.224 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' CYS . . . . . 0.652 ' SG ' ' HA ' ' A' ' 61' ' ' GLU . 23.1 p -76.54 -30.1 56.98 Favored 'General case' 0 C--O 1.197 -1.708 0 C-N-CA 119.514 -0.874 . . . . 5.9000000000000004 109.47 177.111 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 65.0 ttt180 -56.61 -58.36 8.4 Favored 'General case' 0 N--CA 1.437 -1.118 0 C-N-CA 124.872 1.269 . . . . 7.6900000000000004 112.103 177.434 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -62.26 -33.38 74.51 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 122.315 1.055 . . . . 9.7799999999999994 109.728 -179.233 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 21.3 t60 -77.76 -13.38 59.91 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-N 113.933 -1.485 . . . . 8.9700000000000006 110.75 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -98.24 -47.72 5.35 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 109.617 -0.512 . . . . 6.5300000000000002 109.617 178.43 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -54.57 -37.88 66.01 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 123.757 0.661 . . . . 8.5 111.647 -179.409 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -87.77 2.71 50.53 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 116.076 -0.511 . . . . 9.4100000000000001 112.376 -178.12 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -137.67 -81.9 0.34 Allowed 'General case' 0 C--N 1.343 0.287 0 CA-C-O 120.703 0.287 . . . . 10.32 111.431 -178.531 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.272 18.6 p80 41.99 62.88 7.18 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 125.381 1.473 . . . . 7.4699999999999998 114.416 -176.262 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_exo -45.91 -56.52 2.79 Favored 'Trans proline' 0 C--N 1.378 2.089 0 C-N-CA 124.001 3.134 . . . . 6.8099999999999996 114.031 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -177.39 -23.4 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 111.773 0.286 . . . . 7.3200000000000003 111.773 -179.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.583 ' HB1' ' HA ' ' A' ' 79' ' ' ALA . . . 74.69 103.08 0.07 Allowed 'General case' 0 C--N 1.358 0.977 0 C-N-CA 124.222 1.009 . . . . 4.5199999999999996 110.834 -179.334 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -100.18 -85.66 0.4 Allowed 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 114.867 -1.06 . . . . 6.8200000000000003 111.298 -176.538 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.3 m -81.85 -15.65 12.15 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.749 0 CA-C-O 121.889 0.852 . . . . 8.1500000000000004 108.836 176.535 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 31.8 m -97.34 11.11 5.57 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.827 0 CA-C-N 114.707 -1.133 . . . . 5.6500000000000004 109.25 177.348 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ALA . . . . . 0.583 ' HA ' ' HB1' ' A' ' 75' ' ' ALA . . . -63.09 -11.26 18.6 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.514 0.673 . . . . 4.2400000000000002 111.663 176.698 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' CYS . . . . . 0.482 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 76.9 m -82.9 -8.28 59.59 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 115.369 -0.832 . . . . 5.5999999999999996 110.778 177.1 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -165.86 83.57 1.03 Allowed Pre-proline 0 C--N 1.32 -0.717 0 N-CA-C 107.734 -1.21 . . . . 5.1299999999999999 107.734 171.278 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -58.08 1.73 0.22 Allowed 'Trans proline' 0 N--CA 1.498 1.755 0 C-N-CA 123.785 2.99 . . . . 3.27 116.487 -173.181 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 67.1 m-70 -88.73 -7.42 56.32 Favored 'General case' 0 CA--C 1.499 -0.984 0 C-N-CA 120.217 -0.593 . . . . 4.25 112.12 178.302 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 45.6 mt . . . . . 0 C--N 1.303 -1.446 0 C-N-CA 119.749 -0.78 . . . . 5.4699999999999998 109.265 -178.667 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.853 0 N-CA-C 110.226 -1.15 . . . . 19.140000000000001 110.226 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 12.2 p80 -153.23 16.43 0.54 Allowed 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 117.983 0.892 . . . . 19.739999999999998 113.125 -179.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 34.9 t60 -174.7 -41.33 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 109.678 -0.49 . . . . 17.670000000000002 109.678 178.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 60.7 t60 -167.52 169.21 12.27 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 104.737 -2.32 . . . . 14.74 104.737 177.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -62.98 -70.81 0.19 Allowed 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 118.991 0.814 . . . . 14.24 112.581 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 21.8 m170 -117.48 178.26 4.45 Favored 'General case' 0 C--O 1.243 0.713 0 N-CA-C 113.164 0.802 . . . . 13.67 113.164 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 56.0 m80 -137.53 103.24 4.99 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-N 115.16 -0.927 . . . . 10.300000000000001 108.845 179.352 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 53.6 tp 64.24 97.78 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.886 0 O-C-N 124.568 1.168 . . . . 10.1 112.154 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -86.68 -27.38 23.78 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 115.252 -0.885 . . . . 11.869999999999999 109.236 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 126.37 -41.58 1.62 Allowed Glycine 0 C--O 1.217 -0.912 0 C-N-CA 120.936 -0.649 . . . . 9.5999999999999996 111.935 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -173.19 -164.93 29.33 Favored Glycine 0 N--CA 1.439 -1.13 0 C-N-CA 120.911 -0.662 . . . . 8.4499999999999993 111.823 -178.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 146.98 -93.9 0.16 Allowed Glycine 0 N--CA 1.422 -2.273 0 N-CA-C 110.63 -0.988 . . . . 9.2400000000000002 110.63 -178.702 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 7.0 t30 60.87 97.63 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.419 1.088 . . . . 9.6799999999999997 112.228 -177.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -157.87 174.3 15.49 Favored 'General case' 0 C--N 1.311 -1.082 0 N-CA-C 108.309 -0.997 . . . . 11.119999999999999 108.309 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.453 ' HG3' ' HG3' ' A' ' 16' ' ' LYS . 29.1 pt20 -58.8 -34.81 71.91 Favored 'General case' 0 CA--C 1.558 1.253 0 CA-C-O 121.491 0.663 . . . . 15.18 111.444 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.453 ' HG3' ' HG3' ' A' ' 15' ' ' GLN . 66.0 mttm -88.27 21.24 2.9 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.014 -0.539 . . . . 15.42 110.914 -178.215 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 27.8 t -97.43 -18.77 18.87 Favored 'General case' 0 C--N 1.311 -1.103 0 O-C-N 121.814 -0.554 . . . . 11.210000000000001 111.402 -178.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -42.88 -34.91 1.04 Allowed 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 115.788 1.773 . . . . 13.140000000000001 115.788 -173.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 64.4 mtm -124.45 -40.09 2.26 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 121.635 -0.666 . . . . 14.08 112.059 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.65 -46.06 84.1 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.271 -0.422 . . . . 9.7699999999999996 112.013 -177.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.96 24.99 10.51 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 122.914 0.486 . . . . 10.289999999999999 111.107 -176.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.16 -33.14 70.56 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-O 122.024 0.916 . . . . 9.1500000000000004 111.327 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm -91.27 3.08 55.75 Favored 'General case' 0 CA--C 1.481 -1.692 0 CA-C-N 115.71 -0.677 . . . . 11.119999999999999 111.339 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -85.82 -53.69 4.97 Favored 'General case' 0 N--CA 1.416 -2.173 0 C-N-CA 118.424 -1.31 . . . . 6.46 108.28 -178.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 49.1 tp -178.04 114.01 0.08 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.281 -0.872 . . . . 6.8099999999999996 110.616 178.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -112.85 -16.91 12.63 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-N 115.699 -0.682 . . . . 7.7000000000000002 109.453 174.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 52.0 mttp 64.29 -85.19 0.02 OUTLIER 'General case' 0 C--N 1.352 0.716 0 CA-C-N 115.895 -0.593 . . . . 8.8599999999999994 110.773 -170.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 164.12 -56.65 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 125.844 1.658 . . . . 6.4800000000000004 108.012 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 35.3 mtmm -113.95 140.77 48.13 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 114.634 -1.166 . . . . 10.01 109.898 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.46 -19.08 64.54 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 112.832 0.678 . . . . 7.4299999999999997 112.832 -175.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -135.8 -66.49 0.56 Allowed 'General case' 0 C--N 1.299 -1.59 0 CA-C-O 121.345 0.593 . . . . 8.1600000000000001 109.916 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 157.83 -128.86 2.19 Favored Glycine 0 N--CA 1.422 -2.26 0 N-CA-C 110.737 -0.945 . . . . 7.6900000000000004 110.737 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -155.66 -34.64 0.09 Allowed 'General case' 0 C--N 1.297 -1.674 0 N-CA-C 108.595 -0.891 . . . . 8.8599999999999994 108.595 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 163.87 -154.43 25.31 Favored Glycine 0 N--CA 1.418 -2.506 0 N-CA-C 107.984 -2.046 . . . . 8.2799999999999994 107.984 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.497 ' HA ' ' HG3' ' A' ' 38' ' ' GLU . 32.2 t 69.85 88.57 0.11 Allowed 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 123.634 0.773 . . . . 9.5299999999999994 112.14 177.669 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.417 ' C ' ' H ' ' A' ' 38' ' ' GLU . 18.1 tm0? -132.4 124.15 28.11 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 105.701 -1.963 . . . . 11.91 105.701 178.207 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 49.1 tp 69.73 -3.81 1.59 Allowed 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 124.065 0.946 . . . . 10.08 110.913 -176.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.497 ' HG3' ' HA ' ' A' ' 35' ' ' SER . 6.8 mm-40 -73.73 170.44 15.26 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 125.507 1.523 . . . . 7.8600000000000003 111.35 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -89.99 168.88 11.67 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.468 -0.787 . . . . 5.9199999999999999 109.024 178.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -62.86 113.48 3.08 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.985 0.898 . . . . 6.8799999999999999 111.909 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -117.32 17.97 14.54 Favored 'General case' 0 N--CA 1.427 -1.623 0 CA-C-O 121.543 0.687 . . . . 7.9500000000000002 109.996 -177.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.1 8.33 18.45 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 108.844 -0.799 . . . . 8.1699999999999999 108.844 177.036 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -85.62 -5.69 59.24 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.353 -0.84 . . . . 5.9299999999999997 111.78 -175.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 65.7 mtt 67.71 79.1 0.23 Allowed 'General case' 0 N--CA 1.465 0.296 0 O-C-N 124.08 0.862 . . . . 7.6200000000000001 109.062 -174.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.8 p -71.95 -87.33 0.02 OUTLIER 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 115.308 1.595 . . . . 3.9100000000000001 115.308 -176.204 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.572 ' O ' ' HA ' ' A' ' 54' ' ' THR . 80.6 mt -131.62 124.6 54.5 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.739 0 CA-C-N 116.036 -0.529 . . . . 3.7599999999999998 110.641 -175.373 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.694 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 39.7 tt0 -86.49 137.46 32.52 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.149 0.5 . . . . 6.79 110.078 177.504 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.603 ' SG ' HG22 ' A' ' 50' ' ' VAL . 42.4 t -77.76 130.7 37.06 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 115.015 -0.993 . . . . 5.4299999999999997 111.17 178.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.533 ' HD2' ' O ' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -58.51 -27.99 65.0 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-N 113.593 -1.639 . . . . 5.9100000000000001 111.124 -178.092 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.603 HG22 ' SG ' ' A' ' 48' ' ' CYS . 8.1 m -61.19 -31.29 49.75 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 N-CA-C 112.084 0.402 . . . . 7.9400000000000004 112.084 -176.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.8 t -161.37 -82.01 0.04 OUTLIER 'General case' 0 N--CA 1.44 -0.96 0 CA-C-O 120.779 0.323 . . . . 9.2799999999999994 110.863 -179.01 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 37.6 tpp -164.38 22.1 0.06 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 121.568 0.699 . . . . 9.4399999999999995 109.267 -175.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.694 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 8.7 mm100 -84.09 -167.81 1.9 Allowed 'General case' 0 CA--C 1.492 -1.282 0 C-N-CA 120.436 -0.506 . . . . 9.1099999999999994 109.946 -171.744 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.572 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 11.3 t -141.46 161.08 38.78 Favored 'General case' 0 N--CA 1.419 -2.002 0 C-N-CA 118.521 -1.271 . . . . 5.9299999999999997 112.833 -175.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -140.04 153.18 46.72 Favored 'General case' 0 N--CA 1.436 -1.15 0 C-N-CA 126.732 2.013 . . . . 5.2699999999999996 107.55 178.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 6.9 tp -73.39 136.13 26.11 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.473 0 CA-C-O 121.218 0.532 . . . . 5.2300000000000004 112.081 -177.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 53.8 t -78.27 74.13 4.81 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-O 121.48 0.657 . . . . 4.21 110.443 176.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.3 m -87.03 -5.71 58.98 Favored 'General case' 0 N--CA 1.428 -1.547 0 N-CA-C 107.77 -1.196 . . . . 6.0099999999999998 107.77 171.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 92.2 m -148.18 138.7 22.88 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 107.805 -1.183 . . . . 6.1900000000000004 107.805 178.168 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.3 p -71.36 -81.38 0.05 Allowed 'General case' 0 CA--C 1.55 0.954 0 O-C-N 123.523 0.514 . . . . 6.4699999999999998 112.074 -177.019 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.83 ' HA ' ' SG ' ' A' ' 64' ' ' CYS . 42.8 tt0 178.99 -36.13 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.047 0 C-N-CA 124.873 1.269 . . . . 4.8600000000000003 108.237 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.469 ' O ' ' HB3' ' A' ' 65' ' ' ARG . 80.8 t -70.49 -37.57 70.66 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 C-N-CA 120.569 -0.452 . . . . 7.2300000000000004 110.865 175.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.597 ' HD3' ' O ' ' A' ' 63' ' ' LYS . 1.0 OUTLIER -72.81 -26.68 61.59 Favored 'General case' 0 CA--C 1.553 1.079 0 N-CA-C 108.924 -0.769 . . . . 9.3599999999999994 108.924 178.439 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' CYS . . . . . 0.83 ' SG ' ' HA ' ' A' ' 61' ' ' GLU . 28.9 p -82.71 -25.26 33.1 Favored 'General case' 0 C--O 1.205 -1.248 0 C-N-CA 118.634 -1.226 . . . . 5.9000000000000004 110.26 176.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.469 ' HB3' ' O ' ' A' ' 62' ' ' VAL . 68.0 ttt180 -57.62 -47.71 81.45 Favored 'General case' 0 N--CA 1.441 -0.913 0 C-N-CA 123.869 0.867 . . . . 7.6900000000000004 110.665 174.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -65.74 -35.62 81.25 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.496 0.665 . . . . 9.7799999999999994 110.069 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -74.06 -24.14 59.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.733 -0.667 . . . . 8.9700000000000006 111.066 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.616 ' HB1' ' N ' ' A' ' 86' ' ' LYS . . . -74.79 -56.81 4.39 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-N 115.891 -0.595 . . . . 6.5300000000000002 110.617 -177.007 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.443 ' OE1' ' HD2' ' A' ' 86' ' ' LYS . 5.5 mm-40 -58.52 -34.51 71.05 Favored 'General case' 0 C--N 1.317 -0.813 0 O-C-N 123.751 0.657 . . . . 8.5 111.561 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -77.26 -12.45 59.95 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 115.118 -0.946 . . . . 9.4100000000000001 112.568 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm -132.58 -84.57 0.48 Allowed 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 112.866 0.691 . . . . 10.32 112.866 -176.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.635 ' HB3' ' N ' ' A' ' 86' ' ' LYS . 23.9 p-80 42.49 60.26 9.91 Favored Pre-proline 0 N--CA 1.479 1.015 0 N-CA-C 113.97 1.1 . . . . 7.4699999999999998 113.97 -175.629 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.433 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 24.9 Cg_exo -64.7 -60.65 0.13 Allowed 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.143 1.895 . . . . 6.8099999999999996 111.412 -178.575 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 23.5 pttm -165.21 20.41 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.183 -0.462 . . . . 7.3200000000000003 110.701 -179.542 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.512 ' HB1' ' HA ' ' A' ' 79' ' ' ALA . . . 64.07 -82.3 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.594 -0.73 . . . . 4.5199999999999996 109.254 -172.589 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.4 t70 53.78 -88.43 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.538 1.135 . . . . 6.8200000000000003 113.693 175.365 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.7 m -73.35 -24.01 20.14 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.05 0 N-CA-C 109.585 -0.524 . . . . 8.1500000000000004 109.585 177.163 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.521 ' HB ' ' HB2' ' A' ' 84' ' ' LEU . 19.0 m -104.43 13.96 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.376 0 CA-C-N 115.872 -0.603 . . . . 5.6500000000000004 110.439 176.498 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.512 ' HA ' ' HB1' ' A' ' 75' ' ' ALA . . . -70.35 -14.58 62.64 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 121.484 0.659 . . . . 4.2400000000000002 110.153 177.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 82.5 m -76.8 -19.65 57.32 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 114.908 -1.042 . . . . 5.5999999999999996 110.491 177.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.596 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 34.4 t80 -155.58 83.97 3.55 Favored Pre-proline 0 N--CA 1.447 -0.615 0 N-CA-C 107.353 -1.351 . . . . 5.1299999999999999 107.353 176.53 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -63.19 3.44 0.58 Allowed 'Trans proline' 0 C--O 1.197 -1.552 0 C-N-CA 123.676 2.917 . . . . 3.27 115.312 -172.168 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 66.6 m-70 -72.73 -8.44 55.43 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 119.177 0.899 . . . . 4.25 110.842 174.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 81' ' ' PHE . 11.0 mt -94.92 2.4 55.39 Favored 'General case' 0 N--CA 1.416 -2.155 0 N-CA-C 107.15 -1.426 . . . . 5.4699999999999998 107.15 -178.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.671 ' O ' ' HD3' ' A' ' 85' ' ' LYS . 2.3 tmtm? -141.46 105.16 4.71 Favored 'General case' 0 CA--C 1.558 1.259 0 C-N-CA 124.773 1.229 . . . . 8.0399999999999991 112.579 179.235 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.635 ' N ' ' HB3' ' A' ' 72' ' ' HIS . 16.9 tptp . . . . . 0 N--CA 1.498 1.964 0 CA-C-O 118.758 -0.639 . . . . 11.1 112.652 178.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.207 -1.556 0 N-CA-C 112.041 -0.424 . . . . 19.140000000000001 112.041 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -110.74 179.23 4.12 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 117.047 0.424 . . . . 19.739999999999998 109.86 -177.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 50.3 m80 -97.51 -56.35 2.55 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 112.256 0.465 . . . . 17.670000000000002 112.256 -177.135 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 41.1 t60 -132.37 119.0 20.11 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.562 0.696 . . . . 14.74 110.232 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -88.91 102.98 15.59 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.272 -0.876 . . . . 14.24 110.844 -179.023 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.0 p-80 -80.31 158.17 26.18 Favored 'General case' 0 C--O 1.244 0.779 0 N-CA-C 109.667 -0.494 . . . . 13.67 109.667 177.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -145.55 154.0 41.71 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 118.988 -0.53 . . . . 10.300000000000001 109.87 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 tm? 73.85 -68.31 0.23 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 124.31 1.006 . . . . 10.1 109.218 -178.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -85.48 100.17 11.71 Favored 'General case' 0 N--CA 1.433 -1.288 0 CA-C-O 121.853 0.835 . . . . 11.869999999999999 110.054 178.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.01 131.33 7.26 Favored Glycine 0 N--CA 1.42 -2.379 0 CA-C-N 114.275 -1.329 . . . . 9.5999999999999996 111.079 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -138.37 -139.74 3.89 Favored Glycine 0 N--CA 1.429 -1.803 0 C-N-CA 119.981 -1.104 . . . . 8.4499999999999993 111.794 -178.131 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 156.31 -69.47 0.28 Allowed Glycine 0 N--CA 1.438 -1.219 0 N-CA-C 109.968 -1.253 . . . . 9.2400000000000002 109.968 -178.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 72.63 147.25 0.08 Allowed 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 124.199 1.0 . . . . 9.6799999999999997 112.049 179.199 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -169.91 -74.35 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.819 0 CA-C-O 121.015 0.436 . . . . 11.119999999999999 111.583 -178.531 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -114.0 137.34 51.83 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.05 -0.523 . . . . 15.18 110.601 -178.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.572 ' HE3' ' HA ' ' A' ' 16' ' ' LYS . 0.0 OUTLIER 68.04 -10.97 0.38 Allowed 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 123.996 0.918 . . . . 15.42 112.883 176.936 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 21.5 p -77.86 31.82 0.17 Allowed 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 113.56 0.948 . . . . 11.210000000000001 113.56 -176.014 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.04 -43.5 87.34 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 122.94 0.496 . . . . 13.140000000000001 111.073 -179.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 22.7 ptp -93.67 -19.43 21.13 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.092 0.472 . . . . 14.08 110.228 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.15 -33.77 73.94 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.562 -0.745 . . . . 9.7699999999999996 111.134 -177.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.5 ptp180 -59.47 -28.98 67.49 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 111.727 0.269 . . . . 10.289999999999999 111.727 179.38 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -78.52 6.57 8.31 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 121.351 0.596 . . . . 9.1500000000000004 111.015 -178.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -131.08 -0.46 4.13 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 108.627 -0.879 . . . . 11.119999999999999 108.627 175.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -109.55 -72.65 0.71 Allowed 'General case' 0 N--CA 1.435 -1.193 0 C-N-CA 119.635 -0.826 . . . . 6.46 111.571 -176.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 95.7 mt -142.31 127.4 18.5 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 116.202 -0.453 . . . . 6.8099999999999996 110.358 -176.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -138.22 135.84 35.98 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 109.485 -0.561 . . . . 7.7000000000000002 109.485 179.677 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -127.42 105.26 8.39 Favored 'General case' 0 N--CA 1.433 -1.298 0 N-CA-C 108.751 -0.833 . . . . 8.8599999999999994 108.751 178.495 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.447 ' C ' ' HD2' ' A' ' 29' ' ' LYS . . . -127.74 -54.8 1.32 Allowed 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 108.962 -0.755 . . . . 6.4800000000000004 108.962 176.596 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.447 ' HD2' ' C ' ' A' ' 28' ' ' ALA . 13.2 mptt -129.21 168.01 16.8 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.897 -0.592 . . . . 10.01 109.734 173.652 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.81 -27.99 62.3 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.014 0.435 . . . . 7.4299999999999997 111.771 -178.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -155.85 -69.41 0.11 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.19 -0.459 . . . . 8.1600000000000001 110.482 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 84.46 -66.11 3.95 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.941 -0.647 . . . . 7.6900000000000004 111.498 179.332 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -162.47 168.79 21.43 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 108.232 -1.025 . . . . 8.8599999999999994 108.232 179.153 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -132.93 -117.49 1.83 Allowed Glycine 0 N--CA 1.431 -1.651 0 N-CA-C 110.899 -0.88 . . . . 8.2799999999999994 110.899 178.075 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 82.3 p 59.16 -166.56 0.17 Allowed 'General case' 0 CA--C 1.557 1.215 0 C-N-CA 125.144 1.378 . . . . 9.5299999999999994 112.654 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -177.38 -33.47 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.313 0 CA-C-O 121.54 0.686 . . . . 11.91 109.531 -177.279 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.3 pp -79.23 10.23 3.84 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 113.992 1.108 . . . . 10.08 113.992 -179.25 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -77.27 -20.05 55.65 Favored 'General case' 0 C--N 1.31 -1.126 0 C-N-CA 120.71 -0.396 . . . . 7.8600000000000003 111.79 -177.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 70.35 -82.14 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.669 1.188 . . . . 5.9199999999999999 112.464 -178.18 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 38.2 t30 -168.2 134.32 1.94 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.771 0.32 . . . . 6.8799999999999999 110.181 -178.443 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -90.78 -32.65 16.03 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.166 -0.47 . . . . 7.9500000000000002 110.324 -178.257 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp 67.73 102.21 0.05 Allowed 'General case' 0 C--N 1.368 1.376 0 O-C-N 124.325 1.016 . . . . 8.1699999999999999 110.582 -173.001 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . 68.97 9.1 7.23 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.752 0.821 . . . . 5.9299999999999997 111.983 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 28.0 ttt 69.37 7.52 6.27 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 124.041 0.937 . . . . 7.6200000000000001 112.128 177.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.484 ' OG ' HG13 ' A' ' 46' ' ' ILE . 41.2 t 56.16 -96.78 0.07 Allowed 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.971 1.1 . . . . 3.9100000000000001 113.971 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.484 HG13 ' OG ' ' A' ' 45' ' ' SER . 14.4 mt -124.67 160.96 28.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 C-N-CA 123.395 0.678 . . . . 3.7599999999999998 109.989 -176.3 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.659 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 7.5 tt0 -120.11 131.22 54.97 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 123.227 0.611 . . . . 6.79 109.399 177.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.651 ' SG ' HG22 ' A' ' 50' ' ' VAL . 21.3 t -68.83 134.51 49.77 Favored 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 124.238 1.015 . . . . 5.4299999999999997 111.91 -177.52 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.453 ' HD2' ' O ' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -62.68 -29.35 70.58 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.82 1.648 . . . . 5.9100000000000001 109.806 -177.731 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.651 HG22 ' SG ' ' A' ' 48' ' ' CYS . 11.6 m -62.14 -25.5 37.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.164 -0.471 . . . . 7.9400000000000004 112.169 -174.243 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.469 ' SG ' ' HG2' ' A' ' 52' ' ' MET . 47.6 t -169.26 -77.2 0.02 OUTLIER 'General case' 0 N--CA 1.438 -1.032 0 O-C-N 123.406 0.442 . . . . 9.2799999999999994 110.776 179.324 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.469 ' HG2' ' SG ' ' A' ' 51' ' ' CYS . 19.8 ptm -169.41 32.28 0.02 OUTLIER 'General case' 0 C--O 1.21 -1.025 0 CA-C-N 116.273 -0.421 . . . . 9.4399999999999995 111.732 -176.292 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.659 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 8.3 mm100 -90.82 -166.14 1.51 Allowed 'General case' 0 C--O 1.205 -1.276 0 N-CA-C 108.924 -0.769 . . . . 9.1099999999999994 108.924 -173.496 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.8 t -135.99 167.39 21.31 Favored 'General case' 0 C--N 1.289 -2.031 0 C-N-CA 118.442 -1.303 . . . . 5.9299999999999997 112.277 -175.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.448 ' O ' ' HB3' ' A' ' 45' ' ' SER . 89.5 m-85 -135.17 153.61 51.91 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 106.095 -1.817 . . . . 5.2699999999999996 106.095 175.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 7.9 tp -83.81 133.67 28.67 Favored 'Isoleucine or valine' 0 C--O 1.251 1.145 0 O-C-N 123.644 0.59 . . . . 5.2300000000000004 110.929 -177.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 49.0 t -71.6 74.4 0.8 Allowed 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 121.633 0.73 . . . . 4.21 112.217 176.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 18.0 p -82.11 -3.77 55.48 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 109.158 -0.682 . . . . 6.0099999999999998 109.158 169.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 87.3 m -161.66 149.83 15.22 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.009 -1.478 . . . . 6.1900000000000004 107.009 178.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.0 t -79.71 139.92 37.16 Favored 'General case' 0 N--CA 1.419 -1.983 0 N-CA-C 106.981 -1.489 . . . . 6.4699999999999998 106.981 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -53.25 -32.91 50.74 Favored 'General case' 0 C--O 1.206 -1.218 0 O-C-N 123.826 0.704 . . . . 4.8600000000000003 110.534 -178.381 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.459 ' O ' ' HB3' ' A' ' 65' ' ' ARG . 67.7 t -62.09 -31.8 52.5 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.096 0 N-CA-C 112.832 0.678 . . . . 7.2300000000000004 112.832 -177.4 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.587 ' O ' ' HD2' ' A' ' 63' ' ' LYS . 1.0 OUTLIER -79.85 -35.88 37.56 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 118.171 -1.411 . . . . 9.3599999999999994 107.338 179.216 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 69.1 m -67.15 -27.88 67.67 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 109.123 -0.695 . . . . 5.9000000000000004 109.123 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.459 ' HB3' ' O ' ' A' ' 62' ' ' VAL . 72.7 ttt180 -60.61 -54.85 40.38 Favored 'General case' 0 N--CA 1.426 -1.666 0 C-N-CA 124.607 1.163 . . . . 7.6900000000000004 112.17 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -63.68 -33.84 76.52 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-O 121.079 0.466 . . . . 9.7799999999999994 110.39 -178.37 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -70.73 -37.36 73.47 Favored 'General case' 0 N--CA 1.438 -1.031 0 N-CA-C 109.167 -0.679 . . . . 8.9700000000000006 109.167 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.72 -48.39 54.82 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-N 115.954 -0.567 . . . . 6.5300000000000002 111.878 -178.554 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -71.73 -17.98 62.17 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.509 0.559 . . . . 8.5 112.509 -176.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -93.7 -18.17 22.42 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 116.417 -0.356 . . . . 9.4100000000000001 111.28 176.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -118.27 -81.01 0.62 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.784 0.29 . . . . 10.32 111.784 -178.639 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.476 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 30.8 p80 44.47 54.21 11.99 Favored Pre-proline 0 N--CA 1.498 1.934 0 N-CA-C 114.449 1.277 . . . . 7.4699999999999998 114.449 -178.679 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.476 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 5.3 Cg_exo -75.59 -58.87 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.126 0 C-N-CA 121.686 1.591 . . . . 6.8099999999999996 113.17 -178.435 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -159.73 104.91 1.59 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.487 0.661 . . . . 7.3200000000000003 112.066 -175.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.74 113.15 21.7 Favored 'General case' 0 C--N 1.292 -1.896 0 CA-C-N 116.057 -0.52 . . . . 4.5199999999999996 109.788 175.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -115.12 -76.79 0.57 Allowed 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 111.89 0.33 . . . . 6.8200000000000003 111.89 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 28.2 m -73.81 -18.94 17.57 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.743 0 CA-C-O 122.368 1.08 . . . . 8.1500000000000004 108.977 176.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 35.5 m -105.59 15.83 6.71 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.37 0 CA-C-N 114.359 -1.292 . . . . 5.6500000000000004 109.803 175.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.58 -15.89 59.33 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-O 121.905 0.859 . . . . 4.2400000000000002 110.018 175.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.61 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 64.4 m -67.59 -16.78 64.36 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 114.285 -1.325 . . . . 5.5999999999999996 110.49 176.392 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.487 ' CE2' ' HB2' ' A' ' 83' ' ' HIS . 14.2 t80 -167.85 89.32 0.69 Allowed Pre-proline 0 N--CA 1.444 -0.771 0 N-CA-C 108.052 -1.092 . . . . 5.1299999999999999 108.052 171.343 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -63.91 3.91 0.63 Allowed 'Trans proline' 0 N--CA 1.505 2.206 0 C-N-CA 124.087 3.192 . . . . 3.27 114.504 -173.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.487 ' HB2' ' CE2' ' A' ' 81' ' ' PHE . 13.2 m-70 -88.92 -0.67 57.6 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 109.258 -0.645 . . . . 4.25 109.258 177.779 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 49.0 mt -109.5 8.11 25.05 Favored 'General case' 0 C--N 1.344 0.327 0 CA-C-N 116.413 -0.358 . . . . 5.4699999999999998 111.748 -177.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.2 mmmt -67.61 155.93 37.99 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-O 122.259 1.028 . . . . 8.0399999999999991 113.694 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 23.0 tptm . . . . . 0 C--N 1.292 -1.897 0 CA-C-N 112.988 -1.915 . . . . 11.1 109.227 -178.651 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.729 0 N-CA-C 110.945 -0.862 . . . . 19.140000000000001 110.945 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 14.6 t-80 -113.51 -48.72 2.93 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 117.09 0.445 . . . . 19.739999999999998 111.238 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 11.0 t-160 -108.19 127.9 54.23 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 109.343 -0.614 . . . . 17.670000000000002 109.343 -179.079 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -65.82 152.39 44.49 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 120.915 0.388 . . . . 14.74 111.456 -179.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 45.3 m80 -125.29 152.63 44.41 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 109.25 -0.648 . . . . 14.24 109.25 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.5 p80 -74.33 141.65 45.2 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 120.738 -0.385 . . . . 13.67 110.977 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 60.5 m80 -128.61 156.19 43.78 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 116.419 -0.355 . . . . 10.300000000000001 110.24 -177.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 49.6 tp 72.84 153.93 0.14 Allowed 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.583 1.153 . . . . 10.1 112.163 177.744 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 64.98 19.28 11.82 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.081 1.352 . . . . 11.869999999999999 109.24 178.239 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -176.38 171.84 44.82 Favored Glycine 0 N--CA 1.426 -1.981 0 N-CA-C 109.279 -1.529 . . . . 9.5999999999999996 109.279 -178.635 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 156.8 -37.0 0.57 Allowed Glycine 0 C--O 1.216 -0.97 0 N-CA-C 111.27 -0.732 . . . . 8.4499999999999993 111.27 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 113.16 -14.03 23.63 Favored Glycine 0 N--CA 1.443 -0.881 0 C-N-CA 120.404 -0.903 . . . . 9.2400000000000002 112.765 178.187 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 15.2 m120 67.06 -170.65 0.19 Allowed 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.316 0.646 . . . . 9.6799999999999997 110.473 179.239 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.446 ' H ' ' HB2' ' A' ' 17' ' ' SER . . . -167.05 -103.09 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 122.619 0.368 . . . . 11.119999999999999 111.565 178.069 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -107.97 -72.25 0.73 Allowed 'General case' 0 C--O 1.217 -0.611 0 CA-C-O 121.479 0.657 . . . . 15.18 110.612 -177.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -81.46 3.65 23.9 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-O 121.902 0.858 . . . . 15.42 110.508 -177.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.446 ' HB2' ' H ' ' A' ' 14' ' ' ALA . 19.2 m -81.17 16.94 1.38 Allowed 'General case' 0 N--CA 1.428 -1.54 0 CA-C-N 114.888 -1.051 . . . . 11.210000000000001 110.526 -178.21 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.49 -24.32 60.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.342 -0.39 . . . . 13.140000000000001 110.532 178.722 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 23.1 ptp -160.91 -28.82 0.06 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.097 -0.501 . . . . 14.08 111.941 179.088 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.97 -45.77 87.61 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 120.292 -0.563 . . . . 9.7699999999999996 109.483 178.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 69.5 mtp180 -137.38 72.69 1.42 Allowed 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.429 -0.805 . . . . 10.289999999999999 109.175 175.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.96 120.31 22.64 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.4 -0.592 . . . . 9.1500000000000004 109.4 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.307 7.1 ptpp? 45.81 74.58 0.13 Allowed 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.4 1.259 . . . . 11.119999999999999 114.4 -175.737 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -148.09 151.77 36.21 Favored 'General case' 0 N--CA 1.411 -2.391 0 CA-C-N 115.467 -0.788 . . . . 6.46 109.403 -178.532 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 53.3 tp -135.29 -79.6 0.43 Allowed 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 108.858 -0.793 . . . . 6.8099999999999996 108.858 177.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -117.74 173.06 6.96 Favored 'General case' 0 C--O 1.244 0.77 0 N-CA-C 108.368 -0.975 . . . . 7.7000000000000002 108.368 177.01 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -116.93 104.78 11.63 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.178 -0.675 . . . . 8.8599999999999994 109.178 177.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -160.32 176.6 11.51 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.795 -0.446 . . . . 6.4800000000000004 109.795 -177.453 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -72.33 111.46 7.55 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.198 0.523 . . . . 10.01 111.679 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -148.92 166.61 28.07 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-N 115.954 -0.566 . . . . 7.4299999999999997 109.802 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.64 -18.96 26.87 Favored 'General case' 0 C--O 1.245 0.825 0 CA-C-N 115.8 -0.636 . . . . 8.1600000000000001 110.795 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 64.41 -114.97 7.3 Favored Glycine 0 C--N 1.339 0.723 0 CA-C-N 115.408 -0.814 . . . . 7.6900000000000004 111.53 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm 72.9 -53.92 0.7 Allowed 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 125.478 1.511 . . . . 8.8599999999999994 113.584 175.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 104.97 103.08 2.83 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 121.39 -0.434 . . . . 8.2799999999999994 112.641 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.9 t -168.86 135.22 1.78 Allowed 'General case' 0 C--O 1.248 1.026 0 N-CA-C 108.996 -0.742 . . . . 9.5299999999999994 108.996 179.161 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -153.22 142.23 21.28 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.638 -0.505 . . . . 11.91 109.638 178.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.3 mp 70.49 -45.25 0.59 Allowed 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 124.93 1.292 . . . . 10.08 113.552 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -72.26 -67.12 0.57 Allowed 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 123.591 0.756 . . . . 7.8600000000000003 110.984 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 67.44 14.13 9.53 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.242 1.017 . . . . 5.9199999999999999 112.431 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -77.76 123.18 26.37 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.772 -0.195 . . . . 6.8799999999999999 111.347 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -139.98 20.16 2.46 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 122.712 1.244 . . . . 7.9500000000000002 108.698 178.084 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -69.47 153.26 43.79 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 115.091 -0.959 . . . . 8.1699999999999999 110.104 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . 66.76 9.56 6.82 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.01 0.924 . . . . 5.9299999999999997 113.022 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 65.8 mtt 72.32 16.78 5.0 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.303 0.641 . . . . 7.6200000000000001 112.273 178.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.5 p 51.67 -104.76 0.19 Allowed 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 116.347 1.98 . . . . 3.9100000000000001 116.347 177.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.433 ' O ' ' HA ' ' A' ' 54' ' ' THR . 59.0 mt -118.35 143.75 28.36 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 N-CA-C 109.657 -0.498 . . . . 3.7599999999999998 109.657 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.565 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 1.1 tp-100 -112.19 133.82 54.09 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 106.549 -1.648 . . . . 6.79 106.549 178.049 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.593 ' SG ' HG22 ' A' ' 50' ' ' VAL . 35.7 t -66.28 135.72 54.82 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 124.512 1.125 . . . . 5.4299999999999997 113.024 -175.545 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.403 ' HD2' ' O ' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -64.31 -26.59 68.55 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.1 1.36 . . . . 5.9100000000000001 110.168 -178.266 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.593 HG22 ' SG ' ' A' ' 48' ' ' CYS . 5.4 m -66.52 -33.19 61.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 120.843 0.354 . . . . 7.9400000000000004 111.797 -175.202 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 83.9 m -156.67 -83.11 0.06 Allowed 'General case' 0 N--CA 1.433 -1.318 0 CA-C-N 115.801 -0.636 . . . . 9.2799999999999994 110.792 -174.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 52.1 ttp 179.9 47.51 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.768 0 N-CA-C 108.471 -0.937 . . . . 9.4399999999999995 108.471 -178.478 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.565 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 10.3 mm100 -101.56 -178.29 3.68 Favored 'General case' 0 C--O 1.173 -2.927 0 N-CA-C 107.263 -1.384 . . . . 9.1099999999999994 107.263 -178.259 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.433 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 9.5 t -125.7 154.12 42.89 Favored 'General case' 0 C--N 1.286 -2.16 0 C-N-CA 117.53 -1.668 . . . . 5.9299999999999997 113.574 -175.19 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.453 ' HE2' ' SG ' ' A' ' 48' ' ' CYS . 86.7 m-85 -137.59 147.9 45.43 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 113.867 -1.515 . . . . 5.2699999999999996 107.634 177.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.495 HG13 ' H ' ' A' ' 58' ' ' THR . 9.2 tp -73.7 132.18 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 N-CA-C 109.402 -0.592 . . . . 5.2300000000000004 109.402 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 24.9 p -74.43 -18.98 60.57 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.03 0.381 . . . . 4.21 112.03 -176.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.495 ' H ' HG13 ' A' ' 56' ' ' ILE 0.25 13.6 t 54.34 -4.89 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 127.26 2.224 . . . . 6.0099999999999998 115.152 177.739 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 87.0 m -155.93 -83.9 0.06 Allowed 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 109.319 -0.623 . . . . 6.1900000000000004 109.319 178.09 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 18.0 p -161.2 10.36 0.09 Allowed 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 112.242 0.46 . . . . 6.4699999999999998 112.242 -178.202 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.568 ' O ' ' HG3' ' A' ' 65' ' ' ARG . 26.7 tt0 68.51 -52.04 0.56 Allowed 'General case' 0 C--O 1.183 -2.416 0 C-N-CA 124.523 1.129 . . . . 4.8600000000000003 110.806 -177.816 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.526 HG12 ' CZ ' ' A' ' 65' ' ' ARG . 35.7 m -55.37 -39.18 51.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 O-C-N 121.354 -0.841 . . . . 7.2300000000000004 112.77 -178.322 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -60.46 -42.28 95.87 Favored 'General case' 0 C--N 1.306 -1.3 0 CA-C-N 115.357 -0.838 . . . . 9.3599999999999994 109.496 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 28.5 p -78.19 -31.81 49.71 Favored 'General case' 0 N--CA 1.428 -1.544 0 C-N-CA 119.85 -0.74 . . . . 5.9000000000000004 109.621 178.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.568 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 22.3 mtm180 -59.68 -50.26 74.56 Favored 'General case' 0 CA--C 1.5 -0.966 0 N-CA-C 111.921 0.341 . . . . 7.6900000000000004 111.921 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -66.73 -33.79 76.41 Favored 'General case' 0 C--O 1.236 0.366 0 O-C-N 123.741 0.65 . . . . 9.7799999999999994 111.931 -178.067 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.449 ' CD2' ' HA ' ' A' ' 86' ' ' LYS . 4.9 t60 -74.39 -30.25 61.87 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 119.696 -0.802 . . . . 8.9700000000000006 109.463 177.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.53 ' CB ' ' HA ' ' A' ' 83' ' ' HIS . . . -71.14 -46.86 60.7 Favored 'General case' 0 C--O 1.204 -1.333 0 CA-C-N 116.559 -0.291 . . . . 6.5300000000000002 111.543 179.664 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 10.7 pt-20 -71.65 -11.6 60.92 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.417 0.627 . . . . 8.5 111.432 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.05 -32.06 59.13 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.009 -0.996 . . . . 9.4100000000000001 109.798 173.42 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -120.65 -86.48 0.65 Allowed 'General case' 0 C--O 1.216 -0.698 0 CA-C-N 115.763 -0.653 . . . . 10.32 111.191 -177.184 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.471 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 20.4 t-80 45.49 55.58 14.74 Favored Pre-proline 0 CA--C 1.561 1.403 0 C-N-CA 123.85 0.86 . . . . 7.4699999999999998 112.014 -178.859 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.471 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 34.6 Cg_exo -65.23 -44.93 8.33 Favored 'Trans proline' 0 C--N 1.37 1.661 0 C-N-CA 121.881 1.721 . . . . 6.8099999999999996 110.341 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.472 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 24.5 pttm -170.03 106.14 0.33 Allowed 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 114.141 -1.391 . . . . 7.3200000000000003 108.85 177.695 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 79' ' ' ALA . . . -67.16 112.77 4.64 Favored 'General case' 0 C--N 1.302 -1.476 0 C-N-CA 119.427 -0.909 . . . . 4.5199999999999996 109.153 171.875 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.401 ' HB2' ' H ' ' A' ' 77' ' ' VAL . 8.9 m-20 -86.94 -90.75 0.11 Allowed 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 122.003 0.906 . . . . 6.8200000000000003 110.709 -174.145 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.401 ' H ' ' HB2' ' A' ' 76' ' ' ASP . 28.2 m -89.49 -14.96 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.219 0 N-CA-C 108.546 -0.909 . . . . 8.1500000000000004 108.546 177.057 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 24.4 m -87.03 7.44 2.54 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.833 0 CA-C-N 115.019 -0.991 . . . . 5.6500000000000004 109.047 177.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.432 ' HB2' ' O ' ' A' ' 75' ' ' ALA . . . -65.33 -2.77 3.38 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-N 115.185 -0.916 . . . . 4.2400000000000002 112.003 178.068 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 25.3 p -73.51 -23.22 60.0 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 115.366 -0.833 . . . . 5.5999999999999996 109.213 174.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.522 ' CE2' ' HB2' ' A' ' 83' ' ' HIS . 31.8 t80 -160.36 88.67 1.81 Allowed Pre-proline 0 N--CA 1.428 -1.528 0 N-CA-C 106.456 -1.683 . . . . 5.1299999999999999 106.456 170.564 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -60.01 6.73 0.1 OUTLIER 'Trans proline' 0 N--CA 1.509 2.395 0 C-N-CA 124.435 3.423 . . . . 3.27 115.527 -173.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.53 ' HA ' ' CB ' ' A' ' 68' ' ' ALA . 83.2 m-70 -98.87 5.58 47.28 Favored 'General case' 0 C--N 1.286 -2.163 0 N-CA-C 110.075 -0.343 . . . . 4.25 110.075 177.841 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.487 ' HG ' ' HD2' ' A' ' 81' ' ' PHE . 74.9 mt -107.98 4.9 25.7 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 111.982 0.364 . . . . 5.4699999999999998 111.982 -179.256 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.472 ' HE3' ' O ' ' A' ' 74' ' ' LYS . 6.8 mmtt -49.07 -62.15 1.69 Allowed 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 114.456 1.28 . . . . 8.0399999999999991 114.456 178.448 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.449 ' HA ' ' CD2' ' A' ' 67' ' ' HIS . 61.2 tttm . . . . . 0 CA--C 1.554 1.12 0 N-CA-C 113.197 0.814 . . . . 11.1 113.197 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.933 0 N-CA-C 111.359 -0.696 . . . . 19.140000000000001 111.359 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 61.84 16.18 7.74 Favored 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 123.648 0.779 . . . . 19.739999999999998 112.722 176.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 43.4 m170 -82.17 85.35 6.81 Favored 'General case' 0 C--O 1.242 0.7 0 O-C-N 121.838 -0.539 . . . . 17.670000000000002 110.786 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 42.8 m80 68.58 -177.1 0.21 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.711 0.804 . . . . 14.74 110.279 -177.489 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 58.2 m80 -117.81 117.91 30.6 Favored 'General case' 0 C--N 1.309 -1.183 0 O-C-N 121.929 -0.482 . . . . 14.24 109.769 179.04 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -137.86 -38.78 0.57 Allowed 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 120.903 0.382 . . . . 13.67 110.994 179.258 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 34.7 m-70 -142.4 148.54 38.02 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 108.203 -1.036 . . . . 10.300000000000001 108.203 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 66.4 tp 68.4 106.8 0.05 Allowed 'General case' 0 N--CA 1.479 1.013 0 O-C-N 124.865 1.353 . . . . 10.1 113.571 175.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -121.5 -71.34 0.74 Allowed 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.378 -0.971 . . . . 11.869999999999999 108.378 173.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 179.99 76.07 0.06 OUTLIER Glycine 0 N--CA 1.437 -1.298 0 CA-C-N 115.579 -0.737 . . . . 9.5999999999999996 111.384 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -79.57 -56.83 3.26 Favored Glycine 0 C--O 1.217 -0.929 0 C-N-CA 120.644 -0.788 . . . . 8.4499999999999993 111.803 178.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 85.17 -38.06 2.99 Favored Glycine 0 C--O 1.22 -0.726 0 C-N-CA 121.108 -0.567 . . . . 9.2400000000000002 112.861 177.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 75.65 94.99 0.07 Allowed 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.177 1.391 . . . . 9.6799999999999997 110.738 -177.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.625 ' H ' ' HB1' ' A' ' 20' ' ' ALA . . . -109.62 -167.12 1.16 Allowed 'General case' 0 C--O 1.25 1.118 0 CA-C-N 115.194 -0.912 . . . . 11.119999999999999 111.146 -178.483 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -48.28 150.03 1.37 Allowed 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.931 1.292 . . . . 15.18 112.948 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? 74.74 -43.57 0.52 Allowed 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.486 1.115 . . . . 15.42 111.411 -175.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 66.0 m 63.05 7.3 2.64 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.792 0.837 . . . . 11.210000000000001 112.535 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -87.35 -71.4 0.56 Allowed 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 108.716 -0.846 . . . . 13.140000000000001 108.716 176.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 51.0 ttm -78.5 -17.48 56.19 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.43 -0.805 . . . . 14.08 109.586 178.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.625 ' HB1' ' H ' ' A' ' 14' ' ' ALA . . . -77.59 5.02 9.94 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.948 0.721 . . . . 9.7699999999999996 112.948 -175.647 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 68.4 mtt180 -107.03 -45.34 4.17 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-O 119.497 -0.287 . . . . 10.289999999999999 110.416 176.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 55.38 28.31 11.31 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 113.477 0.917 . . . . 9.1500000000000004 113.477 174.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt 68.52 14.73 9.12 Favored 'General case' 0 C--N 1.353 0.723 0 C-N-CA 124.708 1.203 . . . . 11.119999999999999 110.429 -179.437 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -77.78 -21.38 51.75 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.377 0.608 . . . . 6.46 109.717 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 95.3 mt -135.92 179.69 6.19 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-N 115.527 -0.761 . . . . 6.8099999999999996 110.731 -176.246 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -84.24 -170.04 2.9 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.235 -0.893 . . . . 7.7000000000000002 110.094 -179.155 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -91.62 144.07 25.92 Favored 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 107.921 -1.14 . . . . 8.8599999999999994 107.921 176.112 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -94.66 -3.87 48.65 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.771 -0.372 . . . . 6.4800000000000004 111.747 -179.449 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -172.59 150.15 2.18 Favored 'General case' 0 N--CA 1.437 -1.097 0 N-CA-C 106.9 -1.518 . . . . 10.01 106.9 -178.627 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -150.77 -40.34 0.13 Allowed 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.737 -0.385 . . . . 7.4299999999999997 111.778 179.395 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -93.29 158.47 15.73 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 120.776 0.322 . . . . 8.1600000000000001 111.15 -178.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -137.06 -167.77 11.19 Favored Glycine 0 N--CA 1.438 -1.168 0 N-CA-C 110.602 -0.999 . . . . 7.6900000000000004 110.602 179.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -61.42 109.83 1.27 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.317 0.579 . . . . 8.8599999999999994 110.525 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 116.84 -97.93 0.77 Allowed Glycine 0 N--CA 1.426 -2.023 0 N-CA-C 109.909 -1.276 . . . . 8.2799999999999994 109.909 -178.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 38.1 m 58.96 -170.94 0.12 Allowed 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.383 0.673 . . . . 9.5299999999999994 111.798 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 26.7 pt20 -161.72 133.58 5.59 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.466 -0.568 . . . . 11.91 109.466 176.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.1 mt 66.85 14.11 9.68 Favored 'General case' 0 N--CA 1.485 1.301 0 O-C-N 123.98 0.8 . . . . 10.08 112.239 178.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -145.04 149.02 34.36 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 108.361 -0.977 . . . . 7.8600000000000003 108.361 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 52.76 72.97 0.38 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.724 1.21 . . . . 5.9199999999999999 113.406 -179.424 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -87.79 98.99 11.77 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.811 -0.632 . . . . 6.8799999999999999 111.481 -179.063 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.656 ' HD3' ' H ' ' A' ' 41' ' ' LYS . 0.2 OUTLIER -56.95 -38.32 72.77 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.137 0.975 . . . . 7.9500000000000002 111.12 178.944 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 38.1 mtmm 61.93 -82.67 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.053 0 N-CA-C 113.741 1.015 . . . . 8.1699999999999999 113.741 176.209 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -85.06 27.65 0.76 Allowed 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 112.634 0.605 . . . . 5.9299999999999997 112.634 -174.334 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 68.6 mtm 70.28 1.66 3.67 Favored 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 124.305 1.042 . . . . 7.6200000000000001 113.21 179.01 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 67.1 m 52.0 -92.18 0.03 OUTLIER 'General case' 0 CA--C 1.561 1.387 0 N-CA-C 115.594 1.701 . . . . 3.9100000000000001 115.594 176.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.537 ' O ' ' HA ' ' A' ' 54' ' ' THR . 66.2 mt -131.86 133.88 60.63 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.209 0 N-CA-C 108.894 -0.78 . . . . 3.7599999999999998 108.894 -177.305 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.685 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 27.4 tt0 -100.81 138.83 37.34 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 120.918 0.39 . . . . 6.79 110.217 -179.027 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.635 ' SG ' HG12 ' A' ' 50' ' ' VAL . 44.8 t -77.86 143.96 37.37 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.709 -0.678 . . . . 5.4299999999999997 111.152 178.237 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.405 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -57.06 -39.07 74.19 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 126.06 1.744 . . . . 5.9100000000000001 112.579 -174.37 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.635 HG12 ' SG ' ' A' ' 48' ' ' CYS . 2.1 p -49.0 -51.37 12.78 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 114.74 1.385 . . . . 7.9400000000000004 114.74 -176.272 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.605 ' SG ' HG22 ' A' ' 50' ' ' VAL . 93.4 m -153.96 -67.73 0.14 Allowed 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 121.093 -0.243 . . . . 9.2799999999999994 111.302 -173.104 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.406 ' HA ' ' CG ' ' A' ' 47' ' ' GLN . 39.1 ttp -174.86 35.4 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 120.109 -0.636 . . . . 9.4399999999999995 109.653 -175.809 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.685 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 6.8 mm100 -87.47 179.25 6.6 Favored 'General case' 0 CA--C 1.494 -1.199 0 C-N-CA 119.265 -0.974 . . . . 9.1099999999999994 108.665 -174.371 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.537 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 7.5 t -137.99 154.31 49.35 Favored 'General case' 0 C--N 1.299 -1.597 0 C-N-CA 118.541 -1.264 . . . . 5.9299999999999997 113.946 -175.476 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -132.94 151.55 52.04 Favored 'General case' 0 N--CA 1.409 -2.497 0 N-CA-C 105.877 -1.897 . . . . 5.2699999999999996 105.877 175.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 10.8 tp -75.57 146.32 9.42 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.563 0 N-CA-C 109.459 -0.571 . . . . 5.2300000000000004 109.459 -177.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 45.1 t -76.95 72.68 3.53 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 121.883 0.849 . . . . 4.21 110.941 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 8.9 t -84.94 -3.2 58.64 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.103 -0.953 . . . . 6.0099999999999998 110.097 174.571 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 95.0 m -160.29 140.28 11.36 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 106.721 -1.585 . . . . 6.1900000000000004 106.721 177.09 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 35.7 p -75.65 139.32 41.93 Favored 'General case' 0 N--CA 1.42 -1.946 0 N-CA-C 109.396 -0.594 . . . . 6.4699999999999998 109.396 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.722 ' HA ' ' SG ' ' A' ' 64' ' ' CYS . 14.4 pt-20 -52.53 -35.02 52.56 Favored 'General case' 0 C--O 1.206 -1.184 0 C-N-CA 123.543 0.737 . . . . 4.8600000000000003 111.824 178.752 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.428 ' O ' ' HB3' ' A' ' 65' ' ' ARG . 99.4 t -67.16 -38.97 82.12 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.844 0 C-N-CA 123.155 0.582 . . . . 7.2300000000000004 112.494 178.001 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -73.01 -35.93 66.9 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 121.476 0.655 . . . . 9.3599999999999994 109.683 -178.111 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' CYS . . . . . 0.722 ' SG ' ' HA ' ' A' ' 61' ' ' GLU . 1.8 p -74.52 -27.34 60.5 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 115.656 -0.702 . . . . 5.9000000000000004 111.044 174.757 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.452 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 54.8 ttt180 -59.68 -52.65 64.58 Favored 'General case' 0 N--CA 1.439 -1.018 0 C-N-CA 123.627 0.771 . . . . 7.6900000000000004 112.251 178.523 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -68.98 -30.24 68.61 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.37 -0.532 . . . . 9.7799999999999994 110.99 -179.011 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 61.3 t60 -66.96 -37.96 85.22 Favored 'General case' 0 C--O 1.241 0.644 0 CA-C-N 116.158 -0.474 . . . . 8.9700000000000006 109.805 176.058 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.25 -42.16 72.55 Favored 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 115.966 -0.561 . . . . 6.5300000000000002 110.379 178.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 6.0 mm-40 -63.63 -17.95 63.43 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.157 0.503 . . . . 8.5 111.698 -179.655 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -84.46 -11.3 56.43 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.994 -0.548 . . . . 9.4100000000000001 111.06 176.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -142.52 -84.83 0.17 Allowed 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.611 0.597 . . . . 10.32 112.611 -177.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.469 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 34.9 p80 41.76 47.81 2.65 Favored Pre-proline 0 N--CA 1.502 2.158 0 C-N-CA 125.357 1.463 . . . . 7.4699999999999998 114.036 -176.072 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.469 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 1.3 Cg_endo -73.75 -41.75 1.01 Allowed 'Trans proline' 0 N--CA 1.444 -1.414 0 C-N-CA 121.015 1.143 . . . . 6.8099999999999996 112.374 -175.442 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.462 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 0.1 OUTLIER -160.53 116.16 2.29 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.48 -0.933 . . . . 7.3200000000000003 108.48 -179.324 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.506 ' O ' HG22 ' A' ' 78' ' ' VAL . . . -73.05 -51.58 17.58 Favored 'General case' 0 C--N 1.286 -2.187 0 C-N-CA 118.738 -1.185 . . . . 4.5199999999999996 108.654 173.602 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.45 ' OD1' HG13 ' A' ' 77' ' ' VAL . 11.3 t70 61.0 -86.5 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 124.111 0.965 . . . . 6.8200000000000003 113.037 170.459 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.45 HG13 ' OD1' ' A' ' 76' ' ' ASP . 35.6 m -92.63 -19.32 6.88 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.742 0 CA-C-O 121.166 0.508 . . . . 8.1500000000000004 109.884 178.247 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.506 HG22 ' O ' ' A' ' 75' ' ' ALA . 21.1 m -102.34 18.39 3.84 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.504 0 N-CA-C 107.973 -1.121 . . . . 5.6500000000000004 107.973 174.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.423 ' HA ' ' HB1' ' A' ' 75' ' ' ALA . . . -64.48 -11.97 39.15 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-O 121.803 0.811 . . . . 4.2400000000000002 111.496 178.591 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.548 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 89.2 m -75.4 -15.56 60.44 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-N 115.135 -0.939 . . . . 5.5999999999999996 110.025 174.139 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.586 ' CD1' HD12 ' A' ' 84' ' ' LEU . 11.9 p90 -154.45 69.86 6.03 Favored Pre-proline 0 CA--C 1.563 1.47 0 C-N-CA 124.64 1.176 . . . . 5.1299999999999999 111.401 178.501 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -64.22 -17.46 59.8 Favored 'Trans proline' 0 N--CA 1.5 1.854 0 C-N-CA 123.814 3.009 . . . . 3.27 115.375 -172.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -81.48 4.47 21.04 Favored 'General case' 0 C--N 1.31 -1.143 0 C-N-CA 120.549 -0.46 . . . . 4.25 111.601 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.586 HD12 ' CD1' ' A' ' 81' ' ' PHE . 17.0 mt -115.64 4.19 14.07 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 120.391 -0.524 . . . . 5.4699999999999998 110.687 -177.472 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.506 ' HD2' ' H ' ' A' ' 86' ' ' LYS . 27.9 tptp -65.08 152.83 42.51 Favored 'General case' 0 C--O 1.244 0.787 0 CA-C-O 122.496 1.141 . . . . 8.0399999999999991 112.172 -178.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.506 ' H ' ' HD2' ' A' ' 85' ' ' LYS . 22.0 pttp . . . . . 0 C--N 1.283 -2.321 0 N-CA-C 106.204 -1.776 . . . . 11.1 106.204 178.379 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.934 0 N-CA-C 111.534 -0.626 . . . . 19.140000000000001 111.534 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 19.2 p-80 -158.5 137.29 11.21 Favored 'General case' 0 C--O 1.214 -0.765 0 N-CA-C 107.424 -1.325 . . . . 19.739999999999998 107.424 176.028 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -128.68 18.87 6.21 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 119.243 -0.983 . . . . 17.670000000000002 112.998 -176.096 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -135.58 -73.02 0.46 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 119.847 -0.741 . . . . 14.74 112.474 177.029 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -139.42 -169.94 2.79 Favored 'General case' 0 C--O 1.242 0.697 0 C-N-CA 120.2 -0.6 . . . . 14.24 111.662 -176.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 57.5 m80 -70.73 165.02 23.89 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 124.011 0.819 . . . . 13.67 111.015 179.232 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.0 p-80 -105.26 163.53 12.53 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 108.74 -0.837 . . . . 10.300000000000001 108.74 177.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 58.5 tp 56.81 68.57 0.84 Allowed 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.998 0.904 . . . . 10.1 109.317 -176.455 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -122.93 -68.26 0.9 Allowed 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 114.678 -1.147 . . . . 11.869999999999999 108.606 -175.026 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -118.58 -76.48 0.53 Allowed Glycine 0 N--CA 1.438 -1.215 0 N-CA-C 110.844 -0.902 . . . . 9.5999999999999996 110.844 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.4 ' HA2' ' HB2' ' A' ' 25' ' ' LEU . . . 108.53 164.37 20.86 Favored Glycine 0 CA--C 1.484 -1.876 0 C-N-CA 120.216 -0.992 . . . . 8.4499999999999993 111.99 179.154 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -139.45 -78.46 0.06 OUTLIER Glycine 0 N--CA 1.425 -2.094 0 C-N-CA 120.341 -0.933 . . . . 9.2400000000000002 111.35 179.119 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 29.2 p30 -154.94 154.62 32.89 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 112.048 0.388 . . . . 9.6799999999999997 112.048 -175.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -175.2 129.94 0.29 Allowed 'General case' 0 C--O 1.245 0.854 0 C-N-CA 124.701 1.201 . . . . 11.119999999999999 108.275 178.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.497 ' C ' ' H ' ' A' ' 17' ' ' SER 0.363 22.2 mp0 41.33 83.34 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 115.686 1.735 . . . . 15.18 115.686 177.608 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.3 mtmp? 71.81 -24.02 0.18 Allowed 'General case' 0 C--O 1.214 -0.783 0 CA-C-N 114.153 -1.385 . . . . 15.42 112.392 -177.115 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.497 ' H ' ' C ' ' A' ' 15' ' ' GLN . 43.2 p 59.88 1.02 0.29 Allowed 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 126.46 1.904 . . . . 11.210000000000001 114.242 178.037 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.29 -36.44 84.11 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.802 -0.635 . . . . 13.140000000000001 109.927 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 28.0 ttt -155.77 -30.62 0.1 Allowed 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.718 -0.674 . . . . 14.08 111.923 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.29 -19.77 37.35 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 113.037 0.755 . . . . 9.7699999999999996 113.037 -176.19 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -66.05 -48.4 71.18 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 120.418 -0.513 . . . . 10.289999999999999 111.478 -179.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 46.62 32.2 1.61 Allowed 'General case' 0 N--CA 1.507 2.378 0 N-CA-C 112.906 0.706 . . . . 9.1500000000000004 112.906 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt 69.4 88.74 0.11 Allowed 'General case' 0 CA--C 1.501 -0.925 0 C-N-CA 124.529 1.132 . . . . 11.119999999999999 112.09 -173.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -148.17 147.94 30.01 Favored 'General case' 0 C--N 1.295 -1.802 0 C-N-CA 120.04 -0.664 . . . . 6.46 109.535 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.4 ' HB2' ' HA2' ' A' ' 11' ' ' GLY . 2.1 tm? -157.65 114.87 2.99 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 105.948 -1.871 . . . . 6.8099999999999996 105.948 178.732 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -108.0 -79.86 0.57 Allowed 'General case' 0 C--N 1.308 -1.2 0 O-C-N 123.644 0.59 . . . . 7.7000000000000002 110.359 179.083 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -110.4 -9.32 14.62 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.745 -0.382 . . . . 8.8599999999999994 112.026 -179.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 61.55 -169.87 0.17 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.732 0.813 . . . . 6.4800000000000004 111.479 -178.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -94.88 -25.68 16.48 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.954 0.407 . . . . 10.01 110.582 179.306 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -127.33 113.26 16.03 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.582 -0.281 . . . . 7.4299999999999997 110.912 -178.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -96.95 -49.32 5.07 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.179 0.514 . . . . 8.1600000000000001 110.855 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 162.22 -133.5 3.14 Favored Glycine 0 N--CA 1.435 -1.417 0 N-CA-C 111.141 -0.784 . . . . 7.6900000000000004 111.141 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 11.4 mptt -93.25 -1.77 55.79 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 121.104 0.478 . . . . 8.8599999999999994 110.203 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 172.82 179.29 43.46 Favored Glycine 0 N--CA 1.425 -2.036 0 N-CA-C 110.212 -1.155 . . . . 8.2799999999999994 110.212 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.9 m -68.75 -67.19 0.49 Allowed 'General case' 0 C--O 1.248 0.974 0 O-C-N 123.733 0.313 . . . . 9.5299999999999994 110.925 179.491 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 54.9 tp60 177.35 -72.31 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 108.737 -0.838 . . . . 11.91 108.737 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.3 mt -107.35 106.4 16.8 Favored 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 108.022 -1.103 . . . . 10.08 108.022 176.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -146.17 -64.58 0.31 Allowed 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 109.307 -0.627 . . . . 7.8600000000000003 109.307 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -132.87 179.71 6.0 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.898 -0.779 . . . . 5.9199999999999999 108.898 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -69.16 138.26 54.0 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 109.806 -0.442 . . . . 6.8799999999999999 109.806 179.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 50.3 mttp 76.68 -154.99 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.409 1.483 . . . . 7.9500000000000002 108.078 -177.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp 78.9 -44.14 0.35 Allowed 'General case' 0 N--CA 1.484 1.266 0 N-CA-C 113.58 0.956 . . . . 8.1699999999999999 113.58 176.363 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.58 -72.13 0.11 Allowed 'General case' 0 N--CA 1.469 0.482 0 O-C-N 123.424 0.452 . . . . 5.9299999999999997 111.531 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.522 ' O ' HG23 ' A' ' 54' ' ' THR . 0.0 OUTLIER 178.99 -32.78 0.01 OUTLIER 'General case' 0 C--O 1.207 -1.159 0 C-N-CA 123.444 0.698 . . . . 7.6200000000000001 111.742 177.208 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.446 ' HB3' ' N ' ' A' ' 57' ' ' CYS . 54.7 m 60.84 -80.11 0.02 OUTLIER 'General case' 0 CA--C 1.563 1.479 0 N-CA-C 114.618 1.34 . . . . 3.9100000000000001 114.618 178.642 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.442 ' HB ' ' HB2' ' A' ' 55' ' ' PHE . 57.2 mt -139.86 144.81 27.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 N-CA-C 109.053 -0.721 . . . . 3.7599999999999998 109.053 -178.056 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.621 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 4.1 tp60 -109.36 136.78 48.23 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-O 121.015 0.436 . . . . 6.79 110.592 -178.09 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.563 ' SG ' HG22 ' A' ' 50' ' ' VAL . 38.1 t -74.28 145.05 44.31 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 124.803 1.241 . . . . 5.4299999999999997 113.483 -175.504 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.6 ttpt -63.86 -34.97 79.13 Favored 'General case' 0 C--O 1.216 -0.689 0 C-N-CA 125.796 1.639 . . . . 5.9100000000000001 111.332 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.563 HG22 ' SG ' ' A' ' 48' ' ' CYS . 8.5 m -61.04 -25.05 34.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 N-CA-C 113.286 0.847 . . . . 7.9400000000000004 113.286 -171.3 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.5 t -170.07 -76.25 0.02 OUTLIER 'General case' 0 N--CA 1.436 -1.149 0 N-CA-C 108.825 -0.805 . . . . 9.2799999999999994 108.825 -178.289 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 27.5 ttt -179.89 60.86 0.01 OUTLIER 'General case' 0 C--O 1.208 -1.11 0 N-CA-C 107.303 -1.369 . . . . 9.4399999999999995 107.303 179.141 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.621 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 11.3 mm100 -106.43 -174.24 2.49 Favored 'General case' 0 C--O 1.195 -1.809 0 N-CA-C 109.475 -0.565 . . . . 9.1099999999999994 109.475 -176.009 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.522 HG23 ' O ' ' A' ' 44' ' ' MET . 97.4 m -120.57 142.89 48.95 Favored 'General case' 0 C--N 1.273 -2.718 0 N-CA-C 114.255 1.206 . . . . 5.9299999999999997 114.255 -170.351 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.442 ' HB2' ' HB ' ' A' ' 46' ' ' ILE . 79.9 m-85 -130.41 172.75 11.53 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 125.698 1.599 . . . . 5.2699999999999996 108.435 175.212 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.1 tp -100.21 137.36 27.97 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 CA-C-O 121.035 0.445 . . . . 5.2300000000000004 112.114 -175.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.446 ' N ' ' HB3' ' A' ' 45' ' ' SER . 25.8 p -89.01 77.48 7.65 Favored 'General case' 0 N--CA 1.418 -2.031 0 CA-C-O 121.571 0.7 . . . . 4.21 110.258 176.828 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 8.2 m -67.47 -9.44 42.06 Favored 'General case' 0 CA--C 1.576 1.968 0 CA-C-O 122.29 1.043 . . . . 6.0099999999999998 110.189 174.425 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.443 HG22 ' H ' ' A' ' 60' ' ' SER . 33.2 m -149.75 173.76 13.35 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 104.681 -2.34 . . . . 6.1900000000000004 104.681 178.082 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.443 ' H ' HG22 ' A' ' 59' ' ' THR . 15.5 m -75.75 20.42 0.18 Allowed 'General case' 0 CA--C 1.552 1.051 0 CA-C-N 119.533 1.06 . . . . 6.4699999999999998 112.517 -174.042 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 65.23 -52.22 0.35 Allowed 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 126.929 2.092 . . . . 4.8600000000000003 111.542 -178.223 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.639 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 28.3 m -55.47 -41.93 65.44 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.411 0 N-CA-C 113.388 0.884 . . . . 7.2300000000000004 113.388 -177.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.481 ' HA ' ' OE1' ' A' ' 66' ' ' GLU . 0.6 OUTLIER -59.9 -35.26 74.49 Favored 'General case' 0 CA--C 1.55 0.953 0 CA-C-O 122.037 0.922 . . . . 9.3599999999999994 109.466 178.34 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 55.7 m -73.7 -36.26 65.23 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 108.45 -0.944 . . . . 5.9000000000000004 108.45 179.123 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -59.3 -42.76 92.08 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 115.615 -0.72 . . . . 7.6900000000000004 110.93 178.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.639 ' HG3' ' O ' ' A' ' 62' ' ' VAL . 25.3 mt-10 -59.14 -45.46 90.89 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 124.35 1.031 . . . . 9.7799999999999994 109.894 -177.29 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.45 ' CD2' ' HA ' ' A' ' 86' ' ' LYS . 7.4 t60 -75.65 -24.59 56.4 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.281 -0.872 . . . . 8.9700000000000006 109.721 -178.161 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.97 -43.86 33.39 Favored 'General case' 0 C--O 1.206 -1.189 0 CA-C-N 116.179 -0.464 . . . . 6.5300000000000002 111.485 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.93 -18.83 64.15 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.098 0.475 . . . . 8.5 110.186 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.09 -29.5 67.6 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.16 -0.927 . . . . 9.4100000000000001 110.733 175.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -128.16 -76.13 0.56 Allowed 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 112.327 0.491 . . . . 10.32 112.327 -175.027 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.416 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 13.4 p80 39.13 60.62 5.63 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 125.148 1.379 . . . . 7.4699999999999998 113.695 -175.388 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.416 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 51.1 Cg_exo -59.58 -51.43 6.19 Favored 'Trans proline' 0 C--N 1.358 1.057 0 C-N-CA 122.36 2.04 . . . . 6.8099999999999996 112.483 -178.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.28 -32.03 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 113.619 0.97 . . . . 7.3200000000000003 113.619 177.577 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' A' ' 79' ' ' ALA . . . 71.45 116.53 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.74 0.816 . . . . 4.5199999999999996 109.956 -176.274 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -104.21 -80.87 0.53 Allowed 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.062 0.458 . . . . 6.8200000000000003 111.129 -174.231 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.8 m -81.53 -18.06 11.64 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 121.657 0.741 . . . . 8.1500000000000004 109.174 176.118 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 35.3 m -97.0 12.03 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.305 0 CA-C-N 115.003 -0.999 . . . . 5.6500000000000004 109.514 176.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.409 ' HB2' ' O ' ' A' ' 75' ' ' ALA . . . -59.99 -12.89 9.02 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-O 121.41 0.624 . . . . 4.2400000000000002 111.996 178.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.442 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 71.2 m -84.16 -8.64 59.02 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 115.42 -0.809 . . . . 5.5999999999999996 111.384 178.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.469 ' HD2' ' HG ' ' A' ' 84' ' ' LEU . 19.9 t80 -168.12 84.1 0.75 Allowed Pre-proline 0 N--CA 1.434 -1.269 0 N-CA-C 108.158 -1.053 . . . . 5.1299999999999999 108.158 168.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -62.14 5.97 0.2 Allowed 'Trans proline' 0 N--CA 1.508 2.371 0 C-N-CA 124.57 3.513 . . . . 3.27 115.199 -174.125 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.434 ' HB2' ' CE2' ' A' ' 81' ' ' PHE . 90.3 m-70 -92.81 3.34 55.84 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 109.803 -0.443 . . . . 4.25 109.803 177.529 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.469 ' HG ' ' HD2' ' A' ' 81' ' ' PHE . 45.7 mt -111.54 10.33 21.25 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.96 -0.564 . . . . 5.4699999999999998 110.641 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.499 ' HD3' ' N ' ' A' ' 86' ' ' LYS . 5.0 tmtm? -51.47 -60.7 2.85 Favored 'General case' 0 C--N 1.357 0.911 0 N-CA-C 113.376 0.88 . . . . 8.0399999999999991 113.376 -179.728 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.499 ' N ' ' HD3' ' A' ' 85' ' ' LYS . 58.0 tttm . . . . . 0 C--N 1.355 0.819 0 CA-C-O 118.428 -0.796 . . . . 11.1 110.516 174.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.215 -1.042 0 CA-C-O 119.59 -0.561 . . . . 19.140000000000001 113.26 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 46.8 m-70 78.78 123.26 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 124.154 0.982 . . . . 19.739999999999998 109.5 -172.477 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 44.6 t-80 -126.51 98.36 5.38 Favored 'General case' 0 C--N 1.292 -1.903 0 CA-C-N 116.488 -0.324 . . . . 17.670000000000002 110.821 -174.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 42.4 t-80 -163.59 102.75 0.93 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 120.989 0.423 . . . . 14.74 111.192 178.231 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.0 m80 -88.33 172.41 9.43 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.468 -0.333 . . . . 14.24 110.602 175.147 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 69.21 116.25 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.198 0.999 . . . . 13.67 112.598 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 19.8 p-80 -176.39 21.86 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 107.67 -1.234 . . . . 10.300000000000001 107.67 174.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.5 pp -165.45 172.76 11.79 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-N 115.066 -0.97 . . . . 10.1 108.966 -173.208 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 66.19 99.07 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 O-C-N 125.168 1.542 . . . . 11.869999999999999 111.027 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 157.71 -117.67 0.79 Allowed Glycine 0 N--CA 1.434 -1.45 0 C-N-CA 119.982 -1.104 . . . . 9.5999999999999996 112.686 -178.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -54.1 -31.94 49.37 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 115.191 0.837 . . . . 8.4499999999999993 115.191 -176.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.84 -57.13 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 119.605 -1.283 . . . . 9.2400000000000002 113.524 -177.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 60.3 t30 71.38 163.81 0.27 Allowed 'General case' 0 N--CA 1.499 2.004 0 C-N-CA 124.375 1.07 . . . . 9.6799999999999997 109.694 -175.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -150.16 113.01 4.79 Favored 'General case' 0 C--N 1.321 -0.673 0 O-C-N 121.865 -0.522 . . . . 11.119999999999999 110.428 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -79.84 7.23 9.13 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 112.867 0.692 . . . . 15.18 112.867 -177.508 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -86.13 -5.19 59.25 Favored 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 120.647 -0.421 . . . . 15.42 110.028 172.253 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.6 m 71.17 -35.25 0.32 Allowed 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 125.216 1.406 . . . . 11.210000000000001 112.416 179.057 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.98 -31.32 72.41 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 123.614 0.766 . . . . 13.140000000000001 112.454 -177.019 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 26.1 mmt -107.66 17.68 22.32 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.723 -0.217 . . . . 14.08 111.399 -178.398 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.44 18.21 0.75 Allowed 'General case' 0 N--CA 1.486 1.37 0 CA-C-O 121.852 0.834 . . . . 9.7699999999999996 111.567 -178.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.0 ptm180 -137.28 6.2 2.79 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 115.343 -0.844 . . . . 10.289999999999999 109.391 176.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -92.7 -45.4 8.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.898 0.856 . . . . 9.1500000000000004 108.901 179.052 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -124.23 125.38 44.32 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 114.942 -1.026 . . . . 11.119999999999999 109.546 176.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 22.9 p-10 -146.38 -29.51 0.39 Allowed 'General case' 0 C--N 1.3 -1.559 0 CA-C-N 116.047 -0.524 . . . . 6.46 110.981 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.417 HD23 ' H ' ' A' ' 25' ' ' LEU . 1.8 pt? -61.77 154.55 25.35 Favored 'General case' 0 C--N 1.316 -0.882 0 C-N-CA 123.71 0.804 . . . . 6.8099999999999996 111.46 179.389 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -79.24 -72.4 0.39 Allowed 'General case' 0 C--O 1.219 -0.534 0 CA-C-O 121.944 0.878 . . . . 7.7000000000000002 111.538 178.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.7 pttm -165.23 -177.09 4.36 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.207 -1.36 . . . . 8.8599999999999994 109.127 -170.133 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -138.84 178.46 7.14 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 120.729 0.3 . . . . 6.4800000000000004 111.079 -177.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -84.3 106.07 15.63 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.7 -0.481 . . . . 10.01 109.7 179.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -146.45 -177.72 5.78 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 109.711 -0.477 . . . . 7.4299999999999997 109.711 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -104.26 -74.83 0.63 Allowed 'General case' 0 N--CA 1.444 -0.767 0 CA-C-O 120.755 0.312 . . . . 8.1600000000000001 110.843 178.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 120.96 -132.5 9.2 Favored Glycine 0 N--CA 1.438 -1.224 0 N-CA-C 110.382 -1.087 . . . . 7.6900000000000004 110.382 -179.527 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.8 ptpp? -154.06 118.83 4.95 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 116.939 0.37 . . . . 8.8599999999999994 110.123 177.277 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.7 150.32 25.06 Favored Glycine 0 N--CA 1.44 -1.08 0 N-CA-C 110.89 -0.884 . . . . 8.2799999999999994 110.89 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 42.1 t -117.01 8.64 13.44 Favored 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 120.338 -0.545 . . . . 9.5299999999999994 110.196 -178.133 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -138.56 141.59 39.25 Favored 'General case' 0 C--O 1.245 0.829 0 C-N-CA 120.825 -0.35 . . . . 11.91 110.421 -178.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 95.5 mt 63.57 12.18 6.27 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.243 1.017 . . . . 10.08 113.28 176.813 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -85.62 138.98 31.78 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 109.61 -0.515 . . . . 7.8600000000000003 109.61 178.618 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.91 -55.2 0.02 OUTLIER 'General case' 0 N--CA 1.439 -0.999 0 CA-C-N 115.185 -0.916 . . . . 5.9199999999999999 110.047 -178.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -167.17 142.28 4.02 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.16 -0.473 . . . . 6.8799999999999999 111.223 -176.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.414 ' HE3' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -87.56 -53.38 4.83 Favored 'General case' 0 N--CA 1.483 1.22 0 CA-C-O 120.818 0.342 . . . . 7.9500000000000002 110.267 178.38 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt 73.29 125.89 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 126.058 1.743 . . . . 8.1699999999999999 112.266 -176.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . 61.73 12.06 4.4 Favored 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 124.264 1.026 . . . . 5.9299999999999997 113.423 176.249 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 68.1 mtm 72.38 10.47 5.81 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 124.153 0.981 . . . . 7.6200000000000001 112.002 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.7 p 48.25 -101.1 0.07 Allowed 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 115.666 1.728 . . . . 3.9100000000000001 115.666 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.529 ' O ' ' HA ' ' A' ' 54' ' ' THR . 62.0 mt -122.83 136.64 58.98 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.059 0 N-CA-C 109.006 -0.738 . . . . 3.7599999999999998 109.006 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.632 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 7.3 tt0 -102.89 141.84 35.02 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.779 0.324 . . . . 6.79 110.618 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.552 ' SG ' HG12 ' A' ' 50' ' ' VAL . 48.7 t -80.0 144.68 33.04 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.985 -0.552 . . . . 5.4299999999999997 110.911 177.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.412 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 1.8 tmmm? -59.92 -44.67 94.18 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 125.061 1.344 . . . . 5.9100000000000001 112.299 -174.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.552 HG12 ' SG ' ' A' ' 48' ' ' CYS . 7.5 p -46.95 -37.86 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 N-CA-C 114.885 1.439 . . . . 7.9400000000000004 114.885 -171.811 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 50.1 t -159.96 -67.26 0.07 Allowed 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.388 -0.525 . . . . 9.2799999999999994 110.072 -179.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 27.5 ttt 178.21 60.24 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.417 0 O-C-N 123.758 0.662 . . . . 9.4399999999999995 109.904 -179.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.632 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 9.2 mm100 -103.55 -170.78 1.83 Allowed 'General case' 0 C--O 1.203 -1.384 0 N-CA-C 107.478 -1.304 . . . . 9.1099999999999994 107.478 -177.496 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.529 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 9.0 t -141.94 157.97 44.33 Favored 'General case' 0 N--CA 1.42 -1.952 0 C-N-CA 118.333 -1.347 . . . . 5.9299999999999997 113.013 -178.205 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -140.39 139.98 35.41 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 106.026 -1.842 . . . . 5.2699999999999996 106.026 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 7.1 tp -63.49 140.62 19.35 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 O-C-N 123.413 0.445 . . . . 5.2300000000000004 111.623 -178.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 12.6 p -75.08 72.13 2.18 Favored 'General case' 0 N--CA 1.426 -1.638 0 CA-C-O 121.747 0.784 . . . . 4.21 112.71 178.16 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 24.5 p -82.46 -4.47 57.51 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.312 -0.858 . . . . 6.0099999999999998 109.872 171.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.553 HG21 ' SG ' ' A' ' 64' ' ' CYS . 25.1 m -143.31 161.0 39.48 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 106.586 -1.635 . . . . 6.1900000000000004 106.586 176.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.5 m -87.27 17.22 4.51 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 112.219 0.452 . . . . 6.4699999999999998 112.219 -174.051 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.527 ' CD ' ' HE ' ' A' ' 65' ' ' ARG . 5.4 tp10 67.58 -64.85 0.26 Allowed 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 112.225 0.454 . . . . 4.8600000000000003 112.225 179.229 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.403 ' HA ' ' HB2' ' A' ' 65' ' ' ARG . 5.4 p -63.9 -25.86 39.19 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 C-N-CA 123.014 0.526 . . . . 7.2300000000000004 111.016 -175.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -62.28 -41.59 98.62 Favored 'General case' 0 C--O 1.25 1.104 0 N-CA-C 108.106 -1.072 . . . . 9.3599999999999994 108.106 177.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' CYS . . . . . 0.553 ' SG ' HG21 ' A' ' 59' ' ' THR . 63.9 m -77.48 -29.42 52.65 Favored 'General case' 0 N--CA 1.424 -1.741 0 CA-C-N 115.058 -0.974 . . . . 5.9000000000000004 108.904 176.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.527 ' HE ' ' CD ' ' A' ' 61' ' ' GLU . 97.1 mtt180 -57.78 -47.18 83.29 Favored 'General case' 0 CA--C 1.5 -0.957 0 N-CA-C 113.114 0.783 . . . . 7.6900000000000004 113.114 179.047 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -65.35 -40.69 93.94 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 119.95 -0.7 . . . . 9.7799999999999994 110.49 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.42 ' O ' ' HB3' ' A' ' 70' ' ' ALA . 13.8 t-80 -75.91 -26.95 57.44 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 115.937 -0.574 . . . . 8.9700000000000006 110.725 -175.775 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.599 ' O ' ' HB2' ' A' ' 72' ' ' HIS . . . -77.62 -49.85 13.74 Favored 'General case' 0 C--O 1.186 -2.255 0 N-CA-C 109.935 -0.395 . . . . 6.5300000000000002 109.935 178.804 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -67.81 -8.45 36.08 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.39 0.614 . . . . 8.5 111.049 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.42 ' HB3' ' O ' ' A' ' 67' ' ' HIS . . . -73.12 -31.37 64.26 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 115.047 -0.979 . . . . 9.4100000000000001 109.446 173.621 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -131.39 -79.07 0.52 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.793 -0.64 . . . . 10.32 110.113 -176.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.599 ' HB2' ' O ' ' A' ' 68' ' ' ALA . 5.8 t-160 47.07 48.43 5.71 Favored Pre-proline 0 CA--C 1.566 1.587 0 C-N-CA 124.809 1.244 . . . . 7.4699999999999998 111.643 176.801 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.441 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 45.7 Cg_exo -56.61 -51.09 9.89 Favored 'Trans proline' 0 C--N 1.387 2.556 0 C-N-CA 121.903 1.735 . . . . 6.8099999999999996 111.789 -174.579 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -163.69 106.86 0.98 Allowed 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.68 -0.691 . . . . 7.3200000000000003 109.727 178.309 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.27 111.35 2.57 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 120.039 -0.665 . . . . 4.5199999999999996 109.338 173.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -107.01 -87.62 0.47 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 114.871 -1.058 . . . . 6.8200000000000003 110.858 -170.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 30.3 m -82.16 -1.69 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-O 122.468 1.127 . . . . 8.1500000000000004 108.973 174.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.509 HG21 ' HA ' ' A' ' 85' ' ' LYS . 32.7 m -110.01 10.05 8.83 Favored 'Isoleucine or valine' 0 C--O 1.183 -2.403 0 CA-C-N 113.286 -1.779 . . . . 5.6500000000000004 108.517 176.697 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.57 -21.38 62.54 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-O 121.598 0.714 . . . . 4.2400000000000002 112.156 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.466 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 72.3 m -76.37 -15.92 59.85 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.557 -0.747 . . . . 5.5999999999999996 110.876 176.74 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.65 ' CD1' HD12 ' A' ' 84' ' ' LEU . 4.4 p90 -153.61 71.49 6.7 Favored Pre-proline 0 CA--C 1.555 1.164 0 C-N-CA 124.728 1.211 . . . . 5.1299999999999999 111.119 -179.366 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -64.63 -1.56 4.17 Favored 'Trans proline' 0 C--N 1.364 1.371 0 C-N-CA 123.944 3.096 . . . . 3.27 116.239 -172.047 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -91.86 -0.49 57.51 Favored 'General case' 0 C--N 1.297 -1.688 0 C-N-CA 119.502 -0.879 . . . . 4.25 109.891 177.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.65 HD12 ' CD1' ' A' ' 81' ' ' PHE . 20.0 mt -116.28 17.24 15.69 Favored 'General case' 0 N--CA 1.425 -1.676 0 C-N-CA 121.011 -0.276 . . . . 5.4699999999999998 111.347 -175.6 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.509 ' HA ' HG21 ' A' ' 78' ' ' VAL . 27.0 tptp -53.27 -50.55 64.62 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 112.908 0.707 . . . . 8.0399999999999991 112.908 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt . . . . . 0 N--CA 1.417 -2.114 0 N-CA-C 106.904 -1.517 . . . . 11.1 106.904 178.611 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.223 -0.566 0 N-CA-C 112.909 -0.077 . . . . 19.140000000000001 112.909 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 59.8 m-70 -118.31 -17.53 9.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.08 0.467 . . . . 19.739999999999998 111.27 176.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -132.14 127.05 35.11 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.099 -1.075 . . . . 17.670000000000002 108.099 178.262 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 21.0 m-70 -99.22 -54.59 2.93 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-O 120.659 0.266 . . . . 14.74 111.344 -178.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 27.0 p80 -162.2 176.21 10.87 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 109.299 -0.63 . . . . 14.24 109.299 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 -125.13 -156.22 0.72 Allowed 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 107.324 -1.361 . . . . 13.67 107.324 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -139.96 169.24 18.08 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 106.776 -1.565 . . . . 10.300000000000001 106.776 175.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.4 HD13 ' H ' ' A' ' 25' ' ' LEU . 60.1 tp 74.51 88.0 0.09 Allowed 'General case' 0 N--CA 1.455 -0.191 0 O-C-N 124.723 1.264 . . . . 10.1 110.075 -172.71 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -84.03 2.63 38.16 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.214 -0.903 . . . . 11.869999999999999 108.839 179.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 135.82 -35.63 2.12 Favored Glycine 0 N--CA 1.443 -0.884 0 N-CA-C 109.507 -1.437 . . . . 9.5999999999999996 109.507 -176.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.412 ' HA2' ' OD1' ' A' ' 24' ' ' ASN . . . 118.23 170.22 14.88 Favored Glycine 0 N--CA 1.437 -1.288 0 C-N-CA 120.67 -0.776 . . . . 8.4499999999999993 112.55 177.344 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 111.83 -90.13 0.55 Allowed Glycine 0 N--CA 1.435 -1.387 0 C-N-CA 120.707 -0.759 . . . . 9.2400000000000002 113.048 176.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -154.02 154.72 34.21 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 119.806 -0.14 . . . . 9.6799999999999997 110.646 -173.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -164.57 160.62 20.42 Favored 'General case' 0 C--O 1.255 1.357 0 O-C-N 124.013 0.82 . . . . 11.119999999999999 109.531 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -94.26 119.59 33.27 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 112.88 0.696 . . . . 15.18 112.88 -176.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt 167.58 -57.24 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 126.624 1.97 . . . . 15.42 107.802 173.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.563 ' H ' ' HB2' ' A' ' 22' ' ' ALA . 19.4 m -97.44 13.27 30.4 Favored 'General case' 0 CA--C 1.494 -1.183 0 CA-C-N 115.349 -0.841 . . . . 11.210000000000001 110.082 178.22 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 54.09 45.38 27.63 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 123.738 0.649 . . . . 13.140000000000001 110.72 -178.617 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 56.1 ttp 71.99 1.76 4.04 Favored 'General case' 0 CA--C 1.55 0.955 0 CA-C-N 114.507 -1.224 . . . . 14.08 112.079 -179.357 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.81 -36.61 78.43 Favored 'General case' 0 C--N 1.356 0.871 0 C-N-CA 119.215 -0.994 . . . . 9.7699999999999996 111.236 -178.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 -170.38 27.38 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 116.089 -0.505 . . . . 10.289999999999999 111.333 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.563 ' HB2' ' H ' ' A' ' 17' ' ' SER . . . -77.09 96.47 4.46 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 112.35 0.5 . . . . 9.1500000000000004 112.35 -174.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 93.8 mttt 68.38 -4.37 1.12 Allowed 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 114.907 1.447 . . . . 11.119999999999999 114.907 176.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.412 ' OD1' ' HA2' ' A' ' 11' ' ' GLY . 57.8 t30 -78.86 120.44 23.48 Favored 'General case' 0 C--N 1.282 -2.333 0 C-N-CA 119.132 -1.027 . . . . 6.46 111.832 -172.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.4 ' H ' HD13 ' A' ' 8' ' ' LEU . 85.2 mt 63.4 -168.04 0.21 Allowed 'General case' 0 C--O 1.253 1.254 0 CA-C-N 114.504 -1.225 . . . . 6.8099999999999996 112.928 176.387 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.417 ' HG3' ' HD3' ' A' ' 27' ' ' LYS . 9.8 pt-20 -132.01 -50.24 0.95 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.737 -0.665 . . . . 7.7000000000000002 110.762 177.243 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.417 ' HD3' ' HG3' ' A' ' 26' ' ' GLU . 13.4 mptt -98.76 145.59 26.78 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 120.605 0.241 . . . . 8.8599999999999994 110.593 176.373 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -107.34 2.98 24.87 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.336 0.588 . . . . 6.4800000000000004 110.533 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.405 ' HZ2' ' CD ' ' A' ' 38' ' ' GLU . 12.3 ptmm? -82.61 161.36 22.25 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 115.5 -0.773 . . . . 10.01 110.498 178.542 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -78.39 112.25 15.22 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 116.02 -0.536 . . . . 7.4299999999999997 110.684 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -100.15 141.07 33.48 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 108.63 -0.878 . . . . 8.1600000000000001 108.63 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -83.6 49.56 4.25 Favored Glycine 0 C--N 1.315 -0.592 0 C-N-CA 120.748 -0.739 . . . . 7.6900000000000004 111.854 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 49.7 mmtm 72.0 -15.11 0.48 Allowed 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 124.542 1.137 . . . . 8.8599999999999994 113.042 -179.393 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 162.67 95.81 0.11 Allowed Glycine 0 N--CA 1.441 -1.033 0 N-CA-C 110.606 -0.998 . . . . 8.2799999999999994 110.606 179.099 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.0 m -88.03 -40.07 14.14 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 112.89 0.7 . . . . 9.5299999999999994 112.89 -176.244 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -159.38 -85.8 0.04 OUTLIER 'General case' 0 C--O 1.208 -1.132 0 N-CA-C 109.685 -0.487 . . . . 11.91 109.685 178.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 43.9 tp -102.56 -12.49 17.73 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 107.486 -1.302 . . . . 10.08 107.486 174.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.405 ' CD ' ' HZ2' ' A' ' 29' ' ' LYS . 40.9 tt0 -84.33 102.93 13.08 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 114.177 -1.374 . . . . 7.8600000000000003 109.156 178.5 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -164.07 149.74 10.83 Favored 'General case' 0 N--CA 1.438 -1.06 0 C-N-CA 123.791 0.836 . . . . 5.9199999999999999 108.907 179.165 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -101.32 -6.57 23.94 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 122.568 1.175 . . . . 6.8799999999999999 108.8 177.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.401 ' HE3' ' OG ' ' A' ' 45' ' ' SER . 19.5 ptmt -117.34 88.36 2.89 Favored 'General case' 0 N--CA 1.413 -2.308 0 CA-C-N 114.936 -1.029 . . . . 7.9500000000000002 110.427 -177.553 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.593 ' HD3' ' H ' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -78.31 152.99 32.12 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 114.16 -1.382 . . . . 8.1699999999999999 110.589 -178.145 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . 65.04 14.11 9.13 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.509 1.124 . . . . 5.9299999999999997 112.728 177.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 26.1 mmt 68.98 12.52 8.64 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.607 0.763 . . . . 7.6200000000000001 111.889 178.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.401 ' OG ' ' HE3' ' A' ' 41' ' ' LYS . 13.7 p 46.69 -98.55 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.157 0 N-CA-C 116.485 2.032 . . . . 3.9100000000000001 116.485 176.073 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.472 ' O ' ' HA ' ' A' ' 54' ' ' THR . 66.5 mt -119.99 149.87 22.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.024 0 N-CA-C 108.294 -1.002 . . . . 3.7599999999999998 108.294 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.638 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 1.2 tp60 -119.22 141.33 49.0 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 108.841 -0.8 . . . . 6.79 108.841 -177.407 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.695 ' SG ' HG12 ' A' ' 50' ' ' VAL . 22.6 t -78.99 147.65 32.83 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 112.217 0.451 . . . . 5.4299999999999997 112.217 -177.2 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 2.5 tmmm? -64.29 -46.37 83.94 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.827 1.251 . . . . 5.9100000000000001 110.978 -177.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.695 HG12 ' SG ' ' A' ' 48' ' ' CYS . 8.5 p -51.19 -32.55 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 N-CA-C 113.962 1.097 . . . . 7.9400000000000004 113.962 -173.172 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 41.9 t -159.01 -74.06 0.08 Allowed 'General case' 0 C--N 1.3 -1.583 0 C-N-CA 120.79 -0.364 . . . . 9.2799999999999994 110.044 -177.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.451 ' HG2' HE21 ' A' ' 47' ' ' GLN . 35.2 ttp 176.38 40.64 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 108.967 -0.753 . . . . 9.4399999999999995 108.967 -176.368 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.638 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 7.4 mm100 -89.69 -176.22 4.91 Favored 'General case' 0 C--O 1.193 -1.894 0 N-CA-C 107.72 -1.215 . . . . 9.1099999999999994 107.72 -174.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.472 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 5.2 t -133.17 152.19 51.95 Favored 'General case' 0 C--N 1.286 -2.185 0 C-N-CA 117.73 -1.588 . . . . 5.9299999999999997 113.506 -175.076 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -135.18 156.55 48.8 Favored 'General case' 0 N--CA 1.427 -1.613 0 N-CA-C 106.489 -1.671 . . . . 5.2699999999999996 106.489 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.2 tp -70.83 138.34 22.03 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.657 0 O-C-N 123.713 0.633 . . . . 5.2300000000000004 111.88 -176.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 19.0 p -86.36 74.15 10.02 Favored 'General case' 0 N--CA 1.418 -2.064 0 CA-C-O 121.588 0.709 . . . . 4.21 111.132 178.481 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.1 p -70.78 -16.01 62.71 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.356 -0.838 . . . . 6.0099999999999998 109.931 173.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 60.7 m -155.14 153.18 30.41 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 106.299 -1.741 . . . . 6.1900000000000004 106.299 176.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.9 m -77.4 138.27 39.19 Favored 'General case' 0 N--CA 1.418 -2.03 0 N-CA-C 106.459 -1.682 . . . . 6.4699999999999998 106.459 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -52.17 -39.31 59.86 Favored 'General case' 0 C--O 1.185 -2.291 0 C-N-CA 120.749 -0.381 . . . . 4.8600000000000003 110.402 -179.012 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.548 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 17.2 m -53.38 -41.42 44.33 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.205 0 N-CA-C 114.403 1.26 . . . . 7.2300000000000004 114.403 -178.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -72.37 -33.08 66.98 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 122.137 0.97 . . . . 9.3599999999999994 108.851 -179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 60.0 m -73.48 -31.34 63.7 Favored 'General case' 0 C--N 1.31 -1.135 0 N-CA-C 108.39 -0.967 . . . . 5.9000000000000004 108.39 178.227 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.45 ' HB3' ' O ' ' A' ' 62' ' ' VAL . 27.1 ttm180 -64.86 -42.85 94.53 Favored 'General case' 0 N--CA 1.426 -1.65 0 C-N-CA 125.472 1.509 . . . . 7.6900000000000004 110.967 177.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.548 ' HG3' ' O ' ' A' ' 62' ' ' VAL . 27.9 mt-10 -55.43 -47.92 75.24 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 122.372 1.082 . . . . 9.7799999999999994 108.44 178.645 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -75.59 -16.82 60.19 Favored 'General case' 0 C--N 1.293 -1.87 0 CA-C-N 113.768 -1.56 . . . . 8.9700000000000006 110.943 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.603 ' HA ' ' CD2' ' A' ' 72' ' ' HIS . . . -88.56 -41.46 12.68 Favored 'General case' 0 CA--C 1.489 -1.386 0 N-CA-C 112.423 0.527 . . . . 6.5300000000000002 112.423 -177.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 33.0 mm-40 -68.2 -25.06 65.04 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 107.854 -1.165 . . . . 8.5 107.854 178.405 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.483 ' O ' ' HD3' ' A' ' 71' ' ' LYS . . . -75.8 -31.24 59.35 Favored 'General case' 0 C--O 1.245 0.854 0 CA-C-N 114.783 -1.099 . . . . 9.4100000000000001 111.192 176.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.483 ' HD3' ' O ' ' A' ' 70' ' ' ALA . 73.4 mmtt -135.43 -111.08 0.21 Allowed 'General case' 0 C--N 1.355 0.842 0 N-CA-C 109.682 -0.488 . . . . 10.32 109.682 -177.239 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.603 ' CD2' ' HA ' ' A' ' 68' ' ' ALA . 9.7 m170 29.23 51.62 0.4 Allowed Pre-proline 0 N--CA 1.501 2.086 0 N-CA-C 115.758 1.762 . . . . 7.4699999999999998 115.758 178.336 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.535 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 1.0 OUTLIER -79.85 -3.35 12.75 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.375 2.05 . . . . 6.8099999999999996 113.838 -175.069 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.568 ' O ' ' HG3' ' A' ' 85' ' ' LYS . 18.4 ptmt -161.45 109.3 1.47 Allowed 'General case' 0 C--O 1.199 -1.597 0 N-CA-C 111.987 0.365 . . . . 7.3200000000000003 111.987 -177.198 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -97.62 122.04 40.24 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.221 -1.029 . . . . 4.5199999999999996 108.221 174.421 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -98.95 -90.65 0.29 Allowed 'General case' 0 C--O 1.211 -0.942 0 CA-C-N 115.815 -0.629 . . . . 6.8200000000000003 110.818 -173.024 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 32.7 m -82.44 -11.95 12.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 CA-C-O 122.284 1.04 . . . . 8.1500000000000004 109.044 176.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.479 HG21 ' HA ' ' A' ' 85' ' ' LYS . 35.8 m -99.19 13.57 5.0 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 CA-C-N 113.881 -1.509 . . . . 5.6500000000000004 108.707 177.382 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.85 -15.2 53.64 Favored 'General case' 0 C--O 1.251 1.132 0 CA-C-O 121.622 0.725 . . . . 4.2400000000000002 111.539 178.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.426 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 73.6 m -75.56 -15.81 60.33 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-N 115.295 -0.866 . . . . 5.5999999999999996 110.701 175.165 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.522 ' CD1' HD12 ' A' ' 84' ' ' LEU . 16.4 p90 -154.1 70.6 6.34 Favored Pre-proline 0 CA--C 1.561 1.382 0 C-N-CA 124.454 1.102 . . . . 5.1299999999999999 111.527 179.068 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -57.38 -22.96 52.6 Favored 'Trans proline' 0 N--CA 1.495 1.589 0 C-N-CA 123.481 2.787 . . . . 3.27 114.478 -173.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -73.71 -1.38 18.86 Favored 'General case' 0 C--N 1.309 -1.181 0 C-N-CA 120.161 -0.615 . . . . 4.25 111.825 -178.051 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.522 HD12 ' CD1' ' A' ' 81' ' ' PHE . 19.3 mt -123.01 14.66 9.89 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 118.162 0.437 . . . . 5.4699999999999998 111.011 -177.134 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.568 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 4.7 tmtt? -53.92 -83.38 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 113.764 1.024 . . . . 8.0399999999999991 113.764 -177.718 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.485 ' HG2' ' HD2' ' A' ' 85' ' ' LYS . 31.9 mmmt . . . . . 0 CA--C 1.503 -0.861 0 CA-C-O 118.913 -0.565 . . . . 11.1 110.919 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.803 0 N-CA-C 111.991 -0.443 . . . . 19.140000000000001 111.991 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 63.37 14.29 7.77 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.427 1.091 . . . . 19.739999999999998 112.886 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -148.45 162.0 40.48 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.833 -0.803 . . . . 17.670000000000002 108.833 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -69.35 148.53 49.55 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 120.482 0.182 . . . . 14.74 110.563 178.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 27.3 p80 -131.45 138.79 49.19 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 120.622 0.249 . . . . 14.24 111.011 -176.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 15.1 t-80 -156.69 138.96 14.69 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 107.889 -1.152 . . . . 13.67 107.889 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 67.4 m-70 -133.74 128.94 35.93 Favored 'General case' 0 C--N 1.312 -1.059 0 N-CA-C 109.801 -0.444 . . . . 10.300000000000001 109.801 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.7 mp 62.46 -174.65 0.14 Allowed 'General case' 0 CA--C 1.557 1.242 0 O-C-N 124.336 1.022 . . . . 10.1 111.95 179.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 64.35 16.45 10.15 Favored 'General case' 0 N--CA 1.498 1.943 0 C-N-CA 124.252 1.021 . . . . 11.869999999999999 110.541 178.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 177.55 -167.43 38.44 Favored Glycine 0 N--CA 1.427 -1.941 0 N-CA-C 109.065 -1.614 . . . . 9.5999999999999996 109.065 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -99.7 92.2 1.12 Allowed Glycine 0 N--CA 1.433 -1.518 0 C-N-CA 120.407 -0.901 . . . . 8.4499999999999993 111.09 178.237 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -96.88 63.65 1.04 Allowed Glycine 0 C--N 1.312 -0.76 0 C-N-CA 121.025 -0.607 . . . . 9.2400000000000002 111.796 -179.22 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -83.8 113.72 21.12 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 122.183 0.992 . . . . 9.6799999999999997 111.667 -178.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -88.02 179.59 6.39 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 114.959 -1.019 . . . . 11.119999999999999 110.088 177.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLN . . . . . 0.476 ' C ' ' H ' ' A' ' 17' ' ' SER . 47.3 mt-30 -72.77 168.19 19.31 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-N 116.078 -0.51 . . . . 15.18 111.905 -179.773 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 79.02 -31.69 0.15 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.213 1.805 . . . . 15.42 108.363 -173.581 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.476 ' H ' ' C ' ' A' ' 15' ' ' GLN . 32.7 t 70.92 -38.34 0.42 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.665 1.986 . . . . 11.210000000000001 112.811 175.409 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.53 -51.92 65.44 Favored 'General case' 0 C--N 1.311 -1.105 0 C-N-CA 123.228 0.611 . . . . 13.140000000000001 112.553 -177.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -85.09 -1.81 57.28 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.447 -0.342 . . . . 14.08 111.264 -178.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.94 -28.92 17.75 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.622 0.725 . . . . 9.7699999999999996 109.77 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 74.8 mtp180 -96.08 10.43 37.6 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 114.981 -1.009 . . . . 10.289999999999999 110.186 -178.52 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.55 -35.53 70.65 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.754 -0.657 . . . . 9.1500000000000004 110.818 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -136.55 -90.67 0.27 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 109.036 -0.728 . . . . 11.119999999999999 109.036 178.187 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 54.7 t30 58.87 -71.42 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 114.636 1.347 . . . . 6.46 114.636 175.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 59.6 tp -121.39 116.29 24.51 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-O 121.378 0.609 . . . . 6.8099999999999996 110.314 -175.227 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -84.11 -27.88 27.89 Favored 'General case' 0 C--N 1.3 -1.574 0 N-CA-C 113.761 1.022 . . . . 7.7000000000000002 113.761 -176.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -82.1 16.48 1.93 Allowed 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 113.083 0.771 . . . . 8.8599999999999994 113.083 -174.08 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -108.89 -171.88 1.94 Allowed 'General case' 0 C--N 1.303 -1.432 0 C-N-CA 122.76 0.424 . . . . 6.4800000000000004 110.474 179.635 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -129.12 151.01 50.26 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 123.361 0.665 . . . . 10.01 109.358 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -113.63 -170.9 1.79 Allowed 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 109.608 -0.516 . . . . 7.4299999999999997 109.608 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -91.54 -176.54 4.54 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.837 0.351 . . . . 8.1600000000000001 110.636 -178.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -144.98 -60.47 0.02 OUTLIER Glycine 0 N--CA 1.439 -1.105 0 C-N-CA 120.8 -0.714 . . . . 7.6900000000000004 111.393 -179.466 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -90.85 139.69 30.51 Favored 'General case' 0 C--O 1.25 1.114 0 N-CA-C 109.842 -0.429 . . . . 8.8599999999999994 109.842 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -70.64 137.44 27.28 Favored Glycine 0 N--CA 1.439 -1.151 0 O-C-N 123.959 0.787 . . . . 8.2799999999999994 112.902 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.502 ' HB2' ' HB3' ' A' ' 38' ' ' GLU . 22.9 p -89.64 169.39 11.36 Favored 'General case' 0 N--CA 1.425 -1.7 0 C-N-CA 123.051 0.54 . . . . 9.5299999999999994 111.604 -178.103 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -126.15 -67.05 0.89 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.727 -0.471 . . . . 11.91 109.727 178.444 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.5 mt -104.35 -35.36 7.98 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.604 -0.517 . . . . 10.08 109.604 176.31 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.502 ' HB3' ' HB2' ' A' ' 35' ' ' SER . 12.2 pt-20 52.79 -168.78 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 125.494 1.518 . . . . 7.8600000000000003 113.591 178.6 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 71.7 -17.28 0.35 Allowed 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.627 1.171 . . . . 5.9199999999999999 113.763 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -73.71 18.19 0.14 Allowed 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 113.52 0.933 . . . . 6.8799999999999999 113.52 -177.793 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.499 ' HE2' HG12 ' A' ' 56' ' ' ILE . 34.2 ttmt -131.26 -74.72 0.52 Allowed 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.345 -0.942 . . . . 7.9500000000000002 109.58 178.133 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt 64.4 -33.63 0.15 Allowed 'General case' 0 CA--C 1.571 1.755 0 N-CA-C 114.855 1.428 . . . . 8.1699999999999999 114.855 176.056 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -89.85 -15.82 31.41 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 113.464 0.913 . . . . 5.9299999999999997 113.464 -175.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 1.3 mpt? 61.42 90.04 0.07 Allowed 'General case' 0 N--CA 1.473 0.696 0 O-C-N 123.898 0.748 . . . . 7.6200000000000001 110.795 -173.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.506 ' OG ' HG13 ' A' ' 46' ' ' ILE . 22.7 t -60.0 -81.86 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 114.889 -1.05 . . . . 3.9100000000000001 113.767 -178.263 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.506 HG13 ' OG ' ' A' ' 45' ' ' SER . 13.2 mt -129.41 159.34 41.55 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 CA-C-N 115.968 -0.56 . . . . 3.7599999999999998 110.056 -172.368 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.624 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 34.9 tt0 -108.98 135.03 50.83 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.914 0.885 . . . . 6.79 109.196 178.548 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.678 ' SG ' HG12 ' A' ' 50' ' ' VAL . 47.6 t -77.55 144.81 37.31 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.516 -0.765 . . . . 5.4299999999999997 111.06 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' A' ' 79' ' ' ALA . 14.7 ttpt -59.13 -47.07 86.63 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 124.897 1.279 . . . . 5.9100000000000001 112.426 -175.56 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.678 HG12 ' SG ' ' A' ' 48' ' ' CYS . 7.1 p -49.48 -32.84 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-N 114.542 -1.208 . . . . 7.9400000000000004 113.902 -170.764 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.436 ' SG ' ' HG2' ' A' ' 52' ' ' MET . 52.7 t -160.02 -71.23 0.07 Allowed 'General case' 0 N--CA 1.419 -2.01 0 C-N-CA 119.915 -0.714 . . . . 9.2799999999999994 110.492 -177.359 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.436 ' HG2' ' SG ' ' A' ' 51' ' ' CYS . 24.3 ptt? -178.95 28.12 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 O-C-N 123.5 0.5 . . . . 9.4399999999999995 111.195 -174.568 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.624 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 5.6 mm100 -83.95 178.6 7.81 Favored 'General case' 0 C--O 1.201 -1.456 0 N-CA-C 108.177 -1.045 . . . . 9.1099999999999994 108.177 -171.36 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.491 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 9.5 t -134.86 145.1 47.97 Favored 'General case' 0 C--N 1.279 -2.483 0 C-N-CA 117.894 -1.523 . . . . 5.9299999999999997 112.303 -175.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.487 ' O ' ' HB3' ' A' ' 45' ' ' SER . 96.8 m-85 -107.31 173.42 6.33 Favored 'General case' 0 N--CA 1.424 -1.762 0 CA-C-N 114.317 -1.311 . . . . 5.2699999999999996 108.27 176.404 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.613 HD13 ' H ' ' A' ' 57' ' ' CYS . 0.3 OUTLIER -104.51 148.79 8.7 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.547 0 N-CA-C 107.287 -1.375 . . . . 5.2300000000000004 107.287 -177.217 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.613 ' H ' HD13 ' A' ' 56' ' ' ILE . 42.5 t -71.82 77.58 0.87 Allowed 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.895 0.855 . . . . 4.21 110.322 176.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 9.9 t -96.95 -11.02 25.15 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 114.859 -1.064 . . . . 6.0099999999999998 108.706 174.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 47.2 m -161.95 150.81 15.47 Favored 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 106.76 -1.57 . . . . 6.1900000000000004 106.76 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 11.3 m -89.4 131.16 35.59 Favored 'General case' 0 N--CA 1.406 -2.647 0 N-CA-C 105.719 -1.956 . . . . 6.4699999999999998 105.719 178.279 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.545 ' O ' ' HG3' ' A' ' 65' ' ' ARG . 42.7 mt-10 -52.45 -29.98 27.35 Favored 'General case' 0 C--O 1.186 -2.256 0 N-CA-C 112.787 0.662 . . . . 4.8600000000000003 112.787 -177.253 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.406 HG22 ' NH2' ' A' ' 65' ' ' ARG . 86.5 t -58.91 -36.86 63.77 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.4 0 N-CA-C 111.721 0.267 . . . . 7.2300000000000004 111.721 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -71.56 -30.59 66.04 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 108.02 -1.104 . . . . 9.3599999999999994 108.02 -179.444 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 69.8 m -80.2 -25.68 39.55 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 114.726 -1.125 . . . . 5.9000000000000004 110.956 176.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.545 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 65.8 mtm180 -64.78 -49.12 71.95 Favored 'General case' 0 CA--C 1.5 -0.958 0 N-CA-C 111.972 0.36 . . . . 7.6900000000000004 111.972 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -63.68 -39.48 94.42 Favored 'General case' 0 C--O 1.217 -0.617 0 C-N-CA 119.967 -0.693 . . . . 9.7799999999999994 109.673 177.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -62.72 -30.85 71.73 Favored 'General case' 0 CA--C 1.558 1.271 0 CA-C-N 115.918 -0.583 . . . . 8.9700000000000006 111.085 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -77.67 -50.36 12.62 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 116.295 -0.411 . . . . 6.5300000000000002 111.17 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 10.8 pt-20 -69.17 -18.09 63.89 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 121.103 0.478 . . . . 8.5 111.743 -178.527 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.0 -17.56 59.64 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.424 -0.807 . . . . 9.4100000000000001 111.287 176.632 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.421 ' HG3' ' HG2' ' A' ' 86' ' ' LYS . 47.2 mmtm -138.19 -73.99 0.4 Allowed 'General case' 0 C--O 1.211 -0.93 0 CA-C-O 120.691 0.281 . . . . 10.32 111.31 -174.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 18.5 p80 43.5 63.06 8.36 Favored Pre-proline 0 N--CA 1.478 0.963 0 N-CA-C 114.864 1.431 . . . . 7.4699999999999998 114.864 -178.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -79.74 -60.64 0.03 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.343 0 C-N-CA 121.244 1.296 . . . . 6.8099999999999996 114.101 178.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -158.21 107.29 2.03 Favored 'General case' 0 N--CA 1.44 -0.942 0 C-N-CA 119.587 -0.845 . . . . 7.3200000000000003 112.555 -173.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.746 ' HB2' ' HG2' ' A' ' 85' ' ' LYS . . . -85.0 89.96 7.72 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.374 -0.83 . . . . 4.5199999999999996 110.201 176.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -113.98 -72.48 0.7 Allowed 'General case' 0 N--CA 1.482 1.165 0 CA-C-O 121.101 0.477 . . . . 6.8200000000000003 111.647 -178.233 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 27.2 m -77.51 -14.56 14.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 122.079 0.942 . . . . 8.1500000000000004 108.973 176.032 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.62 HG21 ' HA ' ' A' ' 85' ' ' LYS . 29.1 m -105.22 11.08 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.141 0 CA-C-N 114.346 -1.297 . . . . 5.6500000000000004 108.979 175.141 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.514 ' O ' ' HD3' ' A' ' 49' ' ' LYS . . . -61.21 -18.2 57.06 Favored 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 112.076 0.398 . . . . 4.2400000000000002 112.076 179.405 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.534 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 78.2 m -76.99 -13.1 60.0 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 116.212 -0.449 . . . . 5.5999999999999996 111.293 178.633 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.41 ' CZ ' HG21 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -151.69 75.27 7.75 Favored Pre-proline 0 C--N 1.306 -1.29 0 N-CA-C 106.69 -1.596 . . . . 5.1299999999999999 106.69 174.634 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -67.88 9.44 0.36 Allowed 'Trans proline' 0 C--N 1.367 1.538 0 C-N-CA 123.7 2.933 . . . . 3.27 114.345 -173.112 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 38.7 m170 -91.08 -4.6 56.15 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.946 -0.761 . . . . 4.25 108.946 175.263 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 13.4 mt -120.59 21.09 11.67 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.299 -0.409 . . . . 5.4699999999999998 110.435 -174.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.746 ' HG2' ' HB2' ' A' ' 75' ' ' ALA . 58.6 mttp -36.86 -49.02 0.78 Allowed 'General case' 0 CA--C 1.561 1.375 0 N-CA-C 117.607 2.447 . . . . 8.0399999999999991 117.607 -173.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.421 ' HG2' ' HG3' ' A' ' 71' ' ' LYS . 54.5 tptt . . . . . 0 C--N 1.326 -0.432 0 CA-C-O 118.752 -0.642 . . . . 11.1 112.712 -177.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.488 -1.616 0 N-CA-C 109.649 -1.38 . . . . 19.140000000000001 109.649 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 15.7 t60 -140.65 127.63 20.69 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 109.474 -0.565 . . . . 19.739999999999998 109.474 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 25.7 t-80 71.98 131.0 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.139 0.975 . . . . 17.670000000000002 112.298 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 -64.26 122.02 15.65 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 108.213 -1.032 . . . . 14.74 108.213 177.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 43.7 p-80 -155.41 161.33 41.02 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.685 -0.406 . . . . 14.24 111.026 -177.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.4 m170 72.98 178.71 0.23 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 124.646 1.179 . . . . 13.67 112.384 -176.282 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.507 ' HD2' ' O ' ' A' ' 20' ' ' ALA . 25.4 t-80 -163.43 144.51 9.25 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 106.882 -1.525 . . . . 10.300000000000001 106.882 -178.387 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.547 ' HB2' ' O ' ' A' ' 23' ' ' LYS . 54.5 tp -54.36 -69.39 0.13 Allowed 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 121.321 0.581 . . . . 10.1 111.963 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -88.04 112.06 22.22 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-N 115.34 -0.845 . . . . 11.869999999999999 108.854 -177.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.88 -28.69 7.91 Favored Glycine 0 C--N 1.309 -0.943 0 C-N-CA 120.617 -0.801 . . . . 9.5999999999999996 111.531 -178.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 73.94 -58.27 2.22 Favored Glycine 0 C--O 1.249 1.083 0 N-CA-C 115.388 0.915 . . . . 8.4499999999999993 115.388 177.45 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -77.31 52.64 3.43 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 115.801 1.08 . . . . 9.2400000000000002 115.801 -172.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 67.2 t30 65.52 -172.73 0.18 Allowed 'General case' 0 CA--C 1.559 1.322 0 C-N-CA 123.954 0.902 . . . . 9.6799999999999997 110.759 174.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -179.33 164.11 1.32 Allowed 'General case' 0 C--O 1.249 1.077 0 C-N-CA 124.05 0.94 . . . . 11.119999999999999 109.09 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 96.8 mt-30 -73.03 176.59 5.63 Favored 'General case' 0 C--O 1.239 0.544 0 O-C-N 123.216 0.322 . . . . 15.18 110.46 177.163 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.3 pttt 47.65 43.3 16.36 Favored 'General case' 0 C--N 1.365 1.275 0 CA-C-O 122.333 1.063 . . . . 15.42 109.942 -173.336 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.464 ' HA ' ' HB3' ' A' ' 20' ' ' ALA . 14.3 m -57.22 -5.62 0.31 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 127.096 2.158 . . . . 11.210000000000001 113.927 -175.1 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.77 -59.41 4.59 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.69 -0.485 . . . . 13.140000000000001 109.69 177.32 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 26.2 mmt -101.32 -11.18 19.65 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.144 -0.48 . . . . 14.08 111.266 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.507 ' O ' ' HD2' ' A' ' 7' ' ' HIS . . . -72.08 -11.64 60.84 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.2 0.524 . . . . 9.7699999999999996 111.258 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.88 -1.65 58.11 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 112.557 0.577 . . . . 10.289999999999999 112.557 178.552 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.53 105.29 1.8 Allowed 'General case' 0 C--O 1.237 0.41 0 N-CA-C 109.06 -0.719 . . . . 9.1500000000000004 109.06 177.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.547 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 13.7 mmmm 67.11 117.46 0.03 OUTLIER 'General case' 0 C--N 1.353 0.718 0 O-C-N 124.421 1.076 . . . . 11.119999999999999 111.262 -172.209 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -145.82 133.64 21.22 Favored 'General case' 0 C--N 1.297 -1.701 0 C-N-CA 120.243 -0.583 . . . . 6.46 109.735 175.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 88.3 mt 59.1 85.07 0.1 Allowed 'General case' 0 N--CA 1.468 0.447 0 O-C-N 124.643 1.215 . . . . 6.8099999999999996 112.002 -177.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -79.11 149.34 32.09 Favored 'General case' 0 N--CA 1.427 -1.579 0 N-CA-C 108.797 -0.816 . . . . 7.7000000000000002 108.797 -179.521 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -127.81 -73.49 0.6 Allowed 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 116.588 -0.278 . . . . 8.8599999999999994 111.351 -176.572 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -144.87 100.14 3.45 Favored 'General case' 0 N--CA 1.431 -1.378 0 CA-C-O 120.868 0.366 . . . . 6.4800000000000004 111.046 -177.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -100.31 142.97 31.05 Favored 'General case' 0 C--O 1.252 1.207 0 CA-C-N 115.365 -0.834 . . . . 10.01 109.651 176.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -77.99 123.9 27.37 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.647 -0.706 . . . . 7.4299999999999997 110.879 -178.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -128.41 104.78 7.89 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 109.242 -0.651 . . . . 8.1600000000000001 109.242 178.058 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -166.77 -62.85 0.03 OUTLIER Glycine 0 N--CA 1.442 -0.963 0 N-CA-C 110.858 -0.897 . . . . 7.6900000000000004 110.858 -178.572 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 14.9 mmmm -86.15 -178.17 6.45 Favored 'General case' 0 C--O 1.247 0.923 0 N-CA-C 109.269 -0.641 . . . . 8.8599999999999994 109.269 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -77.65 82.79 1.16 Allowed Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.921 -0.657 . . . . 8.2799999999999994 113.366 -177.44 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 36.4 p -78.05 105.99 9.63 Favored 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 108.913 -0.773 . . . . 9.5299999999999994 108.913 176.671 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -121.15 -76.26 0.59 Allowed 'General case' 0 C--N 1.31 -1.144 0 C-N-CA 120.562 -0.455 . . . . 11.91 110.687 -177.207 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.0 mp -100.26 -35.7 9.53 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.449 -0.501 . . . . 10.08 111.389 178.101 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.51 ' O ' ' HD2' ' A' ' 42' ' ' LYS . 30.9 tt0 59.59 94.54 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.083 0.953 . . . . 7.8600000000000003 110.798 -177.125 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -158.07 -46.77 0.06 Allowed 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 116.142 -0.481 . . . . 5.9199999999999999 110.24 -178.021 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 25.3 p-10 -47.17 -46.77 23.85 Favored 'General case' 0 C--O 1.215 -0.742 0 N-CA-C 114.513 1.301 . . . . 6.8799999999999999 114.513 -176.658 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -136.84 32.95 2.68 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.624 -0.43 . . . . 7.9500000000000002 111.946 -177.312 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.51 ' HD2' ' O ' ' A' ' 38' ' ' GLU . 20.2 ptmt -83.46 8.6 13.41 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 120.228 -0.589 . . . . 8.1699999999999999 110.747 -179.049 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -98.65 0.16 44.16 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.413 -0.812 . . . . 5.9299999999999997 110.085 178.143 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 1.3 mpt? 56.27 78.02 0.22 Allowed 'General case' 0 C--N 1.347 0.492 0 O-C-N 124.276 0.985 . . . . 7.6200000000000001 111.496 -176.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.508 ' HB2' ' O ' ' A' ' 55' ' ' PHE . 62.6 m -61.26 -72.52 0.12 Allowed 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 114.816 -1.084 . . . . 3.9100000000000001 112.253 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.525 ' O ' ' HA ' ' A' ' 54' ' ' THR . 75.4 mt -129.6 129.73 66.75 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 N-CA-C 108.019 -1.104 . . . . 3.7599999999999998 108.019 -178.727 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.584 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 28.8 tt0 -97.9 130.33 44.79 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 108.728 -0.841 . . . . 6.79 108.728 178.265 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.594 ' SG ' HG22 ' A' ' 50' ' ' VAL . 41.9 t -67.56 123.6 20.89 Favored 'General case' 0 N--CA 1.421 -1.88 0 CA-C-N 115.708 -0.678 . . . . 5.4299999999999997 110.479 178.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.444 ' HD2' ' O ' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -50.07 -33.15 17.51 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 127.17 2.188 . . . . 5.9100000000000001 111.608 -177.759 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.594 HG22 ' SG ' ' A' ' 48' ' ' CYS . 10.2 m -59.1 -23.18 23.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 N-CA-C 112.765 0.654 . . . . 7.9400000000000004 112.765 -175.809 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.9 t -173.63 -81.93 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 120.734 0.302 . . . . 9.2799999999999994 110.89 178.29 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.535 ' HA ' ' CG ' ' A' ' 47' ' ' GLN . 55.0 ttp -165.5 36.73 0.06 Allowed 'General case' 0 CA--C 1.547 0.832 0 CA-C-O 122.326 1.06 . . . . 9.4399999999999995 109.736 -174.573 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.584 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 7.4 mm100 -88.99 -177.27 5.42 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 107.302 -1.369 . . . . 9.1099999999999994 107.302 -178.497 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.525 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 13.3 t -144.32 149.22 35.87 Favored 'General case' 0 N--CA 1.42 -1.952 0 C-N-CA 117.156 -1.817 . . . . 5.9299999999999997 113.041 -177.613 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.508 ' O ' ' HB2' ' A' ' 45' ' ' SER . 98.4 m-85 -125.93 153.74 43.82 Favored 'General case' 0 N--CA 1.418 -2.068 0 N-CA-C 106.826 -1.546 . . . . 5.2699999999999996 106.826 177.192 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 9.0 tp -79.32 139.72 17.91 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.342 0 O-C-N 123.411 0.444 . . . . 5.2300000000000004 110.377 -178.099 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.443 ' HB2' ' HB3' ' A' ' 45' ' ' SER . 43.0 t -81.16 74.7 8.16 Favored 'General case' 0 N--CA 1.429 -1.525 0 N-CA-C 108.683 -0.858 . . . . 4.21 108.683 177.103 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 9.8 t -92.26 1.14 57.4 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.406 -0.816 . . . . 6.0099999999999998 109.951 177.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 92.5 m -156.54 137.26 13.29 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 108.014 -1.106 . . . . 6.1900000000000004 108.014 178.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 17.9 m -78.72 138.23 38.16 Favored 'General case' 0 N--CA 1.419 -1.997 0 O-C-N 123.522 0.514 . . . . 6.4699999999999998 110.038 -175.893 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -51.08 -29.33 12.73 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 124.915 1.286 . . . . 4.8600000000000003 112.295 178.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 64.3 t -72.54 -32.42 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.78 0 CA-C-O 120.913 0.387 . . . . 7.2300000000000004 111.384 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -71.52 -39.59 70.67 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 122.322 1.058 . . . . 9.3599999999999994 108.96 177.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 55.6 m -62.47 -38.16 88.75 Favored 'General case' 0 C--N 1.271 -2.814 0 CA-C-N 113.885 -1.507 . . . . 5.9000000000000004 109.462 174.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 23.5 ttt180 -57.68 -51.74 68.29 Favored 'General case' 0 N--CA 1.444 -0.768 0 C-N-CA 123.811 0.845 . . . . 7.6900000000000004 112.895 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -61.7 -38.22 87.03 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-O 121.488 0.661 . . . . 9.7799999999999994 111.346 -177.341 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 32.0 t60 -76.67 -31.8 57.53 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.857 -0.61 . . . . 8.9700000000000006 109.898 -177.099 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.446 ' HB1' ' CG ' ' A' ' 85' ' ' LYS . . . -75.99 -25.39 55.74 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 115.753 -0.658 . . . . 6.5300000000000002 111.717 -177.624 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -83.17 -21.03 33.64 Favored 'General case' 0 C--N 1.294 -1.839 0 C-N-CA 120.03 -0.668 . . . . 8.5 111.512 176.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.47 -32.44 37.11 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.08 0.466 . . . . 9.4100000000000001 110.493 175.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.441 ' HB3' ' HD3' ' A' ' 73' ' ' PRO . 13.5 mptt -101.45 -86.54 0.41 Allowed 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.948 0.721 . . . . 10.32 112.948 -179.002 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.461 ' N ' ' HD3' ' A' ' 73' ' ' PRO 0.256 23.9 p80 46.38 59.01 16.21 Favored Pre-proline 0 N--CA 1.485 1.276 0 N-CA-C 116.052 1.871 . . . . 7.4699999999999998 116.052 -177.306 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.461 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 6.2 Cg_exo -82.34 -55.43 0.03 OUTLIER 'Trans proline' 0 N--CA 1.434 -2.016 0 C-N-CA 121.77 1.647 . . . . 6.8099999999999996 112.063 175.235 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 12.7 ptmm? -160.84 108.82 1.56 Allowed 'General case' 0 N--CA 1.436 -1.16 0 CA-C-O 121.435 0.636 . . . . 7.3200000000000003 111.819 -177.402 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 79' ' ' ALA . . . -73.07 88.88 1.43 Allowed 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 106.777 -1.564 . . . . 4.5199999999999996 106.777 171.236 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -113.19 -75.24 0.6 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.014 -0.994 . . . . 6.8200000000000003 110.66 -172.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 34.8 m -78.64 -11.91 13.34 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.832 0 CA-C-O 121.893 0.854 . . . . 8.1500000000000004 108.743 176.247 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 33.4 m -109.29 13.1 8.68 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.025 0 CA-C-N 114.393 -1.276 . . . . 5.6500000000000004 109.246 177.06 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.414 ' HB2' ' O ' ' A' ' 75' ' ' ALA . . . -66.32 -6.0 12.55 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 121.725 0.774 . . . . 4.2400000000000002 110.604 177.577 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.405 ' HB2' ' SG ' ' A' ' 48' ' ' CYS . 18.4 p -70.85 -27.31 63.75 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-N 114.813 -1.085 . . . . 5.5999999999999996 109.634 176.673 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -155.02 88.22 3.22 Favored Pre-proline 0 N--CA 1.439 -0.986 0 N-CA-C 106.866 -1.531 . . . . 5.1299999999999999 106.866 174.658 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -60.6 5.49 0.14 Allowed 'Trans proline' 0 N--CA 1.503 2.061 0 C-N-CA 124.212 3.275 . . . . 3.27 115.063 -172.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 65.1 m-70 -87.96 -8.58 55.5 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 109.205 -0.665 . . . . 4.25 109.205 174.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 36.9 mt -99.32 8.77 44.4 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.848 -0.615 . . . . 5.4699999999999998 111.128 -176.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.446 ' CG ' ' HB1' ' A' ' 68' ' ' ALA . 18.9 pttp -50.65 105.74 0.11 Allowed 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 122.003 0.906 . . . . 8.0399999999999991 113.227 179.588 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 81.7 tttt . . . . . 0 N--CA 1.441 -0.908 0 CA-C-N 113.696 -1.593 . . . . 11.1 110.154 -175.087 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.215 -1.092 0 N-CA-C 110.714 -0.954 . . . . 19.140000000000001 110.714 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 9.1 p-80 -98.44 178.93 4.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 117.231 0.515 . . . . 19.739999999999998 111.652 -178.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 53.4 m80 -100.44 158.33 15.98 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.193 -0.458 . . . . 17.670000000000002 110.024 178.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 31.1 t60 -102.18 128.68 48.58 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 120.745 0.307 . . . . 14.74 110.49 -176.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 73.0 t60 -158.68 138.0 11.58 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 108.506 -0.924 . . . . 14.24 108.506 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 44.8 t-80 -61.29 128.36 36.01 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 108.906 -0.776 . . . . 13.67 108.906 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 39.9 m80 -67.49 156.97 35.38 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.698 -0.401 . . . . 10.300000000000001 110.608 178.919 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 84.2 mt 82.59 -17.08 0.54 Allowed 'General case' 0 N--CA 1.497 1.887 0 C-N-CA 125.555 1.542 . . . . 10.1 111.337 -176.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -87.15 100.54 12.74 Favored 'General case' 0 C--O 1.244 0.806 0 CA-C-O 119.356 -0.354 . . . . 11.869999999999999 110.292 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.92 129.71 0.38 Allowed Glycine 0 C--O 1.246 0.892 0 C-N-CA 120.82 -0.705 . . . . 9.5999999999999996 112.934 177.093 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -76.18 80.62 1.1 Allowed Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 121.642 -0.313 . . . . 8.4499999999999993 112.789 -176.621 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -113.3 41.93 2.08 Favored Glycine 0 C--N 1.316 -0.566 0 C-N-CA 120.852 -0.69 . . . . 9.2400000000000002 112.678 179.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASN . . . . . 0.646 ' O ' ' HA ' ' A' ' 19' ' ' MET . 13.4 m120 -126.21 140.4 52.58 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 122.619 -0.342 . . . . 9.6799999999999997 110.752 -179.067 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.538 ' HA ' ' HG2' ' A' ' 19' ' ' MET . . . -89.11 166.05 14.1 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 114.025 1.121 . . . . 11.119999999999999 114.025 -172.666 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 71.75 173.23 0.31 Allowed 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 125.421 1.489 . . . . 15.18 110.111 -179.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.596 ' HB3' ' HA ' ' A' ' 22' ' ' ALA . 23.0 tptm 75.32 -56.67 0.61 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.611 1.164 . . . . 15.42 113.369 174.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.491 ' HB2' ' H ' ' A' ' 21' ' ' ARG . 38.6 m -132.21 26.36 4.52 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 116.252 -0.431 . . . . 11.210000000000001 109.962 -178.578 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 55.06 41.66 31.55 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.647 -0.706 . . . . 13.140000000000001 109.679 -179.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.646 ' HA ' ' O ' ' A' ' 13' ' ' ASN . 65.5 mtt 78.97 6.27 2.22 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 114.637 -1.165 . . . . 14.08 112.335 -178.879 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.474 ' HB3' ' HB3' ' A' ' 17' ' ' SER . . . -75.9 -30.83 58.94 Favored 'General case' 0 C--O 1.225 -0.233 0 C-N-CA 118.512 -1.275 . . . . 9.7699999999999996 109.477 178.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.491 ' H ' ' HB2' ' A' ' 17' ' ' SER . 25.1 ptt180 -178.2 83.71 0.02 OUTLIER 'General case' 0 C--O 1.206 -1.222 0 C-N-CA 124.204 1.002 . . . . 10.289999999999999 110.862 -178.763 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.596 ' HA ' ' HB3' ' A' ' 16' ' ' LYS . . . -63.53 -82.83 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 119.305 -0.958 . . . . 9.1500000000000004 111.702 175.214 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -131.4 15.91 4.98 Favored 'General case' 0 CA--C 1.491 -1.31 0 N-CA-C 106.193 -1.78 . . . . 11.119999999999999 106.193 175.054 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -84.31 -35.84 23.02 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 113.724 -1.58 . . . . 6.46 112.411 -172.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -120.18 -79.03 0.6 Allowed 'General case' 0 C--O 1.213 -0.817 0 C-N-CA 120.163 -0.615 . . . . 6.8099999999999996 110.123 -174.765 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 52.24 95.07 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 114.87 1.433 . . . . 7.7000000000000002 114.87 -178.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.432 ' HB3' ' HB3' ' A' ' 30' ' ' ALA . 75.4 mmtt 70.37 102.16 0.06 Allowed 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.296 1.038 . . . . 8.8599999999999994 111.49 179.16 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.93 -53.98 11.42 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 115.302 -0.863 . . . . 6.4800000000000004 112.428 -175.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -113.69 8.46 17.54 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-O 121.334 0.588 . . . . 10.01 110.164 -177.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.432 ' HB3' ' HB3' ' A' ' 27' ' ' LYS . . . -117.87 20.54 13.31 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 115.437 -0.801 . . . . 7.4299999999999997 109.776 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.01 141.44 43.93 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 115.039 -0.982 . . . . 8.1600000000000001 111.108 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -102.01 -139.98 10.86 Favored Glycine 0 C--O 1.251 1.207 0 C-N-CA 120.976 -0.631 . . . . 7.6900000000000004 113.472 -178.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 46.5 mmtm -147.71 31.95 0.87 Allowed 'General case' 0 C--O 1.244 0.815 0 C-N-CA 124.647 1.179 . . . . 8.8599999999999994 109.776 -178.148 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -115.84 176.43 16.49 Favored Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.864 -0.607 . . . . 8.2799999999999994 111.912 -178.401 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 31.3 t 174.47 -40.09 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 107.298 -1.371 . . . . 9.5299999999999994 107.298 -178.206 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -78.53 -173.08 3.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.52 -1.218 . . . . 11.91 109.379 177.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 54.1 tp -55.67 -45.74 77.67 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 123.502 0.501 . . . . 10.08 110.432 177.14 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 66.95 118.5 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.245 0 CA-C-O 122.523 1.154 . . . . 7.8600000000000003 114.062 175.382 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -87.51 149.99 24.02 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 115.284 -0.871 . . . . 5.9199999999999999 110.885 -178.26 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -53.74 -45.78 70.66 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 123.562 0.539 . . . . 6.8799999999999999 110.7 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -96.44 33.92 1.72 Allowed 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.228 0.455 . . . . 7.9500000000000002 112.228 -179.162 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 79.0 tttt -59.91 -39.14 84.41 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 108.93 -0.767 . . . . 8.1699999999999999 108.93 173.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . 176.62 -20.28 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.213 0 CA-C-N 115.02 -0.991 . . . . 5.9299999999999997 110.978 178.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 72.1 mtm -70.19 89.35 0.64 Allowed 'General case' 0 CA--C 1.5 -0.963 0 CA-C-O 121.654 0.74 . . . . 7.6200000000000001 109.122 178.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.584 ' HB2' ' O ' ' A' ' 55' ' ' PHE . 75.3 m -143.89 -73.04 0.27 Allowed 'General case' 0 N--CA 1.413 -2.321 0 CA-C-N 114.561 -1.2 . . . . 3.9100000000000001 113.872 -174.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.594 ' O ' ' HA ' ' A' ' 54' ' ' THR . 44.3 mt -111.79 136.67 47.2 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.492 0 O-C-N 121.868 -0.52 . . . . 3.7599999999999998 109.816 -177.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.641 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 4.4 tt0 -97.59 123.98 41.69 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 109.504 -0.554 . . . . 6.79 109.504 -176.75 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.698 ' SG ' HG22 ' A' ' 50' ' ' VAL . 34.2 t -60.46 141.78 55.98 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.725 1.61 . . . . 5.4299999999999997 114.052 -173.899 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.431 ' HD2' ' O ' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -72.12 -31.96 66.51 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.338 1.455 . . . . 5.9100000000000001 109.467 -177.77 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.698 HG22 ' SG ' ' A' ' 48' ' ' CYS . 5.9 m -61.28 -26.58 39.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 115.868 -0.606 . . . . 7.9400000000000004 111.6 -174.488 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.7 t -161.86 -76.72 0.05 OUTLIER 'General case' 0 N--CA 1.426 -1.646 0 CA-C-N 115.967 -0.56 . . . . 9.2799999999999994 109.97 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 34.3 ttp 178.51 35.75 0.0 OUTLIER 'General case' 0 C--O 1.212 -0.892 0 CA-C-O 121.925 0.869 . . . . 9.4399999999999995 108.84 -175.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.641 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 6.5 mm100 -93.92 -164.7 1.21 Allowed 'General case' 0 C--O 1.191 -1.983 0 N-CA-C 108.0 -1.111 . . . . 9.1099999999999994 108.0 -172.433 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.594 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 15.3 t -137.14 162.41 33.49 Favored 'General case' 0 C--N 1.313 -0.999 0 C-N-CA 116.828 -1.949 . . . . 5.9299999999999997 113.184 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.584 ' O ' ' HB2' ' A' ' 45' ' ' SER . 96.6 m-85 -144.18 177.9 8.27 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 126.626 1.97 . . . . 5.2699999999999996 106.978 177.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 7.5 tp -86.95 134.73 26.81 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 CA-C-O 120.977 0.418 . . . . 5.2300000000000004 111.994 -176.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.558 ' CB ' ' HB3' ' A' ' 45' ' ' SER . 10.3 t -110.4 85.0 2.02 Favored 'General case' 0 N--CA 1.413 -2.296 0 N-CA-C 107.353 -1.351 . . . . 4.21 107.353 175.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.9 p -55.27 -35.13 64.69 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.17 -0.923 . . . . 6.0099999999999998 111.681 174.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.65 HG23 ' H ' ' A' ' 61' ' ' GLU . 14.2 t -109.09 -155.44 0.56 Allowed 'General case' 0 CA--C 1.556 1.176 0 N-CA-C 108.723 -0.843 . . . . 6.1900000000000004 108.723 -178.105 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.0 t -100.07 21.74 12.36 Favored 'General case' 0 CA--C 1.554 1.097 0 N-CA-C 109.68 -0.489 . . . . 6.4699999999999998 109.68 177.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.65 ' H ' HG23 ' A' ' 59' ' ' THR . 29.7 tt0 64.78 -50.88 0.32 Allowed 'General case' 0 N--CA 1.503 2.191 0 C-N-CA 126.361 1.864 . . . . 4.8600000000000003 111.942 -175.163 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.518 ' HA ' ' HB3' ' A' ' 65' ' ' ARG . 57.7 t -51.01 -29.49 7.9 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 C-N-CA 125.361 1.464 . . . . 7.2300000000000004 112.956 -176.86 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.53 ' HD3' ' O ' ' A' ' 63' ' ' LYS . 4.7 tmtm? -72.5 -38.07 68.23 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 122.038 0.923 . . . . 9.3599999999999994 108.898 -179.311 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 85.6 m -75.78 -29.28 58.72 Favored 'General case' 0 C--N 1.284 -2.259 0 N-CA-C 109.038 -0.727 . . . . 5.9000000000000004 109.038 176.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.518 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 21.8 tpt180 -56.86 -55.34 35.65 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.421 1.088 . . . . 7.6900000000000004 111.34 177.631 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -59.1 -37.61 77.55 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 123.981 0.801 . . . . 9.7799999999999994 110.73 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 52.8 t60 -76.7 -26.77 55.08 Favored 'General case' 0 C--O 1.21 -1.023 0 C-N-CA 120.368 -0.533 . . . . 8.9700000000000006 111.501 -178.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ALA . . . . . 0.457 ' O ' ' HB2' ' A' ' 72' ' ' HIS . . . -82.13 -38.03 25.38 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 111.771 0.286 . . . . 6.5300000000000002 111.771 -177.08 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -73.49 -23.49 60.06 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.3 0.571 . . . . 8.5 110.297 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -89.63 -7.0 55.69 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.596 -0.729 . . . . 9.4100000000000001 111.437 178.518 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -136.0 -85.87 0.36 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 111.962 0.356 . . . . 10.32 111.962 -177.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.457 ' HB2' ' O ' ' A' ' 68' ' ' ALA . 44.3 t-80 51.25 51.8 10.95 Favored Pre-proline 0 CA--C 1.561 1.37 0 C-N-CA 123.743 0.817 . . . . 7.4699999999999998 110.272 -178.197 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.45 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 31.4 Cg_exo -61.11 -46.67 14.7 Favored 'Trans proline' 0 C--N 1.382 2.301 0 C-N-CA 121.481 1.454 . . . . 6.8099999999999996 110.79 -176.104 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 15.5 pttp -167.49 106.23 0.55 Allowed 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 115.196 -0.911 . . . . 7.3200000000000003 109.075 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.488 ' HA ' ' CG ' ' A' ' 85' ' ' LYS . . . -57.7 -54.7 43.94 Favored 'General case' 0 CA--C 1.564 1.518 0 N-CA-C 114.494 1.294 . . . . 4.5199999999999996 114.494 177.645 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 56.43 -94.73 0.05 OUTLIER 'General case' 0 N--CA 1.518 2.958 0 C-N-CA 124.455 1.102 . . . . 6.8200000000000003 113.136 -178.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.6 m -85.66 -17.03 9.72 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.746 0 CA-C-N 115.353 -0.84 . . . . 8.1500000000000004 110.894 -176.086 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.459 ' CG2' ' HG2' ' A' ' 85' ' ' LYS . 26.3 m -103.18 13.51 6.94 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.639 0 N-CA-C 109.079 -0.711 . . . . 5.6500000000000004 109.079 175.154 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.9 -12.91 28.31 Favored 'General case' 0 N--CA 1.489 1.483 0 CA-C-O 121.429 0.633 . . . . 4.2400000000000002 111.687 176.357 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 71.6 m -74.98 -11.59 60.14 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-N 115.803 -0.635 . . . . 5.5999999999999996 110.262 176.224 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.455 ' CE2' ' HB2' ' A' ' 83' ' ' HIS . 25.8 t80 -167.78 83.37 0.8 Allowed Pre-proline 0 N--CA 1.435 -1.198 0 N-CA-C 108.226 -1.027 . . . . 5.1299999999999999 108.226 172.108 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -63.07 11.26 0.09 OUTLIER 'Trans proline' 0 N--CA 1.498 1.741 0 C-N-CA 124.384 3.39 . . . . 3.27 116.053 -173.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.455 ' HB2' ' CE2' ' A' ' 81' ' ' PHE . 50.3 m170 -87.19 -1.62 58.03 Favored 'General case' 0 C--O 1.193 -1.908 0 N-CA-C 109.026 -0.731 . . . . 4.25 109.026 174.501 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 45.2 mt -101.54 0.17 36.05 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 113.556 0.947 . . . . 5.4699999999999998 113.556 -172.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.488 ' CG ' ' HA ' ' A' ' 75' ' ' ALA 0.314 21.9 mmmt -67.86 156.85 36.2 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 117.308 2.336 . . . . 8.0399999999999991 117.308 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.479 ' H ' ' HE3' ' A' ' 85' ' ' LYS . 14.0 mmmm . . . . . 0 C--N 1.297 -1.714 0 CA-C-N 111.753 -2.476 . . . . 11.1 108.068 -179.459 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.18 0 N-CA-C 111.409 -0.676 . . . . 19.140000000000001 111.409 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 37.0 m-70 -83.34 141.71 31.58 Favored 'General case' 0 C--O 1.247 0.932 0 CA-C-O 121.168 0.509 . . . . 19.739999999999998 110.912 -178.808 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 77.0 m-70 -93.12 157.98 16.0 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 115.723 -0.672 . . . . 17.670000000000002 109.498 -178.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 26.5 m80 68.05 83.63 0.16 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.183 0.993 . . . . 14.74 110.262 -179.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 13.6 p-80 -144.72 121.75 11.4 Favored 'General case' 0 C--O 1.207 -1.168 0 C-N-CA 119.724 -0.791 . . . . 14.24 111.588 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 35.7 m80 35.53 92.27 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.202 0 N-CA-C 115.181 1.549 . . . . 13.67 115.181 173.048 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 32.2 m-70 -105.7 152.64 22.9 Favored 'General case' 0 C--N 1.314 -0.948 0 O-C-N 121.643 -0.66 . . . . 10.300000000000001 112.599 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.49 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 2.7 pp -124.08 2.24 8.61 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 124.915 1.286 . . . . 10.1 108.622 174.72 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -112.76 129.52 56.39 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 105.128 -2.175 . . . . 11.869999999999999 105.128 -179.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 106.55 138.3 8.98 Favored Glycine 0 N--CA 1.431 -1.657 0 C-N-CA 120.918 -0.658 . . . . 9.5999999999999996 111.539 -177.213 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -154.88 170.44 33.13 Favored Glycine 0 N--CA 1.435 -1.371 0 N-CA-C 109.919 -1.272 . . . . 8.4499999999999993 109.919 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 110.02 -7.83 31.23 Favored Glycine 0 CA--C 1.502 -0.774 0 C-N-CA 120.716 -0.754 . . . . 9.2400000000000002 111.801 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 71.05 175.09 0.29 Allowed 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.252 1.021 . . . . 9.6799999999999997 112.026 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -147.85 26.89 0.99 Allowed 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 109.229 -0.656 . . . . 11.119999999999999 109.229 179.303 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 71.0 -64.33 0.38 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.083 1.353 . . . . 15.18 111.36 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 8.2 mtpm? -89.18 21.73 3.11 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 121.734 0.778 . . . . 15.42 110.086 179.057 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.508 ' HA ' ' HB3' ' A' ' 20' ' ' ALA . 4.7 p -76.02 -3.59 36.57 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.389 1.076 . . . . 11.210000000000001 113.59 -177.783 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -45.13 -48.09 12.2 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.466 1.106 . . . . 13.140000000000001 113.161 -176.416 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 88.0 mtp -121.61 3.86 10.13 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.304 0.574 . . . . 14.08 110.563 178.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.508 ' HB3' ' HA ' ' A' ' 17' ' ' SER . . . -86.82 -23.95 25.17 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.662 -0.699 . . . . 9.7699999999999996 110.1 -179.632 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.572 ' HA ' ' HE ' ' A' ' 21' ' ' ARG . 0.2 OUTLIER -101.76 -60.28 1.56 Allowed 'General case' 0 C--O 1.245 0.823 0 CA-C-N 116.224 -0.444 . . . . 10.289999999999999 110.348 178.747 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 67.59 -54.69 0.48 Allowed 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 124.893 1.277 . . . . 9.1500000000000004 113.7 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.49 ' HD2' ' HB3' ' A' ' 8' ' ' LEU . 23.9 ttmm -98.17 -72.99 0.63 Allowed 'General case' 0 N--CA 1.412 -2.361 0 C-N-CA 122.878 0.471 . . . . 11.119999999999999 110.179 -179.17 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.429 ' HB3' ' HB3' ' A' ' 21' ' ' ARG . 3.3 p-10 47.8 -174.32 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 126.782 2.033 . . . . 6.46 114.826 178.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 62.9 tp -90.39 127.11 36.1 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-N 115.233 -0.894 . . . . 6.8099999999999996 109.365 177.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -89.94 154.85 19.53 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.325 -0.852 . . . . 7.7000000000000002 110.778 -178.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.9 mtpm? -117.65 -83.67 0.64 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.241 0.543 . . . . 8.8599999999999994 109.927 177.607 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -104.54 171.16 7.48 Favored 'General case' 0 N--CA 1.433 -1.282 0 N-CA-C 109.071 -0.715 . . . . 6.4800000000000004 109.071 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.01 144.53 16.28 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.839 -0.619 . . . . 10.01 109.392 178.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -151.07 165.31 34.22 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 109.391 -0.596 . . . . 7.4299999999999997 109.391 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -145.04 139.83 27.69 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 108.47 -0.937 . . . . 8.1600000000000001 108.47 177.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 178.38 -159.0 24.07 Favored Glycine 0 N--CA 1.43 -1.761 0 N-CA-C 110.39 -1.084 . . . . 7.6900000000000004 110.39 -178.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -135.59 104.83 5.95 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.351 -0.611 . . . . 8.8599999999999994 109.351 -179.003 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -149.59 114.63 0.67 Allowed Glycine 0 N--CA 1.44 -1.038 0 C-N-CA 121.099 -0.572 . . . . 8.2799999999999994 111.803 -178.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 43.0 m -152.84 172.7 16.34 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.594 -1.261 . . . . 9.5299999999999994 107.594 179.261 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -154.88 134.42 12.68 Favored 'General case' 0 CA--C 1.502 -0.901 0 N-CA-C 109.945 -0.391 . . . . 11.91 109.945 -179.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 54.8 tp 69.63 -59.25 0.5 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.837 1.255 . . . . 10.08 111.004 -178.773 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -87.35 128.6 35.19 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 123.784 0.833 . . . . 7.8600000000000003 110.147 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -159.87 110.75 1.94 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.027 -0.731 . . . . 5.9199999999999999 109.027 178.813 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -108.92 21.04 17.75 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 120.907 0.384 . . . . 6.8799999999999999 111.968 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -78.81 13.51 1.67 Allowed 'General case' 0 N--CA 1.482 1.171 0 O-C-N 121.938 -0.476 . . . . 7.9500000000000002 112.264 -178.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -69.43 -19.75 63.79 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.19 0.519 . . . . 8.1699999999999999 110.985 -179.335 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -91.82 12.58 20.98 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 116.145 -0.48 . . . . 5.9299999999999997 111.64 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 47.2 tpp 75.33 -3.85 2.5 Favored 'General case' 0 N--CA 1.503 2.213 0 C-N-CA 124.486 1.114 . . . . 7.6200000000000001 111.757 178.309 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . 0.264 32.6 p 48.02 -98.74 0.05 OUTLIER 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 116.177 1.917 . . . . 3.9100000000000001 116.177 179.058 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.54 ' O ' ' HA ' ' A' ' 54' ' ' THR . 70.2 mt -127.32 127.07 68.77 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.251 0 N-CA-C 109.414 -0.587 . . . . 3.7599999999999998 109.414 -177.524 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.611 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 26.1 tt0 -99.52 133.38 43.93 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 109.133 -0.691 . . . . 6.79 109.133 -178.025 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.495 ' SG ' HG22 ' A' ' 50' ' ' VAL . 49.5 t -72.53 131.75 42.91 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 115.69 -0.687 . . . . 5.4299999999999997 112.584 -177.465 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 5.9 ttpt -52.9 -29.39 28.11 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 127.097 2.159 . . . . 5.9100000000000001 112.465 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.495 HG22 ' SG ' ' A' ' 48' ' ' CYS . 14.6 m -63.58 -27.78 43.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.984 -0.553 . . . . 7.9400000000000004 112.223 -172.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 48.2 t -170.72 -77.5 0.02 OUTLIER 'General case' 0 N--CA 1.434 -1.267 0 CA-C-N 116.208 -0.451 . . . . 9.2799999999999994 110.047 -178.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.409 ' HG2' ' O ' ' A' ' 52' ' ' MET . 26.9 ttt -171.51 39.85 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.664 0 CA-C-O 121.965 0.888 . . . . 9.4399999999999995 109.817 -175.172 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.611 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 8.7 mm100 -92.52 -173.41 3.36 Favored 'General case' 0 C--O 1.203 -1.394 0 N-CA-C 108.38 -0.971 . . . . 9.1099999999999994 108.38 -177.785 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.54 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 9.6 t -139.21 161.81 36.51 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 118.111 -1.436 . . . . 5.9299999999999997 112.461 -177.589 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -141.1 148.62 40.42 Favored 'General case' 0 N--CA 1.433 -1.322 0 C-N-CA 126.244 1.818 . . . . 5.2699999999999996 106.527 178.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.1 tp -70.43 136.37 26.16 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.694 0 CA-C-O 121.061 0.458 . . . . 5.2300000000000004 111.975 -177.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 16.6 p -81.68 76.66 8.58 Favored 'General case' 0 N--CA 1.423 -1.78 0 CA-C-O 121.811 0.815 . . . . 4.21 110.534 175.096 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.5 m -63.46 -8.59 9.66 Favored 'General case' 0 CA--C 1.568 1.659 0 CA-C-N 114.817 -1.083 . . . . 6.0099999999999998 110.752 175.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.424 HG22 ' H ' ' A' ' 60' ' ' SER . 32.9 m -146.21 172.99 12.63 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 105.555 -2.017 . . . . 6.1900000000000004 105.555 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.424 ' H ' HG22 ' A' ' 59' ' ' THR . 12.5 m -74.54 15.85 0.32 Allowed 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 118.987 0.812 . . . . 6.4699999999999998 112.233 -174.302 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.428 ' CD ' HH21 ' A' ' 65' ' ' ARG . 35.1 tt0 63.1 -61.67 0.13 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 125.195 1.398 . . . . 4.8600000000000003 112.066 -177.246 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.0 p -61.06 -28.28 43.37 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.966 0 C-N-CA 123.679 0.792 . . . . 7.2300000000000004 110.735 -176.161 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.409 ' HD3' ' O ' ' A' ' 63' ' ' LYS . 5.7 tmtt? -66.2 -41.78 89.69 Favored 'General case' 0 C--O 1.249 1.078 0 N-CA-C 107.142 -1.429 . . . . 9.3599999999999994 107.142 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 55.6 m -66.16 -33.52 75.96 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 114.663 -1.153 . . . . 5.9000000000000004 108.073 176.34 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.649 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 94.0 mtt180 -62.01 -37.49 85.07 Favored 'General case' 0 C--O 1.199 -1.559 0 CA-C-N 115.405 -0.816 . . . . 7.6900000000000004 111.769 178.552 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -56.37 -50.26 72.07 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.642 0.734 . . . . 9.7799999999999994 109.227 -179.364 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.414 ' CD2' ' HA ' ' A' ' 86' ' ' LYS . 76.4 t60 -68.37 -32.13 71.99 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 114.517 -1.219 . . . . 8.9700000000000006 111.229 -179.573 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.8 -44.66 31.84 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 112.475 0.546 . . . . 6.5300000000000002 112.475 -175.534 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.649 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 11.5 mm-40 -63.51 -32.66 74.18 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.362 0.601 . . . . 8.5 109.467 -178.154 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -88.74 7.97 31.17 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-N 115.312 -0.858 . . . . 9.4100000000000001 111.628 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -144.17 -85.56 0.14 Allowed 'General case' 0 CA--C 1.508 -0.651 0 C-N-CA 122.501 0.321 . . . . 10.32 111.852 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.408 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 29.4 p80 43.05 57.88 11.74 Favored Pre-proline 0 CA--C 1.554 1.128 0 C-N-CA 124.013 0.925 . . . . 7.4699999999999998 112.338 -177.143 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.512 ' HD2' ' HD2' ' A' ' 85' ' ' LYS . 53.6 Cg_exo -54.92 -36.53 92.13 Favored 'Trans proline' 0 C--N 1.37 1.68 0 C-N-CA 122.934 2.423 . . . . 6.8099999999999996 113.694 -175.403 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 63.5 pttt -171.86 -40.41 0.02 OUTLIER 'General case' 0 C--N 1.348 0.518 0 N-CA-C 113.3 0.852 . . . . 7.3200000000000003 113.3 -178.43 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.583 ' HB1' ' HA ' ' A' ' 79' ' ' ALA . . . 76.03 108.66 0.08 Allowed 'General case' 0 C--O 1.212 -0.892 0 C-N-CA 124.387 1.075 . . . . 4.5199999999999996 109.326 -172.336 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.415 ' HB2' ' H ' ' A' ' 77' ' ' VAL . 1.7 m-20 -87.47 -105.58 0.07 Allowed 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 113.899 -1.501 . . . . 6.8200000000000003 110.102 -169.327 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.415 ' H ' ' HB2' ' A' ' 76' ' ' ASP . 26.8 m -86.41 -7.65 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.838 0 N-CA-C 107.56 -1.274 . . . . 8.1500000000000004 107.56 170.825 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.409 HG22 ' H ' ' A' ' 76' ' ' ASP . 28.6 m -90.75 14.4 1.45 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.505 0 CA-C-N 113.766 -1.561 . . . . 5.6500000000000004 109.266 177.2 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.583 ' HA ' ' HB1' ' A' ' 75' ' ' ALA . . . -71.35 1.05 6.77 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 122.079 0.942 . . . . 4.2400000000000002 110.176 176.87 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.413 ' HB2' ' SG ' ' A' ' 48' ' ' CYS . 19.9 p -75.76 -22.14 56.77 Favored 'General case' 0 N--CA 1.423 -1.778 0 CA-C-N 114.217 -1.356 . . . . 5.5999999999999996 109.503 174.188 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.519 ' HD2' ' HG ' ' A' ' 84' ' ' LEU . 27.2 t80 -157.57 91.32 2.31 Favored Pre-proline 0 C--N 1.309 -1.163 0 N-CA-C 106.413 -1.699 . . . . 5.1299999999999999 106.413 170.59 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -62.04 5.13 0.24 Allowed 'Trans proline' 0 N--CA 1.491 1.326 0 C-N-CA 123.762 2.975 . . . . 3.27 115.41 -172.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.433 ' HB2' ' CE2' ' A' ' 81' ' ' PHE . 76.7 m-70 -100.85 9.99 41.67 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 108.789 -0.819 . . . . 4.25 108.789 177.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.519 ' HG ' ' HD2' ' A' ' 81' ' ' PHE . 60.8 mt -111.31 1.43 17.1 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 115.691 -0.686 . . . . 5.4699999999999998 111.254 178.448 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.755 ' HD3' ' H ' ' A' ' 86' ' ' LYS . 5.7 tmtm? -74.58 157.55 35.24 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 105.509 -2.034 . . . . 8.0399999999999991 105.509 177.375 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.755 ' H ' ' HD3' ' A' ' 85' ' ' LYS . 23.5 pttm . . . . . 0 C--N 1.248 -3.833 0 CA-C-O 117.523 -1.227 . . . . 11.1 110.88 -174.625 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.699 0 N-CA-C 111.349 -0.7 . . . . 19.140000000000001 111.349 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 42.0 m80 73.14 127.52 0.04 OUTLIER 'General case' 0 C--N 1.349 0.583 0 C-N-CA 124.263 1.025 . . . . 19.739999999999998 111.971 -178.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 74.98 -168.01 0.09 Allowed 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.97 0.908 . . . . 17.670000000000002 110.184 -177.239 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -93.42 166.89 12.06 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.579 -0.448 . . . . 14.74 111.253 -176.443 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -73.41 -28.67 62.12 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 112.596 0.591 . . . . 14.24 112.596 -177.535 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 46.0 m80 -123.18 130.97 53.47 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 120.251 -0.579 . . . . 13.67 111.232 -177.735 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 60.9 t60 -134.75 119.89 18.77 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.136 -0.484 . . . . 10.300000000000001 109.937 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.0 tt 68.56 -64.64 0.3 Allowed 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 125.696 1.598 . . . . 10.1 112.484 178.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -75.61 21.35 0.15 Allowed 'General case' 0 N--CA 1.486 1.336 0 CA-C-O 121.281 0.563 . . . . 11.869999999999999 112.213 -176.386 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -118.46 -40.51 0.67 Allowed Glycine 0 N--CA 1.424 -2.122 0 CA-C-N 115.884 -0.598 . . . . 9.5999999999999996 112.619 -178.678 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 78.23 -131.56 11.0 Favored Glycine 0 CA--C 1.505 -0.585 0 C-N-CA 120.418 -0.896 . . . . 8.4499999999999993 111.199 -176.844 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 76.74 62.53 2.5 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.65 -0.786 . . . . 9.2400000000000002 113.822 177.195 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 39.2 t30 -80.0 102.63 9.37 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 108.618 -0.882 . . . . 9.6799999999999997 108.618 175.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -141.38 91.55 2.39 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.074 0.464 . . . . 11.119999999999999 110.206 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 52.3 mt-30 64.23 169.23 0.17 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.35 1.06 . . . . 15.18 110.755 -177.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.428 ' HB2' ' HZ2' ' A' ' 16' ' ' LYS . 0.1 OUTLIER 60.65 24.06 13.85 Favored 'General case' 0 N--CA 1.486 1.337 0 CA-C-O 121.588 0.709 . . . . 15.42 109.719 -177.291 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.2 m -65.2 -3.42 3.87 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.55 1.14 . . . . 11.210000000000001 112.957 -175.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.61 -35.5 81.0 Favored 'General case' 0 N--CA 1.439 -1.017 0 N-CA-C 109.405 -0.591 . . . . 13.140000000000001 109.405 175.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 89.1 mtp -126.28 -19.1 4.77 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 112.557 0.577 . . . . 14.08 112.557 178.176 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.9 -7.95 49.37 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 112.456 0.539 . . . . 9.7699999999999996 112.456 -178.58 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 85.3 mtm180 -100.08 -17.79 17.29 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.365 0.602 . . . . 10.289999999999999 109.815 176.464 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.13 133.24 39.05 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 115.825 -0.625 . . . . 9.1500000000000004 109.453 -178.151 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.579 ' H ' ' HG3' ' A' ' 27' ' ' LYS . 40.2 tttp 71.13 -38.68 0.43 Allowed 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 125.755 1.622 . . . . 11.119999999999999 112.107 -178.714 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 53.8 t30 -57.09 -74.79 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.718 1.207 . . . . 6.46 112.513 -176.336 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.4 mt -115.42 -83.06 0.62 Allowed 'General case' 0 C--O 1.244 0.777 0 C-N-CA 120.27 -0.572 . . . . 6.8099999999999996 112.257 -178.142 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -103.78 117.43 34.34 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 121.533 0.682 . . . . 7.7000000000000002 111.247 179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.579 ' HG3' ' H ' ' A' ' 23' ' ' LYS . 2.9 mppt? -83.42 97.79 9.15 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 114.949 -1.023 . . . . 8.8599999999999994 111.067 -176.425 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.19 118.14 18.61 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.458 -0.792 . . . . 6.4800000000000004 111.169 -179.078 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -137.74 133.8 34.55 Favored 'General case' 0 C--N 1.312 -1.033 0 C-N-CA 123.874 0.869 . . . . 10.01 108.709 176.451 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -133.0 8.89 4.1 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.048 0.452 . . . . 7.4299999999999997 111.066 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -107.53 100.2 9.64 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-O 120.889 0.376 . . . . 8.1600000000000001 110.927 -177.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -102.36 -85.32 1.86 Allowed Glycine 0 C--O 1.219 -0.844 0 N-CA-C 111.37 -0.692 . . . . 7.6900000000000004 111.37 178.111 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -91.39 26.05 2.38 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 121.13 0.49 . . . . 8.8599999999999994 109.982 178.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -78.79 100.24 1.7 Allowed Glycine 0 N--CA 1.443 -0.894 0 N-CA-C 111.183 -0.767 . . . . 8.2799999999999994 111.183 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.0 p -61.3 -45.23 95.32 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 123.07 0.548 . . . . 9.5299999999999994 111.211 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -171.2 105.18 0.23 Allowed 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 105.496 -2.039 . . . . 11.91 105.496 176.215 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 66.9 tp 68.52 -78.36 0.04 OUTLIER 'General case' 0 C--O 1.252 1.197 0 C-N-CA 123.856 0.862 . . . . 10.08 111.556 -178.17 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 53.61 83.43 0.07 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.498 0.719 . . . . 7.8600000000000003 111.417 -175.731 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -75.52 124.61 27.48 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-N 115.924 -0.58 . . . . 5.9199999999999999 111.417 -176.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 86.0 m-20 64.98 -175.06 0.17 Allowed 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 115.262 -0.881 . . . . 6.8799999999999999 111.281 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm 68.41 4.66 4.35 Favored 'General case' 0 N--CA 1.502 2.154 0 C-N-CA 124.543 1.137 . . . . 7.9500000000000002 110.741 175.282 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 17.1 ttmm -93.17 10.86 29.99 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 122.017 0.913 . . . . 8.1699999999999999 109.064 -172.319 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -98.6 9.43 43.28 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.027 -0.988 . . . . 5.9299999999999997 110.569 -177.176 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.403 ' HA ' HG21 ' A' ' 54' ' ' THR . 66.5 mtt 62.21 74.55 0.43 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.478 -0.783 . . . . 7.6200000000000001 110.387 -176.154 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.434 ' HB3' ' CB ' ' A' ' 57' ' ' CYS . 31.0 m -52.33 -59.16 4.74 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 114.16 -1.382 . . . . 3.9100000000000001 112.757 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.543 HG13 ' HB2' ' A' ' 57' ' ' CYS . 65.6 mt -127.88 128.39 69.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 109.294 -0.632 . . . . 3.7599999999999998 109.294 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.6 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 1.6 tp60 -100.12 124.68 45.8 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 107.116 -1.439 . . . . 6.79 107.116 178.756 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.656 ' SG ' HG22 ' A' ' 50' ' ' VAL . 26.9 t -59.7 122.45 14.17 Favored 'General case' 0 C--N 1.307 -1.239 0 C-N-CA 124.135 0.974 . . . . 5.4299999999999997 111.394 -176.572 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.577 ' HD2' ' O ' ' A' ' 49' ' ' LYS . 1.5 tmmm? -52.02 -31.72 30.94 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 125.363 1.465 . . . . 5.9100000000000001 111.411 -178.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.656 HG22 ' SG ' ' A' ' 48' ' ' CYS . 7.4 m -63.8 -28.15 44.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 112.176 0.435 . . . . 7.9400000000000004 112.176 -174.633 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 54.1 t -161.17 -77.62 0.05 Allowed 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 120.969 -0.292 . . . . 9.2799999999999994 110.863 -178.031 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.464 ' HG2' ' O ' ' A' ' 52' ' ' MET . 50.1 ttm -178.24 36.55 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.039 0 CA-C-O 121.523 0.678 . . . . 9.4399999999999995 109.941 -176.562 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.6 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 10.5 mm100 -91.99 178.73 5.8 Favored 'General case' 0 C--O 1.188 -2.145 0 O-C-N 121.13 -0.981 . . . . 9.1099999999999994 109.569 -177.515 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.517 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 27.6 m -128.01 141.35 51.54 Favored 'General case' 0 N--CA 1.413 -2.276 0 C-N-CA 118.12 -1.432 . . . . 5.9299999999999997 113.385 -173.371 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -126.24 172.55 9.98 Favored 'General case' 0 C--O 1.242 0.677 0 C-N-CA 125.275 1.43 . . . . 5.2699999999999996 107.823 174.149 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.436 HD13 ' N ' ' A' ' 57' ' ' CYS . 0.1 OUTLIER -96.63 132.29 41.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 N-CA-C 109.434 -0.58 . . . . 5.2300000000000004 109.434 -176.585 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.543 ' HB2' HG13 ' A' ' 46' ' ' ILE . 11.4 t -103.87 85.62 2.45 Favored 'General case' 0 N--CA 1.425 -1.704 0 N-CA-C 106.811 -1.551 . . . . 4.21 106.811 176.475 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 11.2 t -56.17 1.69 0.02 OUTLIER 'General case' 0 CA--C 1.579 2.072 0 N-CA-C 115.413 1.634 . . . . 6.0099999999999998 115.413 178.262 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 14.9 t -155.33 -164.91 1.87 Allowed 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 106.919 -1.512 . . . . 6.1900000000000004 106.919 178.025 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 41.6 t -85.05 135.39 34.02 Favored 'General case' 0 C--N 1.281 -2.375 0 N-CA-C 107.686 -1.227 . . . . 6.4699999999999998 107.686 175.798 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.565 ' O ' ' HG3' ' A' ' 65' ' ' ARG . 42.3 tt0 -56.49 -26.89 55.69 Favored 'General case' 0 C--O 1.196 -1.76 0 N-CA-C 110.244 -0.28 . . . . 4.8600000000000003 110.244 177.039 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 86.5 t -67.09 -30.31 49.02 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 O-C-N 122.06 -0.4 . . . . 7.2300000000000004 110.722 179.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -71.89 -33.16 68.12 Favored 'General case' 0 C--O 1.257 1.457 0 N-CA-C 107.155 -1.424 . . . . 9.3599999999999994 107.155 178.487 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' CYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 61' ' ' GLU . 82.1 m -69.21 -40.93 77.71 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-N 114.249 -1.342 . . . . 5.9000000000000004 109.732 173.339 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.565 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 96.0 mtt180 -60.38 -50.69 72.59 Favored 'General case' 0 CA--C 1.508 -0.642 0 C-N-CA 123.271 0.628 . . . . 7.6900000000000004 112.09 -177.716 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -62.49 -33.98 75.96 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.208 0.527 . . . . 9.7799999999999994 110.687 -179.42 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 41.4 t60 -75.34 -31.81 60.69 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.093 -0.503 . . . . 8.9700000000000006 110.936 178.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -73.66 -44.83 55.75 Favored 'General case' 0 CA--C 1.483 -1.615 0 N-CA-C 109.784 -0.45 . . . . 6.5300000000000002 109.784 179.09 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -71.74 -7.64 49.37 Favored 'General case' 0 C--N 1.315 -0.902 0 O-C-N 123.541 0.525 . . . . 8.5 111.155 178.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.74 -54.32 4.99 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.731 -0.668 . . . . 9.4100000000000001 109.862 172.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . 0.643 ' HG3' ' OXT' ' A' ' 86' ' ' LYS . 12.3 mmmm -88.05 -77.54 0.35 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.693 -0.685 . . . . 10.32 111.221 -177.36 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.25 54.7 p-80 40.85 63.62 5.58 Favored Pre-proline 0 N--CA 1.468 0.463 0 N-CA-C 115.087 1.514 . . . . 7.4699999999999998 115.087 -177.183 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -83.12 -61.04 0.02 OUTLIER 'Trans proline' 0 N--CA 1.431 -2.171 0 C-N-CA 120.951 1.101 . . . . 6.8099999999999996 111.466 176.546 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 13.7 pttm -161.32 120.4 2.5 Favored 'General case' 0 N--CA 1.411 -2.421 0 N-CA-C 108.037 -1.097 . . . . 7.3200000000000003 108.037 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.501 ' O ' ' HB2' ' A' ' 79' ' ' ALA . . . -73.6 100.78 3.42 Favored 'General case' 0 C--N 1.286 -2.172 0 N-CA-C 108.752 -0.833 . . . . 4.5199999999999996 108.752 175.058 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -95.19 -91.82 0.21 Allowed 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.448 0.642 . . . . 6.8200000000000003 111.272 -177.192 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.1 m -79.54 -13.81 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.073 0 N-CA-C 108.151 -1.055 . . . . 8.1500000000000004 108.151 176.237 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.637 HG21 ' HA ' ' A' ' 85' ' ' LYS . 13.9 m -92.95 9.32 4.4 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.874 0 CA-C-N 114.635 -1.166 . . . . 5.6500000000000004 108.603 176.424 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.501 ' HB2' ' O ' ' A' ' 75' ' ' ALA . . . -69.33 -11.15 60.57 Favored 'General case' 0 C--O 1.253 1.249 0 CA-C-O 121.104 0.478 . . . . 4.2400000000000002 111.638 178.793 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 66.4 m -79.96 -23.43 41.66 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 115.627 -0.715 . . . . 5.5999999999999996 109.122 174.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 3.7 p90 -140.74 67.39 28.95 Favored Pre-proline 0 CA--C 1.556 1.173 0 C-N-CA 124.547 1.139 . . . . 5.1299999999999999 111.334 178.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' PRO . . . . . 0.432 ' O ' ' HG3' ' A' ' 85' ' ' LYS . 19.7 Cg_exo -69.03 7.45 0.79 Allowed 'Trans proline' 0 C--N 1.366 1.478 0 C-N-CA 123.645 2.897 . . . . 3.27 114.013 -174.851 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 49.5 m170 -90.84 -7.27 52.77 Favored 'General case' 0 C--O 1.202 -1.413 0 N-CA-C 109.171 -0.677 . . . . 4.25 109.171 177.463 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.447 ' HB3' ' HB3' ' A' ' 64' ' ' CYS . 0.2 OUTLIER -133.51 45.5 2.67 Favored 'General case' 0 N--CA 1.42 -1.929 0 CA-C-N 114.921 -1.036 . . . . 5.4699999999999998 110.348 178.116 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.637 ' HA ' HG21 ' A' ' 78' ' ' VAL . 98.5 mttt -44.28 -26.03 0.29 Allowed 'General case' 0 CA--C 1.579 2.09 0 N-CA-C 114.822 1.415 . . . . 8.0399999999999991 114.822 177.009 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.643 ' OXT' ' HG3' ' A' ' 71' ' ' LYS . 23.4 tptm . . . . . 0 N--CA 1.497 1.879 0 N-CA-C 114.053 1.131 . . . . 11.1 114.053 170.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.46 0.264 0 N-CA-C 111.838 -0.505 . . . . 19.140000000000001 111.838 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 49.9 t-80 -65.66 -25.75 67.49 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.22 1.008 . . . . 19.739999999999998 112.664 -176.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 38.8 m-70 80.7 146.62 0.09 Allowed 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 125.022 1.329 . . . . 17.670000000000002 108.872 -171.72 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 5.4 p-80 -159.29 143.99 15.5 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.684 -0.487 . . . . 14.74 109.684 178.098 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.401 ' O ' ' HB3' ' A' ' 6' ' ' HIS . 32.4 m-70 -104.1 -18.92 14.35 Favored 'General case' 0 C--N 1.308 -1.218 0 O-C-N 122.993 0.183 . . . . 14.24 111.141 179.756 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.401 ' HB3' ' O ' ' A' ' 5' ' ' HIS . 52.0 t-80 75.78 112.04 0.07 Allowed 'General case' 0 C--O 1.211 -0.923 0 O-C-N 124.2 0.937 . . . . 13.67 110.206 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.9 t-80 -64.77 -44.57 89.61 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.847 -0.615 . . . . 10.300000000000001 112.0 -173.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 59.4 tp 69.82 -78.83 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.115 0.966 . . . . 10.1 112.56 176.307 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -91.26 133.53 35.32 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.703 -0.851 . . . . 11.869999999999999 108.703 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.1 74.98 1.08 Allowed Glycine 0 C--N 1.29 -1.999 0 N-CA-C 109.106 -1.598 . . . . 9.5999999999999996 109.106 -174.446 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -100.33 58.06 0.76 Allowed Glycine 0 C--N 1.304 -1.232 0 C-N-CA 121.121 -0.561 . . . . 8.4499999999999993 112.479 -177.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -86.61 -1.11 85.8 Favored Glycine 0 C--O 1.215 -1.037 0 C-N-CA 120.945 -0.645 . . . . 9.2400000000000002 112.692 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.4 p30 59.2 -179.2 0.08 Allowed 'General case' 0 N--CA 1.505 2.319 0 C-N-CA 126.619 1.968 . . . . 9.6799999999999997 111.378 -178.161 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -151.12 57.74 0.9 Allowed 'General case' 0 C--O 1.24 0.588 0 O-C-N 121.957 -0.465 . . . . 11.119999999999999 111.68 -178.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 64.12 -87.2 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 113.979 1.103 . . . . 15.18 113.979 175.075 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.4 pttt -84.91 19.49 2.09 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.331 0.586 . . . . 15.42 110.766 -177.527 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 69.8 p -81.54 32.05 0.35 Allowed 'General case' 0 N--CA 1.44 -0.943 0 C-N-CA 123.389 0.676 . . . . 11.210000000000001 109.806 177.397 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.461 ' O ' ' HG2' ' A' ' 21' ' ' ARG . . . -53.71 -42.48 68.1 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.475 0.71 . . . . 13.140000000000001 111.854 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 66.2 mtt -94.79 -13.04 25.99 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.836 0.351 . . . . 14.08 111.23 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.81 -10.86 46.58 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.094 0.473 . . . . 9.7699999999999996 110.806 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.461 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 10.5 ptp180 -88.32 -7.26 57.0 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 109.663 -0.495 . . . . 10.289999999999999 109.663 178.876 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.6 -39.68 77.4 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.086 -0.961 . . . . 9.1500000000000004 111.747 -178.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.9 mtmp? -139.43 98.64 3.54 Favored 'General case' 0 CA--C 1.484 -1.576 0 N-CA-C 112.806 0.669 . . . . 11.119999999999999 112.806 178.439 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -141.04 -70.76 0.37 Allowed 'General case' 0 C--N 1.3 -1.554 0 CA-C-N 115.858 -0.61 . . . . 6.46 109.96 175.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 58.5 tp -96.76 -83.27 0.39 Allowed 'General case' 0 CA--C 1.551 0.99 0 CA-C-O 120.881 0.372 . . . . 6.8099999999999996 110.829 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -141.7 163.57 32.55 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 108.006 -1.109 . . . . 7.7000000000000002 108.006 178.377 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.7 pttt -118.79 -42.4 2.73 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 123.334 0.396 . . . . 8.8599999999999994 111.938 -179.267 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -130.76 106.4 8.43 Favored 'General case' 0 CA--C 1.516 -0.357 0 O-C-N 121.93 -0.481 . . . . 6.4800000000000004 111.368 -179.028 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -125.29 -11.43 6.93 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 121.315 0.578 . . . . 10.01 109.802 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -155.82 160.6 40.37 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 108.83 -0.804 . . . . 7.4299999999999997 108.83 -177.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -92.99 100.59 13.0 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 123.368 0.418 . . . . 8.1600000000000001 110.884 -178.439 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -71.41 -42.31 56.65 Favored Glycine 0 C--O 1.219 -0.788 0 CA-C-N 115.967 -0.561 . . . . 7.6900000000000004 112.09 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 96.0 mttt 63.72 15.56 9.08 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 124.149 0.98 . . . . 8.8599999999999994 113.226 177.612 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 152.25 84.0 0.04 OUTLIER Glycine 0 C--O 1.244 0.758 0 C-N-CA 120.54 -0.838 . . . . 8.2799999999999994 111.768 178.113 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 22.4 t -81.86 92.52 6.71 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-O 122.225 1.012 . . . . 9.5299999999999994 111.042 -176.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 98.8 mt-30 -138.84 -48.27 0.5 Allowed 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 106.573 -1.64 . . . . 11.91 106.573 175.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.2 mp -106.78 -57.52 2.05 Favored 'General case' 0 N--CA 1.436 -1.13 0 N-CA-C 106.804 -1.554 . . . . 10.08 106.804 173.449 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 67.46 92.88 0.08 Allowed 'General case' 0 C--N 1.351 0.644 0 C-N-CA 124.962 1.305 . . . . 7.8600000000000003 110.619 177.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -120.95 127.33 51.72 Favored 'General case' 0 C--O 1.241 0.658 0 CA-C-N 115.49 -0.777 . . . . 5.9199999999999999 111.905 -174.506 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -75.49 137.75 41.11 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.245 -0.889 . . . . 6.8799999999999999 112.0 -179.252 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -113.98 -17.76 11.9 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.042 -1.095 . . . . 7.9500000000000002 108.042 173.513 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt 65.32 -59.85 0.26 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.678 1.591 . . . . 8.1699999999999999 112.635 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.421 ' C ' ' H ' ' A' ' 45' ' ' SER . . . -88.65 15.15 8.56 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 112.138 0.422 . . . . 5.9299999999999997 112.138 -177.507 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . 0.262 23.1 ptp 60.11 -23.36 0.03 OUTLIER 'General case' 0 N--CA 1.516 2.858 0 C-N-CA 127.252 2.221 . . . . 7.6200000000000001 115.682 179.431 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.421 ' H ' ' C ' ' A' ' 43' ' ' ALA . 41.2 m 70.47 -101.07 0.04 OUTLIER 'General case' 0 N--CA 1.413 -2.295 0 N-CA-C 114.91 1.448 . . . . 3.9100000000000001 114.91 176.112 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.469 ' O ' ' HA ' ' A' ' 54' ' ' THR . 66.3 mt -133.52 148.45 30.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 N-CA-C 110.169 -0.308 . . . . 3.7599999999999998 110.169 -172.749 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.592 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 46.3 tt0 -110.6 143.69 40.62 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 123.417 0.687 . . . . 6.79 109.993 177.6 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.546 ' SG ' HG22 ' A' ' 50' ' ' VAL . 49.0 t -82.55 129.92 35.02 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 122.986 0.514 . . . . 5.4299999999999997 111.214 178.356 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.404 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -52.5 -35.19 52.47 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 127.791 2.436 . . . . 5.9100000000000001 110.617 -178.943 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.546 HG22 ' SG ' ' A' ' 48' ' ' CYS . 9.6 m -58.32 -23.46 22.24 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 N-CA-C 112.798 0.666 . . . . 7.9400000000000004 112.798 -174.376 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.8 t -172.11 -86.27 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.846 0 O-C-N 123.473 0.483 . . . . 9.2799999999999994 110.532 179.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.461 ' HA ' ' CG ' ' A' ' 47' ' ' GLN . 50.0 ttp -164.68 40.51 0.08 Allowed 'General case' 0 C--O 1.239 0.544 0 CA-C-O 122.67 1.224 . . . . 9.4399999999999995 110.207 -178.062 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.592 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 8.3 mm100 -86.97 -167.77 2.0 Favored 'General case' 0 C--O 1.205 -1.25 0 N-CA-C 108.22 -1.029 . . . . 9.1099999999999994 108.22 -177.546 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 12.9 t -144.42 154.57 43.1 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 117.536 -1.665 . . . . 5.9299999999999997 112.955 -176.271 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -130.46 162.79 28.4 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 106.116 -1.809 . . . . 5.2699999999999996 106.116 176.07 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.569 HD13 ' H ' ' A' ' 57' ' ' CYS . 0.3 OUTLIER -88.96 148.53 4.47 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 108.083 -1.08 . . . . 5.2300000000000004 108.083 -177.264 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.569 ' H ' HD13 ' A' ' 56' ' ' ILE . 20.7 p -76.69 77.36 3.34 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 121.45 0.643 . . . . 4.21 111.485 179.088 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 31.7 p -60.28 -26.89 66.84 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.675 -1.148 . . . . 6.0099999999999998 111.18 174.548 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.523 ' HB ' ' SG ' ' A' ' 64' ' ' CYS . 16.3 m -143.38 173.04 11.97 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 107.178 -1.415 . . . . 6.1900000000000004 107.178 -177.327 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' SER . . . . . 0.455 ' H ' HG22 ' A' ' 59' ' ' THR . 5.4 m -76.47 18.52 0.31 Allowed 'General case' 0 CA--C 1.556 1.191 0 N-CA-C 112.875 0.695 . . . . 6.4699999999999998 112.875 -174.25 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 64.04 -62.16 0.17 Allowed 'General case' 0 N--CA 1.503 2.221 0 C-N-CA 125.375 1.47 . . . . 4.8600000000000003 111.24 -176.048 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.671 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 92.9 t -57.01 -36.42 50.75 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.477 0 C-N-CA 123.966 0.906 . . . . 7.2300000000000004 111.575 -178.026 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.475 ' HA ' ' CG ' ' A' ' 66' ' ' GLU . 4.5 mptp? -68.28 -25.93 65.4 Favored 'General case' 0 C--O 1.244 0.815 0 CA-C-O 122.076 0.941 . . . . 9.3599999999999994 112.296 177.665 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' CYS . . . . . 0.523 ' SG ' ' HB ' ' A' ' 59' ' ' THR . 57.3 m -77.41 -38.78 49.01 Favored 'General case' 0 C--N 1.272 -2.765 0 N-CA-C 107.029 -1.471 . . . . 5.9000000000000004 107.029 175.089 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.487 ' HD3' ' HA ' ' A' ' 62' ' ' VAL . 57.5 mtp180 -63.53 -38.39 90.96 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 114.234 -1.348 . . . . 7.6900000000000004 111.763 178.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.671 ' HG2' ' O ' ' A' ' 62' ' ' VAL . 5.0 mm-40 -52.6 -55.17 24.26 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 107.471 -1.307 . . . . 9.7799999999999994 107.471 176.423 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.49 ' CD2' ' HA ' ' A' ' 86' ' ' LYS . 48.8 t60 -76.14 -17.06 59.74 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-N 114.327 -1.306 . . . . 8.9700000000000006 111.396 -176.81 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -77.92 -40.4 39.78 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 122.038 -0.414 . . . . 6.5300000000000002 109.949 179.088 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -68.83 -16.97 63.93 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.76 0.79 . . . . 8.5 109.748 177.149 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 67' ' ' HIS . . . -75.08 -18.24 60.32 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 114.568 -1.196 . . . . 9.4100000000000001 112.058 175.194 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -141.04 -83.67 0.21 Allowed 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 111.987 0.366 . . . . 10.32 111.987 -178.051 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' HIS . . . . . 0.535 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 27.1 p80 44.48 43.43 1.2 Allowed Pre-proline 0 N--CA 1.507 2.383 0 C-N-CA 125.732 1.613 . . . . 7.4699999999999998 114.682 -179.523 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.535 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 7.5 Cg_exo -71.88 -52.33 0.2 Allowed 'Trans proline' 0 C--N 1.368 1.57 0 C-N-CA 121.48 1.453 . . . . 6.8099999999999996 111.818 -176.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -154.84 122.09 5.61 Favored 'General case' 0 N--CA 1.404 -2.743 0 N-CA-C 107.751 -1.203 . . . . 7.3200000000000003 107.751 -178.716 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.06 120.78 30.77 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 107.88 -1.156 . . . . 4.5199999999999996 107.88 171.376 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -96.95 -90.55 0.25 Allowed 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.31 0.576 . . . . 6.8200000000000003 111.678 -172.542 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.2 m -86.66 -12.01 11.0 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 CA-C-O 122.259 1.028 . . . . 8.1500000000000004 108.595 176.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.485 HG21 ' HA ' ' A' ' 85' ' ' LYS . 27.6 m -96.6 12.2 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 CA-C-N 113.954 -1.475 . . . . 5.6500000000000004 108.94 176.827 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.94 -3.42 3.44 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-O 121.46 0.648 . . . . 4.2400000000000002 110.951 177.488 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 17.8 p -71.11 -28.45 64.32 Favored 'General case' 0 N--CA 1.426 -1.643 0 CA-C-N 115.039 -0.982 . . . . 5.5999999999999996 109.717 175.385 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -155.94 92.38 2.63 Favored Pre-proline 0 N--CA 1.44 -0.951 0 N-CA-C 107.195 -1.409 . . . . 5.1299999999999999 107.195 171.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -63.49 8.4 0.15 Allowed 'Trans proline' 0 N--CA 1.5 1.904 0 C-N-CA 124.462 3.441 . . . . 3.27 114.603 -173.051 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -101.25 7.45 42.94 Favored 'General case' 0 C--N 1.287 -2.109 0 C-N-CA 120.469 -0.492 . . . . 4.25 110.022 176.444 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 37.6 mt -117.58 9.32 13.12 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 116.422 -0.353 . . . . 5.4699999999999998 111.267 -178.503 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.485 ' HA ' HG21 ' A' ' 78' ' ' VAL . 19.8 tptm -52.89 -46.54 68.0 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 115.314 1.598 . . . . 8.0399999999999991 115.314 -178.655 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.49 ' HA ' ' CD2' ' A' ' 67' ' ' HIS . 59.8 tttm . . . . . 0 C--N 1.353 0.728 0 O-C-N 123.381 0.426 . . . . 11.1 112.032 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.024 0 N-CA-C 112.351 -0.3 . . . . 19.140000000000001 112.351 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.6 t60 69.94 -52.27 0.63 Allowed 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 125.448 1.499 . . . . 19.739999999999998 111.118 -178.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -91.76 145.39 24.61 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.023 -1.103 . . . . 17.670000000000002 108.023 173.364 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 90.7 m-70 -126.11 -32.85 2.71 Favored 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 120.18 -0.608 . . . . 14.74 112.6 178.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 54.4 m80 -139.59 168.61 19.43 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 109.355 -0.609 . . . . 14.24 109.355 179.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.8 t-80 -87.56 -14.08 41.19 Favored 'General case' 0 C--N 1.321 -0.645 0 O-C-N 123.698 0.624 . . . . 13.67 109.38 177.216 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.8 p-80 -103.89 143.28 33.05 Favored 'General case' 0 C--O 1.21 -0.986 0 N-CA-C 109.17 -0.678 . . . . 10.300000000000001 109.17 178.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.0 tt 69.8 -72.61 0.1 Allowed 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.712 1.205 . . . . 10.1 111.414 176.483 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -58.46 -19.05 33.53 Favored 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 112.758 0.651 . . . . 11.869999999999999 112.758 -177.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -132.09 37.3 2.07 Favored Glycine 0 N--CA 1.443 -0.895 0 N-CA-C 111.191 -0.764 . . . . 9.5999999999999996 111.191 177.45 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -109.45 -9.91 24.5 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.709 -0.757 . . . . 8.4499999999999993 113.924 -177.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.3 -38.21 1.33 Allowed Glycine 0 CA--C 1.484 -1.883 0 N-CA-C 108.716 -1.753 . . . . 9.2400000000000002 108.716 -178.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 65.72 -76.74 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 125.02 1.328 . . . . 9.6799999999999997 113.201 173.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 58.53 176.34 0.07 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.637 1.175 . . . . 11.119999999999999 112.624 -177.145 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -139.32 11.41 2.56 Favored 'General case' 0 CA--C 1.508 -0.671 0 C-N-CA 120.051 -0.66 . . . . 15.18 111.557 178.185 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.7 mppt? -88.73 5.56 42.77 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 119.566 -0.854 . . . . 15.42 110.583 174.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 51.5 m 67.47 -41.61 0.43 Allowed 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 125.434 1.494 . . . . 11.210000000000001 114.525 177.212 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.33 -62.67 1.56 Allowed 'General case' 0 C--N 1.306 -1.299 0 C-N-CA 123.855 0.862 . . . . 13.140000000000001 112.485 -175.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' MET . . . . . 0.416 ' HA ' ' HB3' ' A' ' 22' ' ' ALA . 96.0 mmm -80.63 -9.88 59.76 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 116.307 -0.406 . . . . 14.08 111.801 -178.708 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.17 -46.97 81.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.491 0.663 . . . . 9.7699999999999996 110.016 -178.06 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -96.5 11.18 35.97 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.665 -0.698 . . . . 10.289999999999999 111.235 -179.305 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.416 ' HB3' ' HA ' ' A' ' 19' ' ' MET . . . -110.27 -53.12 2.72 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 116.238 -0.437 . . . . 9.1500000000000004 111.817 -178.071 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 50.0 tttp -83.48 -7.77 59.48 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.866 0.365 . . . . 11.119999999999999 110.342 -175.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 34.3 p-10 -62.87 163.38 9.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.656 -0.702 . . . . 6.46 111.624 -178.409 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 82.1 mt -88.95 114.46 25.6 Favored 'General case' 0 C--N 1.307 -1.261 0 C-N-CA 120.237 -0.585 . . . . 6.8099999999999996 111.324 -177.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -62.13 146.73 49.7 Favored 'General case' 0 C--N 1.291 -1.937 0 CA-C-N 113.823 -1.535 . . . . 7.7000000000000002 110.461 177.025 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.32 4.44 6.32 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.778 0.658 . . . . 8.8599999999999994 112.778 -176.844 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -152.57 153.85 34.23 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.304 -0.999 . . . . 6.4800000000000004 108.304 -179.213 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -112.7 -23.0 10.44 Favored 'General case' 0 C--N 1.316 -0.872 0 C-N-CA 120.853 -0.339 . . . . 10.01 111.421 -179.589 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 57.02 -152.34 0.4 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.647 0.779 . . . . 7.4299999999999997 111.847 177.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -123.4 173.16 8.17 Favored 'General case' 0 N--CA 1.438 -1.05 0 N-CA-C 108.109 -1.071 . . . . 8.1600000000000001 108.109 177.883 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 148.04 -14.4 1.31 Allowed Glycine 0 C--N 1.316 -0.556 0 C-N-CA 119.165 -1.493 . . . . 7.6900000000000004 112.815 -178.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -78.17 -28.31 48.21 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.525 -0.546 . . . . 8.8599999999999994 109.525 177.627 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.03 170.21 31.61 Favored Glycine 0 N--CA 1.431 -1.671 0 N-CA-C 108.843 -1.703 . . . . 8.2799999999999994 108.843 179.721 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 20.7 m -89.7 -79.49 0.33 Allowed 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 117.67 0.735 . . . . 9.5299999999999994 111.026 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -134.74 -64.1 0.68 Allowed 'General case' 0 C--O 1.219 -0.521 0 CA-C-O 120.648 0.261 . . . . 11.91 110.83 178.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -75.67 -40.58 55.78 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.927 0.394 . . . . 10.08 110.709 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -49.11 -53.78 19.1 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 114.662 -1.154 . . . . 7.8600000000000003 112.156 -175.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -127.4 72.25 1.37 Allowed 'General case' 0 N--CA 1.418 -2.04 0 C-N-CA 119.548 -0.861 . . . . 5.9199999999999999 112.483 -178.406 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -114.02 128.22 56.29 Favored 'General case' 0 C--N 1.283 -2.299 0 N-CA-C 106.336 -1.727 . . . . 6.8799999999999999 106.336 174.264 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 48.8 mmtm -137.07 -56.55 0.72 Allowed 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 109.695 -0.483 . . . . 7.9500000000000002 109.695 178.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt 68.91 -47.3 0.57 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.241 1.416 . . . . 8.1699999999999999 113.109 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -80.54 -10.13 59.75 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 112.563 0.579 . . . . 5.9299999999999997 112.563 -178.14 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 25.2 mmt 57.24 87.68 0.06 Allowed 'General case' 0 N--CA 1.472 0.633 0 O-C-N 123.916 0.76 . . . . 7.6200000000000001 110.704 -173.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.549 ' HB2' ' O ' ' A' ' 55' ' ' PHE . 53.1 m -75.48 -84.35 0.05 Allowed 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 114.677 1.362 . . . . 3.9100000000000001 114.677 -176.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.435 ' O ' ' HA ' ' A' ' 54' ' ' THR . 31.9 mt -139.95 159.29 26.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 N-CA-C 107.812 -1.181 . . . . 3.7599999999999998 107.812 -174.258 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.607 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 32.4 tt0 -112.09 149.34 32.25 Favored 'General case' 0 CA--C 1.552 1.029 0 N-CA-C 109.335 -0.617 . . . . 6.79 109.335 -176.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.456 ' SG ' HG22 ' A' ' 50' ' ' VAL . 41.6 t -85.99 145.25 27.19 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 112.408 0.521 . . . . 5.4299999999999997 112.408 -177.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.457 ' HD2' ' O ' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -66.39 -23.15 66.28 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.392 1.477 . . . . 5.9100000000000001 110.371 -175.235 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.456 HG22 ' SG ' ' A' ' 48' ' ' CYS . 20.4 m -62.11 -30.06 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 CA-C-N 115.169 -0.923 . . . . 7.9400000000000004 112.431 -175.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 41.9 t -176.96 -110.57 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.494 0 N-CA-C 107.3 -1.37 . . . . 9.2799999999999994 107.3 -175.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 4.8 mpp? -136.44 64.28 1.56 Allowed 'General case' 0 N--CA 1.427 -1.614 0 CA-C-O 121.044 0.45 . . . . 9.4399999999999995 111.6 177.095 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.607 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 23.0 mm-40 -106.25 -165.05 1.06 Allowed 'General case' 0 C--O 1.19 -2.062 0 N-CA-C 108.672 -0.862 . . . . 9.1099999999999994 108.672 -178.068 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.435 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 15.0 t -144.13 151.8 40.06 Favored 'General case' 0 N--CA 1.437 -1.12 0 C-N-CA 117.991 -1.484 . . . . 5.9299999999999997 112.954 -178.317 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.549 ' O ' ' HB2' ' A' ' 45' ' ' SER . 89.1 m-85 -123.29 174.55 7.24 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 107.105 -1.443 . . . . 5.2699999999999996 107.105 175.582 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 10.2 tp -100.41 142.46 15.53 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.21 0 N-CA-C 110.057 -0.349 . . . . 5.2300000000000004 110.057 -178.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 49.7 t -86.37 78.35 9.29 Favored 'General case' 0 N--CA 1.415 -2.198 0 CA-C-O 121.565 0.697 . . . . 4.21 109.244 178.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 9.4 t -73.31 -12.81 60.97 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 114.993 -1.003 . . . . 6.0099999999999998 111.097 175.181 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 28.6 m -143.79 -89.57 0.12 Allowed 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 109.767 -0.457 . . . . 6.1900000000000004 109.767 178.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 65.2 p -173.06 5.03 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 112.851 0.686 . . . . 6.4699999999999998 112.851 176.154 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.495 ' O ' ' HG3' ' A' ' 65' ' ' ARG . 36.9 tt0 67.75 -45.58 0.49 Allowed 'General case' 0 N--CA 1.498 1.937 0 C-N-CA 123.839 0.855 . . . . 4.8600000000000003 111.187 -172.113 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' VAL . . . . . 0.441 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 94.8 t -56.84 -40.18 69.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 O-C-N 121.627 -0.671 . . . . 7.2300000000000004 112.468 -178.79 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.461 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 8.0 tmtt? -61.91 -37.74 85.78 Favored 'General case' 0 CA--C 1.561 1.392 0 CA-C-O 122.293 1.044 . . . . 9.3599999999999994 109.008 179.294 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' CYS . . . . . 0.403 ' SG ' ' HA ' ' A' ' 61' ' ' GLU . 29.7 p -81.49 -19.41 42.33 Favored 'General case' 0 C--O 1.204 -1.293 0 CA-C-N 115.791 -0.641 . . . . 5.9000000000000004 110.152 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.495 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 97.5 mtt180 -64.68 -39.8 94.3 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 108.736 -0.838 . . . . 7.6900000000000004 108.736 175.198 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 62' ' ' VAL . 24.5 mt-10 -60.13 -47.8 84.4 Favored 'General case' 0 C--O 1.245 0.867 0 CA-C-N 115.232 -0.894 . . . . 9.7799999999999994 108.822 179.599 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.484 ' O ' ' HB3' ' A' ' 70' ' ' ALA . 41.8 t60 -74.44 -22.31 59.19 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-N 115.072 -0.967 . . . . 8.9700000000000006 111.29 -178.088 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -74.67 -42.26 58.79 Favored 'General case' 0 CA--C 1.492 -1.265 0 C-N-CA 119.957 -0.697 . . . . 6.5300000000000002 109.231 178.441 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -65.76 -13.89 60.26 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.824 0.821 . . . . 8.5 110.67 176.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' A' ' 67' ' ' HIS . . . -76.23 -19.17 58.6 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.099 -0.955 . . . . 9.4100000000000001 110.911 174.681 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -146.0 -82.89 0.14 Allowed 'General case' 0 C--O 1.211 -0.939 0 CA-C-O 121.042 0.449 . . . . 10.32 111.861 -177.201 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.372 4.6 p80 36.45 67.24 1.72 Allowed Pre-proline 0 N--CA 1.488 1.431 0 C-N-CA 126.58 1.952 . . . . 7.4699999999999998 116.052 -173.053 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.491 ' HD2' ' HG2' ' A' ' 85' ' ' LYS . 13.9 Cg_exo -70.02 -61.63 0.06 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 121.39 1.393 . . . . 6.8099999999999996 111.214 174.725 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -158.56 120.05 3.47 Favored 'General case' 0 N--CA 1.418 -2.045 0 CA-C-N 115.558 -0.747 . . . . 7.3200000000000003 108.986 178.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.481 ' O ' ' HB2' ' A' ' 79' ' ' ALA . . . -77.18 115.79 17.27 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 107.769 -1.197 . . . . 4.5199999999999996 107.769 173.5 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -95.53 -87.1 0.29 Allowed 'General case' 0 C--O 1.201 -1.475 0 CA-C-O 121.012 0.434 . . . . 6.8200000000000003 111.389 -173.043 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.8 m -84.6 -14.85 11.19 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.663 0 CA-C-O 122.128 0.966 . . . . 8.1500000000000004 108.774 176.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.409 HG21 ' HA ' ' A' ' 85' ' ' LYS . 34.1 m -94.97 11.66 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.524 0 CA-C-N 114.681 -1.145 . . . . 5.6500000000000004 109.223 177.131 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.481 ' HB2' ' O ' ' A' ' 75' ' ' ALA . . . -65.39 -6.82 11.22 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-O 121.767 0.794 . . . . 4.2400000000000002 111.646 177.322 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 18.9 p -76.53 -17.67 59.13 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 115.144 -0.934 . . . . 5.5999999999999996 109.701 175.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.542 ' CD1' ' HG ' ' A' ' 84' ' ' LEU . 1.6 t80 -161.93 80.13 1.95 Allowed Pre-proline 0 CA--C 1.555 1.14 0 N-CA-C 106.506 -1.665 . . . . 5.1299999999999999 106.506 178.018 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -62.93 -3.85 5.25 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 124.265 3.31 . . . . 3.27 115.696 -171.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -84.77 -6.15 59.35 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 109.268 -0.641 . . . . 4.25 109.268 -179.496 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.542 ' HG ' ' CD1' ' A' ' 81' ' ' PHE . 42.6 mt -106.41 11.87 30.37 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.217 -0.447 . . . . 5.4699999999999998 112.188 -174.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.491 ' HG2' ' HD2' ' A' ' 73' ' ' PRO . 56.9 tptt -50.38 -47.67 56.19 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 111.852 0.316 . . . . 8.0399999999999991 111.852 176.507 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.435 ' HA ' ' CD2' ' A' ' 67' ' ' HIS . 40.4 ttmt . . . . . 0 C--O 1.266 1.961 0 CA-C-O 117.661 -1.162 . . . . 11.1 113.164 173.326 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.527 0 N-CA-C 111.694 -0.562 . . . . 19.140000000000001 111.694 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 4.4 p80 -74.33 86.29 1.97 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 113.035 0.754 . . . . 19.739999999999998 113.035 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 55.3 m-70 -142.92 18.36 1.96 Allowed 'General case' 0 N--CA 1.488 1.434 0 CA-C-N 115.264 -0.88 . . . . 17.670000000000002 110.523 175.061 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 83.5 m-70 -128.79 99.8 5.46 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.044 -0.724 . . . . 14.74 109.044 178.756 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 41.9 t60 -83.23 115.41 21.94 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 115.844 -0.616 . . . . 14.24 110.642 -176.518 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 28.7 t-80 73.63 101.16 0.07 Allowed 'General case' 0 N--CA 1.487 1.422 0 O-C-N 123.799 0.687 . . . . 13.67 111.844 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.2 t-80 -121.92 17.22 10.95 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.486 -0.931 . . . . 10.300000000000001 108.486 177.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 64.1 tp -61.35 110.04 1.31 Allowed 'General case' 0 C--O 1.241 0.632 0 CA-C-N 114.877 -1.056 . . . . 10.1 109.978 176.342 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -162.61 -61.26 0.04 OUTLIER 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.164 -0.925 . . . . 11.869999999999999 109.156 -175.106 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -146.5 -47.0 0.03 OUTLIER Glycine 0 N--CA 1.443 -0.848 0 CA-C-N 115.401 -0.818 . . . . 9.5999999999999996 111.868 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 168.31 -135.99 3.88 Favored Glycine 0 N--CA 1.435 -1.375 0 N-CA-C 110.659 -0.976 . . . . 8.4499999999999993 110.659 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 80.8 66.27 1.64 Allowed Glycine 0 N--CA 1.436 -1.303 0 C-N-CA 120.899 -0.667 . . . . 9.2400000000000002 112.218 178.251 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -108.42 129.76 55.25 Favored 'General case' 0 C--N 1.307 -1.241 0 C-N-CA 120.805 -0.358 . . . . 9.6799999999999997 110.051 176.21 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -159.24 150.0 19.67 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 108.681 -0.859 . . . . 11.119999999999999 108.681 177.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 62.8 97.5 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 124.922 1.289 . . . . 15.18 113.861 176.077 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 99.5 mttt 67.01 1.54 2.37 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 114.258 1.207 . . . . 15.42 114.258 176.428 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.2 p -85.01 22.87 1.31 Allowed 'General case' 0 C--N 1.297 -1.693 0 N-CA-C 112.575 0.583 . . . . 11.210000000000001 112.575 -178.004 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.21 -39.61 63.84 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.775 0.83 . . . . 13.140000000000001 111.844 -179.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 72.4 mtm -106.58 -15.38 14.79 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 120.071 -0.652 . . . . 14.08 111.105 176.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.77 -21.13 61.05 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.028 0.442 . . . . 9.7699999999999996 110.64 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.7 ptt180 -65.42 -21.84 66.71 Favored 'General case' 0 C--O 1.201 -1.483 0 CA-C-N 115.844 -0.616 . . . . 10.289999999999999 110.876 178.297 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -83.33 1.06 43.05 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.993 0.425 . . . . 9.1500000000000004 110.979 -179.426 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.586 ' HA ' ' HE2' ' A' ' 23' ' ' LYS . 10.5 mmpt? -108.29 -31.21 7.96 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.923 -0.769 . . . . 11.119999999999999 108.923 177.371 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -92.75 -8.64 43.18 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.42 -0.809 . . . . 6.46 111.36 -177.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 92.8 mt -130.25 -169.37 2.12 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 108.292 -1.003 . . . . 6.8099999999999996 108.292 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.93 -178.53 3.61 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.158 0.504 . . . . 7.7000000000000002 112.297 -178.14 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -94.5 82.25 4.0 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-N 116.189 -0.459 . . . . 8.8599999999999994 111.056 -177.161 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.49 154.77 37.63 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.029 0.443 . . . . 6.4800000000000004 111.719 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.441 ' N ' ' HD2' ' A' ' 29' ' ' LYS . 3.2 mptp? -110.58 9.14 23.08 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.501 0.667 . . . . 10.01 110.037 -178.857 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.14 131.32 46.23 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.644 -0.707 . . . . 7.4299999999999997 111.345 -178.527 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.91 -28.49 70.09 Favored 'General case' 0 C--O 1.253 1.288 0 CA-C-N 115.466 -0.788 . . . . 8.1600000000000001 112.526 -178.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 87.15 -65.26 3.71 Favored Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 121.146 -0.549 . . . . 7.6900000000000004 112.976 177.294 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -68.14 109.22 3.44 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.988 -0.375 . . . . 8.8599999999999994 109.988 -178.235 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.38 -10.2 57.85 Favored Glycine 0 CA--C 1.501 -0.827 0 N-CA-C 111.114 -0.794 . . . . 8.2799999999999994 111.114 178.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.2 t -86.81 110.75 20.15 Favored 'General case' 0 N--CA 1.418 -2.049 0 N-CA-C 108.083 -1.081 . . . . 9.5299999999999994 108.083 -179.207 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.21 -59.53 0.06 Allowed 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 107.112 -1.44 . . . . 11.91 107.112 179.64 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.1 mt -84.76 -35.38 22.47 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.226 -0.443 . . . . 10.08 111.124 177.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 70.73 -39.45 0.45 Allowed 'General case' 0 N--CA 1.498 1.928 0 C-N-CA 125.151 1.38 . . . . 7.8600000000000003 114.15 175.117 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.9 -24.06 61.86 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 113.542 0.942 . . . . 5.9199999999999999 113.542 -177.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -79.55 93.29 5.42 Favored 'General case' 0 C--O 1.218 -0.604 0 CA-C-O 120.931 0.396 . . . . 6.8799999999999999 110.953 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.535 ' HE3' ' O ' ' A' ' 57' ' ' CYS . 71.4 mmtt 66.66 86.65 0.13 Allowed 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 124.855 1.262 . . . . 7.9500000000000002 111.766 -176.305 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -63.91 -9.6 16.27 Favored 'General case' 0 C--O 1.213 -0.834 0 N-CA-C 113.569 0.952 . . . . 8.1699999999999999 113.569 -174.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -94.07 4.11 54.36 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 116.483 -0.326 . . . . 5.9299999999999997 110.859 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 64.2 mtm 69.35 8.91 7.05 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 124.06 0.944 . . . . 7.6200000000000001 111.417 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . 0.353 12.9 p 55.6 -108.2 0.42 Allowed 'General case' 0 N--CA 1.409 -2.49 0 N-CA-C 118.141 2.645 . . . . 3.9100000000000001 118.141 177.482 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.584 ' O ' ' HA ' ' A' ' 54' ' ' THR . 68.7 mt -127.04 132.19 70.12 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.99 0 CA-C-N 116.604 -0.271 . . . . 3.7599999999999998 110.395 -174.578 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.635 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 9.2 tt0 -98.1 135.12 40.22 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.222 0.534 . . . . 6.79 110.397 -178.818 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.587 ' SG ' HG22 ' A' ' 50' ' ' VAL . 12.9 t -70.86 133.04 46.14 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-N 115.053 -0.976 . . . . 5.4299999999999997 111.913 -178.224 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.6 ttpt -57.21 -30.42 64.56 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.78 1.632 . . . . 5.9100000000000001 111.599 -179.413 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.587 HG22 ' SG ' ' A' ' 48' ' ' CYS . 16.3 m -60.24 -27.89 40.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 N-CA-C 112.944 0.72 . . . . 7.9400000000000004 112.944 -175.099 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 54.1 t -174.27 -99.84 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 109.076 -0.713 . . . . 9.2799999999999994 109.076 -178.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -145.45 60.37 1.28 Allowed 'General case' 0 N--CA 1.426 -1.67 0 C-N-CA 122.543 0.337 . . . . 9.4399999999999995 110.841 179.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.635 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 10.3 mm100 -107.2 -172.49 2.09 Favored 'General case' 0 CA--C 1.481 -1.677 0 N-CA-C 108.064 -1.087 . . . . 9.1099999999999994 108.064 -178.83 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.584 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 8.9 t -143.12 153.71 43.17 Favored 'General case' 0 N--CA 1.424 -1.773 0 C-N-CA 118.239 -1.384 . . . . 5.9299999999999997 112.476 -177.839 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 99.7 m-85 -130.32 140.43 50.64 Favored 'General case' 0 C--N 1.298 -1.64 0 N-CA-C 105.489 -2.041 . . . . 5.2699999999999996 105.489 176.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ILE . . . . . 0.514 HD11 ' HG2' ' A' ' 41' ' ' LYS . 8.9 tp -67.07 147.47 12.58 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 CA-C-O 121.225 0.536 . . . . 5.2300000000000004 111.368 -173.722 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' CYS . . . . . 0.535 ' O ' ' HE3' ' A' ' 41' ' ' LYS . 43.6 t -78.34 73.13 4.9 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-O 121.52 0.676 . . . . 4.21 111.583 178.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.482 HG23 HG23 ' A' ' 56' ' ' ILE . 13.4 p -79.91 -22.27 42.95 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-O 121.483 0.658 . . . . 6.0099999999999998 110.0 170.921 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' THR . . . . . 0.419 HG21 ' HB3' ' A' ' 64' ' ' CYS . 27.2 m -116.61 150.79 37.49 Favored 'General case' 0 N--CA 1.427 -1.595 0 N-CA-C 108.286 -1.005 . . . . 6.1900000000000004 108.286 177.106 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 30.8 t -82.55 14.98 2.75 Favored 'General case' 0 CA--C 1.564 1.518 0 C-N-CA 122.7 0.4 . . . . 6.4699999999999998 111.189 -176.132 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.652 ' HA ' ' SG ' ' A' ' 64' ' ' CYS . 5.5 tp10 64.96 -60.69 0.23 Allowed 'General case' 0 C--O 1.181 -2.509 0 C-N-CA 123.899 0.88 . . . . 4.8600000000000003 111.858 -176.265 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 90.3 t -57.85 -29.07 34.61 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.329 0 O-C-N 121.577 -0.702 . . . . 7.2300000000000004 111.956 -176.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.433 ' O ' ' HD2' ' A' ' 63' ' ' LYS . 3.2 tmmm? -77.79 -35.64 51.25 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 109.372 -0.603 . . . . 9.3599999999999994 109.372 178.224 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' CYS . . . . . 0.652 ' SG ' ' HA ' ' A' ' 61' ' ' GLU . 23.1 p -76.54 -30.1 56.98 Favored 'General case' 0 C--O 1.197 -1.708 0 C-N-CA 119.514 -0.874 . . . . 5.9000000000000004 109.47 177.111 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 65.0 ttt180 -56.61 -58.36 8.4 Favored 'General case' 0 N--CA 1.437 -1.118 0 C-N-CA 124.872 1.269 . . . . 7.6900000000000004 112.103 177.434 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -62.26 -33.38 74.51 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 122.315 1.055 . . . . 9.7799999999999994 109.728 -179.233 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 -77.76 -13.38 59.91 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-N 113.933 -1.485 . . . . 8.9700000000000006 110.75 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -98.24 -47.72 5.35 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 109.617 -0.512 . . . . 6.5300000000000002 109.617 178.43 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -54.57 -37.88 66.01 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 123.757 0.661 . . . . 8.5 111.647 -179.409 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -87.77 2.71 50.53 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 116.076 -0.511 . . . . 9.4100000000000001 112.376 -178.12 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -137.67 -81.9 0.34 Allowed 'General case' 0 C--N 1.343 0.287 0 CA-C-O 120.703 0.287 . . . . 10.32 111.431 -178.531 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.272 18.6 p80 41.99 62.88 7.18 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 125.381 1.473 . . . . 7.4699999999999998 114.416 -176.262 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' PRO . . . . . 0.427 ' HD2' ' HB2' ' A' ' 85' ' ' LYS . 61.9 Cg_exo -45.91 -56.52 2.79 Favored 'Trans proline' 0 C--N 1.378 2.089 0 C-N-CA 124.001 3.134 . . . . 6.8099999999999996 114.031 -179.724 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -177.39 -23.4 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 111.773 0.286 . . . . 7.3200000000000003 111.773 -179.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.583 ' HB1' ' HA ' ' A' ' 79' ' ' ALA . . . 74.69 103.08 0.07 Allowed 'General case' 0 C--N 1.358 0.977 0 C-N-CA 124.222 1.009 . . . . 4.5199999999999996 110.834 -179.334 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -100.18 -85.66 0.4 Allowed 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 114.867 -1.06 . . . . 6.8200000000000003 111.298 -176.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.3 m -81.85 -15.65 12.15 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.749 0 CA-C-O 121.889 0.852 . . . . 8.1500000000000004 108.836 176.535 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' VAL . . . . . 0.632 HG21 ' HA ' ' A' ' 85' ' ' LYS . 31.8 m -97.34 11.11 5.57 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.827 0 CA-C-N 114.707 -1.133 . . . . 5.6500000000000004 109.25 177.348 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ALA . . . . . 0.583 ' HA ' ' HB1' ' A' ' 75' ' ' ALA . . . -63.09 -11.26 18.6 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.514 0.673 . . . . 4.2400000000000002 111.663 176.698 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.482 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 76.9 m -82.9 -8.28 59.59 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 115.369 -0.832 . . . . 5.5999999999999996 110.778 177.1 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -165.86 83.57 1.03 Allowed Pre-proline 0 C--N 1.32 -0.717 0 N-CA-C 107.734 -1.21 . . . . 5.1299999999999999 107.734 171.278 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -58.08 1.73 0.22 Allowed 'Trans proline' 0 N--CA 1.498 1.755 0 C-N-CA 123.785 2.99 . . . . 3.27 116.487 -173.181 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 67.1 m-70 -88.73 -7.42 56.32 Favored 'General case' 0 CA--C 1.499 -0.984 0 C-N-CA 120.217 -0.593 . . . . 4.25 112.12 178.302 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 45.6 mt -89.23 -33.36 17.02 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.749 -0.78 . . . . 5.4699999999999998 109.265 -178.667 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.632 ' HA ' HG21 ' A' ' 78' ' ' VAL 0.399 0.0 OUTLIER 41.88 166.53 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 119.137 3.014 . . . . 8.0399999999999991 119.137 -176.146 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 86.4 tttt . . . . . 0 C--O 1.248 1.005 0 N-CA-C 107.93 -1.137 . . . . 11.1 107.93 176.515 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 65.7 mtt . . . . . 0 N--CA 1.465 0.296 0 CA-C-O 121.854 0.835 . . . . 7.62 109.062 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.8 p -71.95 -87.33 0.02 OUTLIER 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 115.308 1.595 . . . . 3.91 115.308 -176.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.572 ' O ' ' HA ' ' A' ' 54' ' ' THR . 80.6 mt -131.62 124.6 54.5 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.739 0 CA-C-N 116.036 -0.529 . . . . 3.76 110.641 -175.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.694 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 39.7 tt0 -86.49 137.46 32.52 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.149 0.5 . . . . 6.79 110.078 177.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.603 ' SG ' HG22 ' A' ' 50' ' ' VAL . 42.4 t -77.76 130.7 37.06 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 115.015 -0.993 . . . . 5.43 111.17 178.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.533 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -58.51 -27.99 65.0 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-N 113.593 -1.639 . . . . 5.91 111.124 -178.092 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.603 HG22 ' SG ' ' A' ' 48' ' ' CYS . 8.1 m -61.19 -31.29 49.75 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 N-CA-C 112.084 0.402 . . . . 7.94 112.084 -176.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.8 t -161.37 -82.01 0.04 OUTLIER 'General case' 0 N--CA 1.44 -0.96 0 CA-C-O 120.779 0.323 . . . . 9.28 110.863 -179.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 37.6 tpp -164.38 22.1 0.06 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 121.568 0.699 . . . . 9.44 109.267 -175.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.694 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 20.7 mm-40 -84.09 -167.81 1.9 Allowed 'General case' 0 CA--C 1.492 -1.282 0 C-N-CA 120.436 -0.506 . . . . 9.11 109.946 -171.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.572 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 11.3 t -141.46 161.08 38.78 Favored 'General case' 0 N--CA 1.419 -2.002 0 C-N-CA 118.521 -1.271 . . . . 5.93 112.833 -175.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -140.04 153.18 46.72 Favored 'General case' 0 N--CA 1.436 -1.15 0 C-N-CA 126.732 2.013 . . . . 5.27 107.55 178.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 6.9 tp -73.39 136.13 26.11 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.473 0 CA-C-O 121.218 0.532 . . . . 5.23 112.081 -177.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 53.8 t -78.27 74.13 4.81 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-O 121.48 0.657 . . . . 4.21 110.443 176.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.3 m -87.03 -5.71 58.98 Favored 'General case' 0 N--CA 1.428 -1.547 0 N-CA-C 107.77 -1.196 . . . . 6.01 107.77 171.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 92.2 m -148.18 138.7 22.88 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 107.805 -1.183 . . . . 6.19 107.805 178.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.3 p -71.36 -81.38 0.05 Allowed 'General case' 0 CA--C 1.55 0.954 0 O-C-N 123.523 0.514 . . . . 6.47 112.074 -177.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.83 ' HA ' ' SG ' ' A' ' 64' ' ' CYS . 42.8 tt0 178.99 -36.13 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.047 0 C-N-CA 124.873 1.269 . . . . 4.86 108.237 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.469 ' O ' ' HB3' ' A' ' 65' ' ' ARG . 80.8 t -70.49 -37.57 70.66 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 C-N-CA 120.569 -0.452 . . . . 7.23 110.865 175.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.597 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 1.0 OUTLIER -72.81 -26.68 61.59 Favored 'General case' 0 CA--C 1.553 1.079 0 N-CA-C 108.924 -0.769 . . . . 9.36 108.924 178.439 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . 0.83 ' SG ' ' HA ' ' A' ' 61' ' ' GLU . 28.9 p -82.71 -25.26 33.1 Favored 'General case' 0 C--O 1.205 -1.248 0 C-N-CA 118.634 -1.226 . . . . 5.9 110.26 176.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.469 ' HB3' ' O ' ' A' ' 62' ' ' VAL . 68.0 ttt180 -57.62 -47.71 81.45 Favored 'General case' 0 N--CA 1.441 -0.913 0 C-N-CA 123.869 0.867 . . . . 7.69 110.665 174.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -65.74 -35.62 81.25 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.496 0.665 . . . . 9.78 110.069 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -74.06 -24.14 59.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.733 -0.667 . . . . 8.97 111.066 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -74.79 -56.81 4.39 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-N 115.891 -0.595 . . . . 6.53 110.617 -177.007 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -58.52 -34.51 71.05 Favored 'General case' 0 C--N 1.317 -0.813 0 O-C-N 123.751 0.657 . . . . 8.5 111.561 179.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -77.26 -12.45 59.95 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 115.118 -0.946 . . . . 9.41 112.568 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm -132.58 -84.57 0.48 Allowed 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 112.866 0.691 . . . . 10.32 112.866 -176.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.433 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 25.6 p80 42.49 60.26 9.91 Favored Pre-proline 0 N--CA 1.479 1.015 0 N-CA-C 113.97 1.1 . . . . 7.47 113.97 -175.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.433 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 24.9 Cg_exo -64.7 -60.65 0.13 Allowed 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.143 1.895 . . . . 6.81 111.412 -178.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 23.5 pttm -165.21 20.41 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.183 -0.462 . . . . 7.32 110.701 -179.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.512 ' HB1' ' HA ' ' A' ' 79' ' ' ALA . . . 64.07 -82.3 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.594 -0.73 . . . . 4.52 109.254 -172.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.4 t70 53.78 -88.43 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.538 1.135 . . . . 6.82 113.693 175.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.7 m -73.35 -24.01 20.14 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.05 0 N-CA-C 109.585 -0.524 . . . . 8.15 109.585 177.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.521 ' HB ' ' HB2' ' A' ' 84' ' ' LEU . 19.0 m -104.43 13.96 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.376 0 CA-C-N 115.872 -0.603 . . . . 5.65 110.439 176.498 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.512 ' HA ' ' HB1' ' A' ' 75' ' ' ALA . . . -70.35 -14.58 62.64 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 121.484 0.659 . . . . 4.24 110.153 177.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 82.5 m -76.8 -19.65 57.32 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 114.908 -1.042 . . . . 5.6 110.491 177.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.596 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 34.4 t80 -155.58 83.97 3.55 Favored Pre-proline 0 N--CA 1.447 -0.615 0 N-CA-C 107.353 -1.351 . . . . 5.13 107.353 176.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -63.19 3.44 0.58 Allowed 'Trans proline' 0 C--O 1.197 -1.552 0 C-N-CA 123.676 2.917 . . . . 3.27 115.312 -172.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 66.6 m-70 -72.73 -8.44 55.43 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 119.177 0.899 . . . . 4.25 110.842 174.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 81' ' ' PHE . 11.0 mt . . . . . 0 N--CA 1.416 -2.155 0 N-CA-C 107.15 -1.426 . . . . 5.47 107.15 -178.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 CA--C 1.555 1.142 0 N-CA-C 112.128 0.418 . . . . 7.62 112.128 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.484 ' OG ' HG13 ' A' ' 46' ' ' ILE . 41.2 t 56.16 -96.78 0.07 Allowed 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.971 1.1 . . . . 3.91 113.971 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.484 HG13 ' OG ' ' A' ' 45' ' ' SER . 14.4 mt -124.67 160.96 28.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 C-N-CA 123.395 0.678 . . . . 3.76 109.989 -176.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.659 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 7.5 tt0 -120.11 131.22 54.97 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 123.227 0.611 . . . . 6.79 109.399 177.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.651 ' SG ' HG22 ' A' ' 50' ' ' VAL . 21.3 t -68.83 134.51 49.77 Favored 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 124.238 1.015 . . . . 5.43 111.91 -177.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.453 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -62.68 -29.35 70.58 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.82 1.648 . . . . 5.91 109.806 -177.731 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.651 HG22 ' SG ' ' A' ' 48' ' ' CYS . 11.6 m -62.14 -25.5 37.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.164 -0.471 . . . . 7.94 112.169 -174.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.469 ' SG ' ' HG2' ' A' ' 52' ' ' MET . 47.6 t -169.26 -77.2 0.02 OUTLIER 'General case' 0 N--CA 1.438 -1.032 0 O-C-N 123.406 0.442 . . . . 9.28 110.776 179.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.469 ' HG2' ' SG ' ' A' ' 51' ' ' CYS . 19.8 ptm -169.41 32.28 0.02 OUTLIER 'General case' 0 C--O 1.21 -1.025 0 CA-C-N 116.273 -0.421 . . . . 9.44 111.732 -176.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.659 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 17.2 mm-40 -90.82 -166.14 1.51 Allowed 'General case' 0 C--O 1.205 -1.276 0 N-CA-C 108.924 -0.769 . . . . 9.11 108.924 -173.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.8 t -135.99 167.39 21.31 Favored 'General case' 0 C--N 1.289 -2.031 0 C-N-CA 118.442 -1.303 . . . . 5.93 112.277 -175.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.448 ' O ' ' HB3' ' A' ' 45' ' ' SER . 89.5 m-85 -135.17 153.61 51.91 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 106.095 -1.817 . . . . 5.27 106.095 175.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 7.9 tp -83.81 133.67 28.67 Favored 'Isoleucine or valine' 0 C--O 1.251 1.145 0 O-C-N 123.644 0.59 . . . . 5.23 110.929 -177.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 49.0 t -71.6 74.4 0.8 Allowed 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 121.633 0.73 . . . . 4.21 112.217 176.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 18.0 p -82.11 -3.77 55.48 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 109.158 -0.682 . . . . 6.01 109.158 169.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 87.3 m -161.66 149.83 15.22 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.009 -1.478 . . . . 6.19 107.009 178.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.0 t -79.71 139.92 37.16 Favored 'General case' 0 N--CA 1.419 -1.983 0 N-CA-C 106.981 -1.489 . . . . 6.47 106.981 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -53.25 -32.91 50.74 Favored 'General case' 0 C--O 1.206 -1.218 0 O-C-N 123.826 0.704 . . . . 4.86 110.534 -178.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.459 ' O ' ' HB3' ' A' ' 65' ' ' ARG . 67.7 t -62.09 -31.8 52.5 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.096 0 N-CA-C 112.832 0.678 . . . . 7.23 112.832 -177.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.587 ' O ' ' HD2' ' A' ' 63' ' ' LYS . 1.0 OUTLIER -79.85 -35.88 37.56 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 118.171 -1.411 . . . . 9.36 107.338 179.216 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 69.1 m -67.15 -27.88 67.67 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 109.123 -0.695 . . . . 5.9 109.123 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.459 ' HB3' ' O ' ' A' ' 62' ' ' VAL . 72.7 ttt180 -60.61 -54.85 40.38 Favored 'General case' 0 N--CA 1.426 -1.666 0 C-N-CA 124.607 1.163 . . . . 7.69 112.17 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -63.68 -33.84 76.52 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-O 121.079 0.466 . . . . 9.78 110.39 -178.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -70.73 -37.36 73.47 Favored 'General case' 0 N--CA 1.438 -1.031 0 N-CA-C 109.167 -0.679 . . . . 8.97 109.167 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.72 -48.39 54.82 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-N 115.954 -0.567 . . . . 6.53 111.878 -178.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -71.73 -17.98 62.17 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.509 0.559 . . . . 8.5 112.509 -176.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -93.7 -18.17 22.42 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 116.417 -0.356 . . . . 9.41 111.28 176.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -118.27 -81.01 0.62 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.784 0.29 . . . . 10.32 111.784 -178.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.476 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 30.8 p80 44.47 54.21 11.99 Favored Pre-proline 0 N--CA 1.498 1.934 0 N-CA-C 114.449 1.277 . . . . 7.47 114.449 -178.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.476 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 5.3 Cg_exo -75.59 -58.87 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.126 0 C-N-CA 121.686 1.591 . . . . 6.81 113.17 -178.435 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -159.73 104.91 1.59 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.487 0.661 . . . . 7.32 112.066 -175.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.74 113.15 21.7 Favored 'General case' 0 C--N 1.292 -1.896 0 CA-C-N 116.057 -0.52 . . . . 4.52 109.788 175.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -115.12 -76.79 0.57 Allowed 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 111.89 0.33 . . . . 6.82 111.89 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 28.2 m -73.81 -18.94 17.57 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.743 0 CA-C-O 122.368 1.08 . . . . 8.15 108.977 176.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 35.5 m -105.59 15.83 6.71 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.37 0 CA-C-N 114.359 -1.292 . . . . 5.65 109.803 175.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.58 -15.89 59.33 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-O 121.905 0.859 . . . . 4.24 110.018 175.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . 0.61 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 64.4 m -67.59 -16.78 64.36 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 114.285 -1.325 . . . . 5.6 110.49 176.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.487 ' CE2' ' HB2' ' A' ' 83' ' ' HIS . 14.2 t80 -167.85 89.32 0.69 Allowed Pre-proline 0 N--CA 1.444 -0.771 0 N-CA-C 108.052 -1.092 . . . . 5.13 108.052 171.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -63.91 3.91 0.63 Allowed 'Trans proline' 0 N--CA 1.505 2.206 0 C-N-CA 124.087 3.192 . . . . 3.27 114.504 -173.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.487 ' HB2' ' CE2' ' A' ' 81' ' ' PHE . 13.2 m-70 -88.92 -0.67 57.6 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 109.258 -0.645 . . . . 4.25 109.258 177.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 49.0 mt . . . . . 0 C--N 1.344 0.327 0 CA-C-N 116.413 -0.358 . . . . 5.47 111.748 -177.512 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 65.8 mtt . . . . . 0 N--CA 1.484 1.269 0 N-CA-C 112.273 0.471 . . . . 7.62 112.273 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.5 p 51.67 -104.76 0.19 Allowed 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 116.347 1.98 . . . . 3.91 116.347 177.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.433 ' O ' ' HA ' ' A' ' 54' ' ' THR . 59.0 mt -118.35 143.75 28.36 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 N-CA-C 109.657 -0.498 . . . . 3.76 109.657 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.565 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 1.1 tp-100 -112.19 133.82 54.09 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 106.549 -1.648 . . . . 6.79 106.549 178.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.593 ' SG ' HG22 ' A' ' 50' ' ' VAL . 35.7 t -66.28 135.72 54.82 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 124.512 1.125 . . . . 5.43 113.024 -175.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.403 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -64.31 -26.59 68.55 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.1 1.36 . . . . 5.91 110.168 -178.266 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.593 HG22 ' SG ' ' A' ' 48' ' ' CYS . 5.4 m -66.52 -33.19 61.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 120.843 0.354 . . . . 7.94 111.797 -175.202 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 83.9 m -156.67 -83.11 0.06 Allowed 'General case' 0 N--CA 1.433 -1.318 0 CA-C-N 115.801 -0.636 . . . . 9.28 110.792 -174.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 52.1 ttp 179.9 47.51 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.768 0 N-CA-C 108.471 -0.937 . . . . 9.44 108.471 -178.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.565 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 21.2 mm-40 -101.56 -178.29 3.68 Favored 'General case' 0 C--O 1.173 -2.927 0 N-CA-C 107.263 -1.384 . . . . 9.11 107.263 -178.259 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.433 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 9.5 t -125.7 154.12 42.89 Favored 'General case' 0 C--N 1.286 -2.16 0 C-N-CA 117.53 -1.668 . . . . 5.93 113.574 -175.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.453 ' HE2' ' SG ' ' A' ' 48' ' ' CYS . 86.7 m-85 -137.59 147.9 45.43 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 113.867 -1.515 . . . . 5.27 107.634 177.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.495 HG13 ' H ' ' A' ' 58' ' ' THR . 9.2 tp -73.7 132.18 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 N-CA-C 109.402 -0.592 . . . . 5.23 109.402 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 24.9 p -74.43 -18.98 60.57 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.03 0.381 . . . . 4.21 112.03 -176.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.495 ' H ' HG13 ' A' ' 56' ' ' ILE 0.25 13.6 t 54.34 -4.89 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 127.26 2.224 . . . . 6.01 115.152 177.739 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 87.0 m -155.93 -83.9 0.06 Allowed 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 109.319 -0.623 . . . . 6.19 109.319 178.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 18.0 p -161.2 10.36 0.09 Allowed 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 112.242 0.46 . . . . 6.47 112.242 -178.202 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.568 ' O ' ' HG3' ' A' ' 65' ' ' ARG . 26.7 tt0 68.51 -52.04 0.56 Allowed 'General case' 0 C--O 1.183 -2.416 0 C-N-CA 124.523 1.129 . . . . 4.86 110.806 -177.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.526 HG12 ' CZ ' ' A' ' 65' ' ' ARG . 35.7 m -55.37 -39.18 51.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 O-C-N 121.354 -0.841 . . . . 7.23 112.77 -178.322 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -60.46 -42.28 95.87 Favored 'General case' 0 C--N 1.306 -1.3 0 CA-C-N 115.357 -0.838 . . . . 9.36 109.496 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 28.5 p -78.19 -31.81 49.71 Favored 'General case' 0 N--CA 1.428 -1.544 0 C-N-CA 119.85 -0.74 . . . . 5.9 109.621 178.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.568 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 22.3 mtm180 -59.68 -50.26 74.56 Favored 'General case' 0 CA--C 1.5 -0.966 0 N-CA-C 111.921 0.341 . . . . 7.69 111.921 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -66.73 -33.79 76.41 Favored 'General case' 0 C--O 1.236 0.366 0 O-C-N 123.741 0.65 . . . . 9.78 111.931 -178.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -74.39 -30.25 61.87 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 119.696 -0.802 . . . . 8.97 109.463 177.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.53 ' CB ' ' HA ' ' A' ' 83' ' ' HIS . . . -71.14 -46.86 60.7 Favored 'General case' 0 C--O 1.204 -1.333 0 CA-C-N 116.559 -0.291 . . . . 6.53 111.543 179.664 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 10.7 pt-20 -71.65 -11.6 60.92 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.417 0.627 . . . . 8.5 111.432 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.05 -32.06 59.13 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.009 -0.996 . . . . 9.41 109.798 173.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -120.65 -86.48 0.65 Allowed 'General case' 0 C--O 1.216 -0.698 0 CA-C-N 115.763 -0.653 . . . . 10.32 111.191 -177.184 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.471 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 20.4 t-80 45.49 55.58 14.74 Favored Pre-proline 0 CA--C 1.561 1.403 0 C-N-CA 123.85 0.86 . . . . 7.47 112.014 -178.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.471 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 34.6 Cg_exo -65.23 -44.93 8.33 Favored 'Trans proline' 0 C--N 1.37 1.661 0 C-N-CA 121.881 1.721 . . . . 6.81 110.341 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 24.5 pttm -170.03 106.14 0.33 Allowed 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 114.141 -1.391 . . . . 7.32 108.85 177.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 79' ' ' ALA . . . -67.16 112.77 4.64 Favored 'General case' 0 C--N 1.302 -1.476 0 C-N-CA 119.427 -0.909 . . . . 4.52 109.153 171.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.401 ' HB2' ' H ' ' A' ' 77' ' ' VAL . 8.9 m-20 -86.94 -90.75 0.11 Allowed 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 122.003 0.906 . . . . 6.82 110.709 -174.145 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.401 ' H ' ' HB2' ' A' ' 76' ' ' ASP . 28.2 m -89.49 -14.96 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.219 0 N-CA-C 108.546 -0.909 . . . . 8.15 108.546 177.057 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 24.4 m -87.03 7.44 2.54 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.833 0 CA-C-N 115.019 -0.991 . . . . 5.65 109.047 177.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.432 ' HB2' ' O ' ' A' ' 75' ' ' ALA . . . -65.33 -2.77 3.38 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-N 115.185 -0.916 . . . . 4.24 112.003 178.068 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 25.3 p -73.51 -23.22 60.0 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 115.366 -0.833 . . . . 5.6 109.213 174.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.522 ' CE2' ' HB2' ' A' ' 83' ' ' HIS . 31.8 t80 -160.36 88.67 1.81 Allowed Pre-proline 0 N--CA 1.428 -1.528 0 N-CA-C 106.456 -1.683 . . . . 5.13 106.456 170.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -60.01 6.73 0.1 OUTLIER 'Trans proline' 0 N--CA 1.509 2.395 0 C-N-CA 124.435 3.423 . . . . 3.27 115.527 -173.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.53 ' HA ' ' CB ' ' A' ' 68' ' ' ALA . 83.2 m-70 -98.87 5.58 47.28 Favored 'General case' 0 C--N 1.286 -2.163 0 N-CA-C 110.075 -0.343 . . . . 4.25 110.075 177.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.487 ' HG ' ' HD2' ' A' ' 81' ' ' PHE . 74.9 mt . . . . . 0 N--CA 1.43 -1.471 0 N-CA-C 111.982 0.364 . . . . 5.47 111.982 -179.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 68.6 mtm . . . . . 0 N--CA 1.496 1.866 0 N-CA-C 113.21 0.819 . . . . 7.62 113.21 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 67.1 m 52.0 -92.18 0.03 OUTLIER 'General case' 0 CA--C 1.561 1.387 0 N-CA-C 115.594 1.701 . . . . 3.91 115.594 176.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.537 ' O ' ' HA ' ' A' ' 54' ' ' THR . 66.2 mt -131.86 133.88 60.63 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.209 0 N-CA-C 108.894 -0.78 . . . . 3.76 108.894 -177.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.685 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 35.3 tt0 -100.81 138.83 37.34 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 120.918 0.39 . . . . 6.79 110.217 -179.027 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.635 ' SG ' HG12 ' A' ' 50' ' ' VAL . 44.8 t -77.86 143.96 37.37 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.709 -0.678 . . . . 5.43 111.152 178.237 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.405 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -57.06 -39.07 74.19 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 126.06 1.744 . . . . 5.91 112.579 -174.37 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.635 HG12 ' SG ' ' A' ' 48' ' ' CYS . 2.1 p -49.0 -51.37 12.78 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 114.74 1.385 . . . . 7.94 114.74 -176.272 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.605 ' SG ' HG22 ' A' ' 50' ' ' VAL . 93.4 m -153.96 -67.73 0.14 Allowed 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 121.093 -0.243 . . . . 9.28 111.302 -173.104 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.446 ' HG3' ' NE2' ' A' ' 47' ' ' GLN . 39.1 ttp -174.86 35.4 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 120.109 -0.636 . . . . 9.44 109.653 -175.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.685 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 13.4 mm-40 -87.47 179.25 6.6 Favored 'General case' 0 CA--C 1.494 -1.199 0 C-N-CA 119.265 -0.974 . . . . 9.11 108.665 -174.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.537 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 7.5 t -137.99 154.31 49.35 Favored 'General case' 0 C--N 1.299 -1.597 0 C-N-CA 118.541 -1.264 . . . . 5.93 113.946 -175.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -132.94 151.55 52.04 Favored 'General case' 0 N--CA 1.409 -2.497 0 N-CA-C 105.877 -1.897 . . . . 5.27 105.877 175.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 10.8 tp -75.57 146.32 9.42 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.563 0 N-CA-C 109.459 -0.571 . . . . 5.23 109.459 -177.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 45.1 t -76.95 72.68 3.53 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 121.883 0.849 . . . . 4.21 110.941 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 8.9 t -84.94 -3.2 58.64 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.103 -0.953 . . . . 6.01 110.097 174.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 95.0 m -160.29 140.28 11.36 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 106.721 -1.585 . . . . 6.19 106.721 177.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 35.7 p -75.65 139.32 41.93 Favored 'General case' 0 N--CA 1.42 -1.946 0 N-CA-C 109.396 -0.594 . . . . 6.47 109.396 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.722 ' HA ' ' SG ' ' A' ' 64' ' ' CYS . 14.4 pt-20 -52.53 -35.02 52.56 Favored 'General case' 0 C--O 1.206 -1.184 0 C-N-CA 123.543 0.737 . . . . 4.86 111.824 178.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.428 ' O ' ' HB3' ' A' ' 65' ' ' ARG . 99.4 t -67.16 -38.97 82.12 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.844 0 C-N-CA 123.155 0.582 . . . . 7.23 112.494 178.001 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -73.01 -35.93 66.9 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 121.476 0.655 . . . . 9.36 109.683 -178.111 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . 0.722 ' SG ' ' HA ' ' A' ' 61' ' ' GLU . 1.8 p -74.52 -27.34 60.5 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 115.656 -0.702 . . . . 5.9 111.044 174.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.452 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 54.8 ttt180 -59.68 -52.65 64.58 Favored 'General case' 0 N--CA 1.439 -1.018 0 C-N-CA 123.627 0.771 . . . . 7.69 112.251 178.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -68.98 -30.24 68.61 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.37 -0.532 . . . . 9.78 110.99 -179.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 61.3 t60 -66.96 -37.96 85.22 Favored 'General case' 0 C--O 1.241 0.644 0 CA-C-N 116.158 -0.474 . . . . 8.97 109.805 176.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.25 -42.16 72.55 Favored 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 115.966 -0.561 . . . . 6.53 110.379 178.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 6.0 mm-40 -63.63 -17.95 63.43 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.157 0.503 . . . . 8.5 111.698 -179.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -84.46 -11.3 56.43 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.994 -0.548 . . . . 9.41 111.06 176.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -142.52 -84.83 0.17 Allowed 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.611 0.597 . . . . 10.32 112.611 -177.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.469 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 34.9 p80 41.76 47.81 2.65 Favored Pre-proline 0 N--CA 1.502 2.158 0 C-N-CA 125.357 1.463 . . . . 7.47 114.036 -176.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.469 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 1.3 Cg_endo -73.75 -41.75 1.01 Allowed 'Trans proline' 0 N--CA 1.444 -1.414 0 C-N-CA 121.015 1.143 . . . . 6.81 112.374 -175.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -160.53 116.16 2.29 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.48 -0.933 . . . . 7.32 108.48 -179.324 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.506 ' O ' HG22 ' A' ' 78' ' ' VAL . . . -73.05 -51.58 17.58 Favored 'General case' 0 C--N 1.286 -2.187 0 C-N-CA 118.738 -1.185 . . . . 4.52 108.654 173.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.45 ' OD1' HG13 ' A' ' 77' ' ' VAL . 11.3 t70 61.0 -86.5 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 124.111 0.965 . . . . 6.82 113.037 170.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.45 HG13 ' OD1' ' A' ' 76' ' ' ASP . 35.6 m -92.63 -19.32 6.88 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.742 0 CA-C-O 121.166 0.508 . . . . 8.15 109.884 178.247 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.506 HG22 ' O ' ' A' ' 75' ' ' ALA . 21.1 m -102.34 18.39 3.84 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.504 0 N-CA-C 107.973 -1.121 . . . . 5.65 107.973 174.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.423 ' HA ' ' HB1' ' A' ' 75' ' ' ALA . . . -64.48 -11.97 39.15 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-O 121.803 0.811 . . . . 4.24 111.496 178.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . 0.548 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 89.2 m -75.4 -15.56 60.44 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-N 115.135 -0.939 . . . . 5.6 110.025 174.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.586 ' CD1' HD12 ' A' ' 84' ' ' LEU . 11.9 p90 -154.45 69.86 6.03 Favored Pre-proline 0 CA--C 1.563 1.47 0 C-N-CA 124.64 1.176 . . . . 5.13 111.401 178.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -64.22 -17.46 59.8 Favored 'Trans proline' 0 N--CA 1.5 1.854 0 C-N-CA 123.814 3.009 . . . . 3.27 115.375 -172.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -81.48 4.47 21.04 Favored 'General case' 0 C--N 1.31 -1.143 0 C-N-CA 120.549 -0.46 . . . . 4.25 111.601 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.586 HD12 ' CD1' ' A' ' 81' ' ' PHE . 17.0 mt . . . . . 0 N--CA 1.443 -0.779 0 C-N-CA 120.391 -0.524 . . . . 5.47 110.687 -177.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.522 ' O ' HG23 ' A' ' 54' ' ' THR . 0.0 OUTLIER . . . . . 0 C--O 1.207 -1.159 0 N-CA-C 111.742 0.275 . . . . 7.62 111.742 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.446 ' HB3' ' N ' ' A' ' 57' ' ' CYS . 54.7 m 60.84 -80.11 0.02 OUTLIER 'General case' 0 CA--C 1.563 1.479 0 N-CA-C 114.618 1.34 . . . . 3.91 114.618 178.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.442 ' HB ' ' HB2' ' A' ' 55' ' ' PHE . 57.2 mt -139.86 144.81 27.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 N-CA-C 109.053 -0.721 . . . . 3.76 109.053 -178.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.621 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 1.1 tp-100 -109.36 136.78 48.23 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-O 121.015 0.436 . . . . 6.79 110.592 -178.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.563 ' SG ' HG22 ' A' ' 50' ' ' VAL . 38.1 t -74.28 145.05 44.31 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 124.803 1.241 . . . . 5.43 113.483 -175.504 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.6 ttpt -63.86 -34.97 79.13 Favored 'General case' 0 C--O 1.216 -0.689 0 C-N-CA 125.796 1.639 . . . . 5.91 111.332 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.563 HG22 ' SG ' ' A' ' 48' ' ' CYS . 8.5 m -61.04 -25.05 34.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 N-CA-C 113.286 0.847 . . . . 7.94 113.286 -171.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.5 t -170.07 -76.25 0.02 OUTLIER 'General case' 0 N--CA 1.436 -1.149 0 N-CA-C 108.825 -0.805 . . . . 9.28 108.825 -178.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.445 ' C ' HE21 ' A' ' 53' ' ' GLN . 27.5 ttt -179.89 60.86 0.01 OUTLIER 'General case' 0 C--O 1.208 -1.11 0 N-CA-C 107.303 -1.369 . . . . 9.44 107.303 179.141 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.621 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 23.3 mm-40 -106.43 -174.24 2.49 Favored 'General case' 0 C--O 1.195 -1.809 0 N-CA-C 109.475 -0.565 . . . . 9.11 109.475 -176.009 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.522 HG23 ' O ' ' A' ' 44' ' ' MET . 97.4 m -120.57 142.89 48.95 Favored 'General case' 0 C--N 1.273 -2.718 0 N-CA-C 114.255 1.206 . . . . 5.93 114.255 -170.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.442 ' HB2' ' HB ' ' A' ' 46' ' ' ILE . 79.9 m-85 -130.41 172.75 11.53 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 125.698 1.599 . . . . 5.27 108.435 175.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.1 tp -100.21 137.36 27.97 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 CA-C-O 121.035 0.445 . . . . 5.23 112.114 -175.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.446 ' N ' ' HB3' ' A' ' 45' ' ' SER . 25.8 p -89.01 77.48 7.65 Favored 'General case' 0 N--CA 1.418 -2.031 0 CA-C-O 121.571 0.7 . . . . 4.21 110.258 176.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 8.2 m -67.47 -9.44 42.06 Favored 'General case' 0 CA--C 1.576 1.968 0 CA-C-O 122.29 1.043 . . . . 6.01 110.189 174.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.443 HG22 ' H ' ' A' ' 60' ' ' SER . 33.2 m -149.75 173.76 13.35 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 104.681 -2.34 . . . . 6.19 104.681 178.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.443 ' H ' HG22 ' A' ' 59' ' ' THR . 15.5 m -75.75 20.42 0.18 Allowed 'General case' 0 CA--C 1.552 1.051 0 CA-C-N 119.533 1.06 . . . . 6.47 112.517 -174.042 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 65.23 -52.22 0.35 Allowed 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 126.929 2.092 . . . . 4.86 111.542 -178.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.639 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 28.3 m -55.47 -41.93 65.44 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.411 0 N-CA-C 113.388 0.884 . . . . 7.23 113.388 -177.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.481 ' HA ' ' OE1' ' A' ' 66' ' ' GLU . 0.6 OUTLIER -59.9 -35.26 74.49 Favored 'General case' 0 CA--C 1.55 0.953 0 CA-C-O 122.037 0.922 . . . . 9.36 109.466 178.34 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 55.7 m -73.7 -36.26 65.23 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 108.45 -0.944 . . . . 5.9 108.45 179.123 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -59.3 -42.76 92.08 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 115.615 -0.72 . . . . 7.69 110.93 178.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.639 ' HG3' ' O ' ' A' ' 62' ' ' VAL . 25.3 mt-10 -59.14 -45.46 90.89 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 124.35 1.031 . . . . 9.78 109.894 -177.29 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -75.65 -24.59 56.4 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.281 -0.872 . . . . 8.97 109.721 -178.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.97 -43.86 33.39 Favored 'General case' 0 C--O 1.206 -1.189 0 CA-C-N 116.179 -0.464 . . . . 6.53 111.485 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.93 -18.83 64.15 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.098 0.475 . . . . 8.5 110.186 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.09 -29.5 67.6 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.16 -0.927 . . . . 9.41 110.733 175.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -128.16 -76.13 0.56 Allowed 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 112.327 0.491 . . . . 10.32 112.327 -175.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.416 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 13.4 p80 39.13 60.62 5.63 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 125.148 1.379 . . . . 7.47 113.695 -175.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.416 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 51.1 Cg_exo -59.58 -51.43 6.19 Favored 'Trans proline' 0 C--N 1.358 1.057 0 C-N-CA 122.36 2.04 . . . . 6.81 112.483 -178.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.28 -32.03 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 113.619 0.97 . . . . 7.32 113.619 177.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' A' ' 79' ' ' ALA . . . 71.45 116.53 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.74 0.816 . . . . 4.52 109.956 -176.274 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -104.21 -80.87 0.53 Allowed 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.062 0.458 . . . . 6.82 111.129 -174.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.8 m -81.53 -18.06 11.64 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 121.657 0.741 . . . . 8.15 109.174 176.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 35.3 m -97.0 12.03 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.305 0 CA-C-N 115.003 -0.999 . . . . 5.65 109.514 176.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.409 ' HB2' ' O ' ' A' ' 75' ' ' ALA . . . -59.99 -12.89 9.02 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-O 121.41 0.624 . . . . 4.24 111.996 178.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . 0.442 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 71.2 m -84.16 -8.64 59.02 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 115.42 -0.809 . . . . 5.6 111.384 178.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.469 ' HD2' ' HG ' ' A' ' 84' ' ' LEU . 19.9 t80 -168.12 84.1 0.75 Allowed Pre-proline 0 N--CA 1.434 -1.269 0 N-CA-C 108.158 -1.053 . . . . 5.13 108.158 168.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -62.14 5.97 0.2 Allowed 'Trans proline' 0 N--CA 1.508 2.371 0 C-N-CA 124.57 3.513 . . . . 3.27 115.199 -174.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.434 ' HB2' ' CE2' ' A' ' 81' ' ' PHE . 90.3 m-70 -92.81 3.34 55.84 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 109.803 -0.443 . . . . 4.25 109.803 177.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.469 ' HG ' ' HD2' ' A' ' 81' ' ' PHE . 45.7 mt . . . . . 0 C--N 1.32 -0.716 0 CA-C-N 115.96 -0.564 . . . . 5.47 110.641 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 68.1 mtm . . . . . 0 N--CA 1.486 1.357 0 N-CA-C 112.002 0.371 . . . . 7.62 112.002 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.7 p 48.25 -101.1 0.07 Allowed 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 115.666 1.728 . . . . 3.91 115.666 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.529 ' O ' ' HA ' ' A' ' 54' ' ' THR . 62.0 mt -122.83 136.64 58.98 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.059 0 N-CA-C 109.006 -0.738 . . . . 3.76 109.006 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.632 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 7.3 tt0 -102.89 141.84 35.02 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.779 0.324 . . . . 6.79 110.618 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.552 ' SG ' HG12 ' A' ' 50' ' ' VAL . 48.7 t -80.0 144.68 33.04 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.985 -0.552 . . . . 5.43 110.911 177.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.412 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 1.8 tmmm? -59.92 -44.67 94.18 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 125.061 1.344 . . . . 5.91 112.299 -174.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.552 HG12 ' SG ' ' A' ' 48' ' ' CYS . 7.5 p -46.95 -37.86 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 N-CA-C 114.885 1.439 . . . . 7.94 114.885 -171.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 50.1 t -159.96 -67.26 0.07 Allowed 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.388 -0.525 . . . . 9.28 110.072 -179.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.44 ' C ' HE21 ' A' ' 53' ' ' GLN . 27.5 ttt 178.21 60.24 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.417 0 O-C-N 123.758 0.662 . . . . 9.44 109.904 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.632 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 19.1 mm-40 -103.55 -170.78 1.83 Allowed 'General case' 0 C--O 1.203 -1.384 0 N-CA-C 107.478 -1.304 . . . . 9.11 107.478 -177.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.529 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 9.0 t -141.94 157.97 44.33 Favored 'General case' 0 N--CA 1.42 -1.952 0 C-N-CA 118.333 -1.347 . . . . 5.93 113.013 -178.205 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -140.39 139.98 35.41 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 106.026 -1.842 . . . . 5.27 106.026 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 7.1 tp -63.49 140.62 19.35 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 O-C-N 123.413 0.445 . . . . 5.23 111.623 -178.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 12.6 p -75.08 72.13 2.18 Favored 'General case' 0 N--CA 1.426 -1.638 0 CA-C-O 121.747 0.784 . . . . 4.21 112.71 178.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 24.5 p -82.46 -4.47 57.51 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.312 -0.858 . . . . 6.01 109.872 171.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.553 HG21 ' SG ' ' A' ' 64' ' ' CYS . 25.1 m -143.31 161.0 39.48 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 106.586 -1.635 . . . . 6.19 106.586 176.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.5 m -87.27 17.22 4.51 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 112.219 0.452 . . . . 6.47 112.219 -174.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.527 ' CD ' ' HE ' ' A' ' 65' ' ' ARG . 5.4 tp10 67.58 -64.85 0.26 Allowed 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 112.225 0.454 . . . . 4.86 112.225 179.229 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.403 ' HA ' ' HB2' ' A' ' 65' ' ' ARG . 5.4 p -63.9 -25.86 39.19 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 C-N-CA 123.014 0.526 . . . . 7.23 111.016 -175.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -62.28 -41.59 98.62 Favored 'General case' 0 C--O 1.25 1.104 0 N-CA-C 108.106 -1.072 . . . . 9.36 108.106 177.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . 0.553 ' SG ' HG21 ' A' ' 59' ' ' THR . 63.9 m -77.48 -29.42 52.65 Favored 'General case' 0 N--CA 1.424 -1.741 0 CA-C-N 115.058 -0.974 . . . . 5.9 108.904 176.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.527 ' HE ' ' CD ' ' A' ' 61' ' ' GLU . 97.1 mtt180 -57.78 -47.18 83.29 Favored 'General case' 0 CA--C 1.5 -0.957 0 N-CA-C 113.114 0.783 . . . . 7.69 113.114 179.047 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -65.35 -40.69 93.94 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 119.95 -0.7 . . . . 9.78 110.49 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . 0.42 ' O ' ' HB3' ' A' ' 70' ' ' ALA . 3.7 t-160 -75.91 -26.95 57.44 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 115.937 -0.574 . . . . 8.97 110.725 -175.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.599 ' O ' ' HB2' ' A' ' 72' ' ' HIS . . . -77.62 -49.85 13.74 Favored 'General case' 0 C--O 1.186 -2.255 0 N-CA-C 109.935 -0.395 . . . . 6.53 109.935 178.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -67.81 -8.45 36.08 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.39 0.614 . . . . 8.5 111.049 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.42 ' HB3' ' O ' ' A' ' 67' ' ' HIS . . . -73.12 -31.37 64.26 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 115.047 -0.979 . . . . 9.41 109.446 173.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -131.39 -79.07 0.52 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.793 -0.64 . . . . 10.32 110.113 -176.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.599 ' HB2' ' O ' ' A' ' 68' ' ' ALA . 5.8 t-160 47.07 48.43 5.71 Favored Pre-proline 0 CA--C 1.566 1.587 0 C-N-CA 124.809 1.244 . . . . 7.47 111.643 176.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.441 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 45.7 Cg_exo -56.61 -51.09 9.89 Favored 'Trans proline' 0 C--N 1.387 2.556 0 C-N-CA 121.903 1.735 . . . . 6.81 111.789 -174.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -163.69 106.86 0.98 Allowed 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.68 -0.691 . . . . 7.32 109.727 178.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.27 111.35 2.57 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 120.039 -0.665 . . . . 4.52 109.338 173.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -107.01 -87.62 0.47 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 114.871 -1.058 . . . . 6.82 110.858 -170.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 30.3 m -82.16 -1.69 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-O 122.468 1.127 . . . . 8.15 108.973 174.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 32.7 m -110.01 10.05 8.83 Favored 'Isoleucine or valine' 0 C--O 1.183 -2.403 0 CA-C-N 113.286 -1.779 . . . . 5.65 108.517 176.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.57 -21.38 62.54 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-O 121.598 0.714 . . . . 4.24 112.156 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . 0.466 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 72.3 m -76.37 -15.92 59.85 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.557 -0.747 . . . . 5.6 110.876 176.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.65 ' CD1' HD12 ' A' ' 84' ' ' LEU . 4.4 p90 -153.61 71.49 6.7 Favored Pre-proline 0 CA--C 1.555 1.164 0 C-N-CA 124.728 1.211 . . . . 5.13 111.119 -179.366 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -64.63 -1.56 4.17 Favored 'Trans proline' 0 C--N 1.364 1.371 0 C-N-CA 123.944 3.096 . . . . 3.27 116.239 -172.047 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -91.86 -0.49 57.51 Favored 'General case' 0 C--N 1.297 -1.688 0 C-N-CA 119.502 -0.879 . . . . 4.25 109.891 177.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.65 HD12 ' CD1' ' A' ' 81' ' ' PHE . 20.0 mt . . . . . 0 N--CA 1.425 -1.676 0 C-N-CA 121.011 -0.276 . . . . 5.47 111.347 -175.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 26.1 mmt . . . . . 0 N--CA 1.487 1.401 0 N-CA-C 111.889 0.329 . . . . 7.62 111.889 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.7 p 46.69 -98.55 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.157 0 N-CA-C 116.485 2.032 . . . . 3.91 116.485 176.073 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.472 ' O ' ' HA ' ' A' ' 54' ' ' THR . 66.5 mt -119.99 149.87 22.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.024 0 N-CA-C 108.294 -1.002 . . . . 3.76 108.294 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.638 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 0.0 OUTLIER -119.22 141.33 49.0 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 108.841 -0.8 . . . . 6.79 108.841 -177.407 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.695 ' SG ' HG12 ' A' ' 50' ' ' VAL . 22.6 t -78.99 147.65 32.83 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 112.217 0.451 . . . . 5.43 112.217 -177.2 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 2.5 tmmm? -64.29 -46.37 83.94 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.827 1.251 . . . . 5.91 110.978 -177.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.695 HG12 ' SG ' ' A' ' 48' ' ' CYS . 8.5 p -51.19 -32.55 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 N-CA-C 113.962 1.097 . . . . 7.94 113.962 -173.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 41.9 t -159.01 -74.06 0.08 Allowed 'General case' 0 C--N 1.3 -1.583 0 C-N-CA 120.79 -0.364 . . . . 9.28 110.044 -177.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 35.2 ttp 176.38 40.64 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 108.967 -0.753 . . . . 9.44 108.967 -176.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.638 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 13.9 mm-40 -89.69 -176.22 4.91 Favored 'General case' 0 C--O 1.193 -1.894 0 N-CA-C 107.72 -1.215 . . . . 9.11 107.72 -174.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.472 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 5.2 t -133.17 152.19 51.95 Favored 'General case' 0 C--N 1.286 -2.185 0 C-N-CA 117.73 -1.588 . . . . 5.93 113.506 -175.076 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -135.18 156.55 48.8 Favored 'General case' 0 N--CA 1.427 -1.613 0 N-CA-C 106.489 -1.671 . . . . 5.27 106.489 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.2 tp -70.83 138.34 22.03 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.657 0 O-C-N 123.713 0.633 . . . . 5.23 111.88 -176.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 19.0 p -86.36 74.15 10.02 Favored 'General case' 0 N--CA 1.418 -2.064 0 CA-C-O 121.588 0.709 . . . . 4.21 111.132 178.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.1 p -70.78 -16.01 62.71 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.356 -0.838 . . . . 6.01 109.931 173.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 60.7 m -155.14 153.18 30.41 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 106.299 -1.741 . . . . 6.19 106.299 176.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.9 m -77.4 138.27 39.19 Favored 'General case' 0 N--CA 1.418 -2.03 0 N-CA-C 106.459 -1.682 . . . . 6.47 106.459 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -52.17 -39.31 59.86 Favored 'General case' 0 C--O 1.185 -2.291 0 C-N-CA 120.749 -0.381 . . . . 4.86 110.402 -179.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.548 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 17.2 m -53.38 -41.42 44.33 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.205 0 N-CA-C 114.403 1.26 . . . . 7.23 114.403 -178.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -72.37 -33.08 66.98 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 122.137 0.97 . . . . 9.36 108.851 -179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 60.0 m -73.48 -31.34 63.7 Favored 'General case' 0 C--N 1.31 -1.135 0 N-CA-C 108.39 -0.967 . . . . 5.9 108.39 178.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.45 ' HB3' ' O ' ' A' ' 62' ' ' VAL . 27.1 ttm180 -64.86 -42.85 94.53 Favored 'General case' 0 N--CA 1.426 -1.65 0 C-N-CA 125.472 1.509 . . . . 7.69 110.967 177.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.548 ' HG3' ' O ' ' A' ' 62' ' ' VAL . 27.9 mt-10 -55.43 -47.92 75.24 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 122.372 1.082 . . . . 9.78 108.44 178.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -75.59 -16.82 60.19 Favored 'General case' 0 C--N 1.293 -1.87 0 CA-C-N 113.768 -1.56 . . . . 8.97 110.943 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.603 ' HA ' ' CD2' ' A' ' 72' ' ' HIS . . . -88.56 -41.46 12.68 Favored 'General case' 0 CA--C 1.489 -1.386 0 N-CA-C 112.423 0.527 . . . . 6.53 112.423 -177.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 33.0 mm-40 -68.2 -25.06 65.04 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 107.854 -1.165 . . . . 8.5 107.854 178.405 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.483 ' O ' ' HD3' ' A' ' 71' ' ' LYS . . . -75.8 -31.24 59.35 Favored 'General case' 0 C--O 1.245 0.854 0 CA-C-N 114.783 -1.099 . . . . 9.41 111.192 176.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.483 ' HD3' ' O ' ' A' ' 70' ' ' ALA . 73.4 mmtt -135.43 -111.08 0.21 Allowed 'General case' 0 C--N 1.355 0.842 0 N-CA-C 109.682 -0.488 . . . . 10.32 109.682 -177.239 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.603 ' CD2' ' HA ' ' A' ' 68' ' ' ALA . 9.7 m170 29.23 51.62 0.4 Allowed Pre-proline 0 N--CA 1.501 2.086 0 N-CA-C 115.758 1.762 . . . . 7.47 115.758 178.336 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.535 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 1.0 OUTLIER -79.85 -3.35 12.75 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.375 2.05 . . . . 6.81 113.838 -175.069 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.454 ' HE3' ' HB2' ' A' ' 74' ' ' LYS . 18.4 ptmt -161.45 109.3 1.47 Allowed 'General case' 0 C--O 1.199 -1.597 0 N-CA-C 111.987 0.365 . . . . 7.32 111.987 -177.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -97.62 122.04 40.24 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.221 -1.029 . . . . 4.52 108.221 174.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -98.95 -90.65 0.29 Allowed 'General case' 0 C--O 1.211 -0.942 0 CA-C-N 115.815 -0.629 . . . . 6.82 110.818 -173.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 32.7 m -82.44 -11.95 12.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 CA-C-O 122.284 1.04 . . . . 8.15 109.044 176.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 35.8 m -99.19 13.57 5.0 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 CA-C-N 113.881 -1.509 . . . . 5.65 108.707 177.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.85 -15.2 53.64 Favored 'General case' 0 C--O 1.251 1.132 0 CA-C-O 121.622 0.725 . . . . 4.24 111.539 178.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . 0.426 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 73.6 m -75.56 -15.81 60.33 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-N 115.295 -0.866 . . . . 5.6 110.701 175.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.522 ' CD1' HD12 ' A' ' 84' ' ' LEU . 16.4 p90 -154.1 70.6 6.34 Favored Pre-proline 0 CA--C 1.561 1.382 0 C-N-CA 124.454 1.102 . . . . 5.13 111.527 179.068 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -57.38 -22.96 52.6 Favored 'Trans proline' 0 N--CA 1.495 1.589 0 C-N-CA 123.481 2.787 . . . . 3.27 114.478 -173.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -73.71 -1.38 18.86 Favored 'General case' 0 C--N 1.309 -1.181 0 C-N-CA 120.161 -0.615 . . . . 4.25 111.825 -178.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.522 HD12 ' CD1' ' A' ' 81' ' ' PHE . 19.3 mt . . . . . 0 C--O 1.208 -1.11 0 CA-C-N 118.162 0.437 . . . . 5.47 111.011 -177.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.473 0.696 0 CA-C-O 121.55 0.691 . . . . 7.62 110.795 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.506 ' OG ' HG13 ' A' ' 46' ' ' ILE . 22.7 t -60.0 -81.86 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 114.889 -1.05 . . . . 3.91 113.767 -178.263 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.506 HG13 ' OG ' ' A' ' 45' ' ' SER . 13.2 mt -129.41 159.34 41.55 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 CA-C-N 115.968 -0.56 . . . . 3.76 110.056 -172.368 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.624 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 34.9 tt0 -108.98 135.03 50.83 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.914 0.885 . . . . 6.79 109.196 178.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.678 ' SG ' HG12 ' A' ' 50' ' ' VAL . 47.6 t -77.55 144.81 37.31 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.516 -0.765 . . . . 5.43 111.06 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' A' ' 79' ' ' ALA . 14.7 ttpt -59.13 -47.07 86.63 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 124.897 1.279 . . . . 5.91 112.426 -175.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.678 HG12 ' SG ' ' A' ' 48' ' ' CYS . 7.1 p -49.48 -32.84 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-N 114.542 -1.208 . . . . 7.94 113.902 -170.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.436 ' SG ' ' HG2' ' A' ' 52' ' ' MET . 52.7 t -160.02 -71.23 0.07 Allowed 'General case' 0 N--CA 1.419 -2.01 0 C-N-CA 119.915 -0.714 . . . . 9.28 110.492 -177.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.436 ' HG2' ' SG ' ' A' ' 51' ' ' CYS . 24.3 ptt? -178.95 28.12 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 O-C-N 123.5 0.5 . . . . 9.44 111.195 -174.568 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.624 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 10.6 mm-40 -83.95 178.6 7.81 Favored 'General case' 0 C--O 1.201 -1.456 0 N-CA-C 108.177 -1.045 . . . . 9.11 108.177 -171.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.491 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 9.5 t -134.86 145.1 47.97 Favored 'General case' 0 C--N 1.279 -2.483 0 C-N-CA 117.894 -1.523 . . . . 5.93 112.303 -175.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.487 ' O ' ' HB3' ' A' ' 45' ' ' SER . 96.8 m-85 -107.31 173.42 6.33 Favored 'General case' 0 N--CA 1.424 -1.762 0 CA-C-N 114.317 -1.311 . . . . 5.27 108.27 176.404 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.613 HD13 ' H ' ' A' ' 57' ' ' CYS . 0.3 OUTLIER -104.51 148.79 8.7 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.547 0 N-CA-C 107.287 -1.375 . . . . 5.23 107.287 -177.217 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.613 ' H ' HD13 ' A' ' 56' ' ' ILE . 42.5 t -71.82 77.58 0.87 Allowed 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.895 0.855 . . . . 4.21 110.322 176.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 9.9 t -96.95 -11.02 25.15 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 114.859 -1.064 . . . . 6.01 108.706 174.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 47.2 m -161.95 150.81 15.47 Favored 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 106.76 -1.57 . . . . 6.19 106.76 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 11.3 m -89.4 131.16 35.59 Favored 'General case' 0 N--CA 1.406 -2.647 0 N-CA-C 105.719 -1.956 . . . . 6.47 105.719 178.279 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.545 ' O ' ' HG3' ' A' ' 65' ' ' ARG . 42.7 mt-10 -52.45 -29.98 27.35 Favored 'General case' 0 C--O 1.186 -2.256 0 N-CA-C 112.787 0.662 . . . . 4.86 112.787 -177.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.406 HG22 ' NH2' ' A' ' 65' ' ' ARG . 86.5 t -58.91 -36.86 63.77 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.4 0 N-CA-C 111.721 0.267 . . . . 7.23 111.721 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -71.56 -30.59 66.04 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 108.02 -1.104 . . . . 9.36 108.02 -179.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 69.8 m -80.2 -25.68 39.55 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 114.726 -1.125 . . . . 5.9 110.956 176.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.545 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 65.8 mtm180 -64.78 -49.12 71.95 Favored 'General case' 0 CA--C 1.5 -0.958 0 N-CA-C 111.972 0.36 . . . . 7.69 111.972 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -63.68 -39.48 94.42 Favored 'General case' 0 C--O 1.217 -0.617 0 C-N-CA 119.967 -0.693 . . . . 9.78 109.673 177.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -62.72 -30.85 71.73 Favored 'General case' 0 CA--C 1.558 1.271 0 CA-C-N 115.918 -0.583 . . . . 8.97 111.085 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -77.67 -50.36 12.62 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 116.295 -0.411 . . . . 6.53 111.17 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 10.8 pt-20 -69.17 -18.09 63.89 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 121.103 0.478 . . . . 8.5 111.743 -178.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.0 -17.56 59.64 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.424 -0.807 . . . . 9.41 111.287 176.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -138.19 -73.99 0.4 Allowed 'General case' 0 C--O 1.211 -0.93 0 CA-C-O 120.691 0.281 . . . . 10.32 111.31 -174.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 18.5 p80 43.5 63.06 8.36 Favored Pre-proline 0 N--CA 1.478 0.963 0 N-CA-C 114.864 1.431 . . . . 7.47 114.864 -178.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -79.74 -60.64 0.03 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.343 0 C-N-CA 121.244 1.296 . . . . 6.81 114.101 178.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -158.21 107.29 2.03 Favored 'General case' 0 N--CA 1.44 -0.942 0 C-N-CA 119.587 -0.845 . . . . 7.32 112.555 -173.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.0 89.96 7.72 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.374 -0.83 . . . . 4.52 110.201 176.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -113.98 -72.48 0.7 Allowed 'General case' 0 N--CA 1.482 1.165 0 CA-C-O 121.101 0.477 . . . . 6.82 111.647 -178.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 27.2 m -77.51 -14.56 14.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 122.079 0.942 . . . . 8.15 108.973 176.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 29.1 m -105.22 11.08 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.141 0 CA-C-N 114.346 -1.297 . . . . 5.65 108.979 175.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.514 ' O ' ' HD3' ' A' ' 49' ' ' LYS . . . -61.21 -18.2 57.06 Favored 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 112.076 0.398 . . . . 4.24 112.076 179.405 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . 0.534 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 78.2 m -76.99 -13.1 60.0 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 116.212 -0.449 . . . . 5.6 111.293 178.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.41 ' CZ ' HG21 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -151.69 75.27 7.75 Favored Pre-proline 0 C--N 1.306 -1.29 0 N-CA-C 106.69 -1.596 . . . . 5.13 106.69 174.634 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -67.88 9.44 0.36 Allowed 'Trans proline' 0 C--N 1.367 1.538 0 C-N-CA 123.7 2.933 . . . . 3.27 114.345 -173.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 38.7 m170 -91.08 -4.6 56.15 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.946 -0.761 . . . . 4.25 108.946 175.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 13.4 mt . . . . . 0 N--CA 1.469 0.518 0 CA-C-N 116.299 -0.409 . . . . 5.47 110.435 -174.974 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.452 -0.343 0 CA-C-O 121.513 0.673 . . . . 7.62 111.496 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.508 ' HB2' ' O ' ' A' ' 55' ' ' PHE . 62.6 m -61.26 -72.52 0.12 Allowed 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 114.816 -1.084 . . . . 3.91 112.253 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.525 ' O ' ' HA ' ' A' ' 54' ' ' THR . 75.4 mt -129.6 129.73 66.75 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 N-CA-C 108.019 -1.104 . . . . 3.76 108.019 -178.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.584 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 28.8 tt0 -97.9 130.33 44.79 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 108.728 -0.841 . . . . 6.79 108.728 178.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.594 ' SG ' HG22 ' A' ' 50' ' ' VAL . 41.9 t -67.56 123.6 20.89 Favored 'General case' 0 N--CA 1.421 -1.88 0 CA-C-N 115.708 -0.678 . . . . 5.43 110.479 178.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.444 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -50.07 -33.15 17.51 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 127.17 2.188 . . . . 5.91 111.608 -177.759 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.594 HG22 ' SG ' ' A' ' 48' ' ' CYS . 10.2 m -59.1 -23.18 23.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 N-CA-C 112.765 0.654 . . . . 7.94 112.765 -175.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.9 t -173.63 -81.93 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 120.734 0.302 . . . . 9.28 110.89 178.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.535 ' HA ' ' CG ' ' A' ' 47' ' ' GLN . 55.0 ttp -165.5 36.73 0.06 Allowed 'General case' 0 CA--C 1.547 0.832 0 CA-C-O 122.326 1.06 . . . . 9.44 109.736 -174.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.584 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 14.7 mm-40 -88.99 -177.27 5.42 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 107.302 -1.369 . . . . 9.11 107.302 -178.497 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.525 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 13.3 t -144.32 149.22 35.87 Favored 'General case' 0 N--CA 1.42 -1.952 0 C-N-CA 117.156 -1.817 . . . . 5.93 113.041 -177.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.508 ' O ' ' HB2' ' A' ' 45' ' ' SER . 98.4 m-85 -125.93 153.74 43.82 Favored 'General case' 0 N--CA 1.418 -2.068 0 N-CA-C 106.826 -1.546 . . . . 5.27 106.826 177.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 9.0 tp -79.32 139.72 17.91 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.342 0 O-C-N 123.411 0.444 . . . . 5.23 110.377 -178.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.443 ' HB2' ' HB3' ' A' ' 45' ' ' SER . 43.0 t -81.16 74.7 8.16 Favored 'General case' 0 N--CA 1.429 -1.525 0 N-CA-C 108.683 -0.858 . . . . 4.21 108.683 177.103 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 9.8 t -92.26 1.14 57.4 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.406 -0.816 . . . . 6.01 109.951 177.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 92.5 m -156.54 137.26 13.29 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 108.014 -1.106 . . . . 6.19 108.014 178.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 17.9 m -78.72 138.23 38.16 Favored 'General case' 0 N--CA 1.419 -1.997 0 O-C-N 123.522 0.514 . . . . 6.47 110.038 -175.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -51.08 -29.33 12.73 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 124.915 1.286 . . . . 4.86 112.295 178.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 64.3 t -72.54 -32.42 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.78 0 CA-C-O 120.913 0.387 . . . . 7.23 111.384 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -71.52 -39.59 70.67 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 122.322 1.058 . . . . 9.36 108.96 177.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 55.6 m -62.47 -38.16 88.75 Favored 'General case' 0 C--N 1.271 -2.814 0 CA-C-N 113.885 -1.507 . . . . 5.9 109.462 174.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 23.5 ttt180 -57.68 -51.74 68.29 Favored 'General case' 0 N--CA 1.444 -0.768 0 C-N-CA 123.811 0.845 . . . . 7.69 112.895 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -61.7 -38.22 87.03 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-O 121.488 0.661 . . . . 9.78 111.346 -177.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 32.0 t60 -76.67 -31.8 57.53 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.857 -0.61 . . . . 8.97 109.898 -177.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.439 ' O ' ' HB3' ' A' ' 72' ' ' HIS . . . -75.99 -25.39 55.74 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 115.753 -0.658 . . . . 6.53 111.717 -177.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -83.17 -21.03 33.64 Favored 'General case' 0 C--N 1.294 -1.839 0 C-N-CA 120.03 -0.668 . . . . 8.5 111.512 176.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.47 -32.44 37.11 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.08 0.466 . . . . 9.41 110.493 175.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . 0.441 ' HB3' ' HD3' ' A' ' 73' ' ' PRO . 13.5 mptt -101.45 -86.54 0.41 Allowed 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.948 0.721 . . . . 10.32 112.948 -179.002 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.461 ' N ' ' HD3' ' A' ' 73' ' ' PRO 0.256 23.9 p80 46.38 59.01 16.21 Favored Pre-proline 0 N--CA 1.485 1.276 0 N-CA-C 116.052 1.871 . . . . 7.47 116.052 -177.306 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.461 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 6.2 Cg_exo -82.34 -55.43 0.03 OUTLIER 'Trans proline' 0 N--CA 1.434 -2.016 0 C-N-CA 121.77 1.647 . . . . 6.81 112.063 175.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 12.7 ptmm? -160.84 108.82 1.56 Allowed 'General case' 0 N--CA 1.436 -1.16 0 CA-C-O 121.435 0.636 . . . . 7.32 111.819 -177.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 79' ' ' ALA . . . -73.07 88.88 1.43 Allowed 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 106.777 -1.564 . . . . 4.52 106.777 171.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -113.19 -75.24 0.6 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.014 -0.994 . . . . 6.82 110.66 -172.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 34.8 m -78.64 -11.91 13.34 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.832 0 CA-C-O 121.893 0.854 . . . . 8.15 108.743 176.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 33.4 m -109.29 13.1 8.68 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.025 0 CA-C-N 114.393 -1.276 . . . . 5.65 109.246 177.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.414 ' HB2' ' O ' ' A' ' 75' ' ' ALA . . . -66.32 -6.0 12.55 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 121.725 0.774 . . . . 4.24 110.604 177.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . 0.405 ' HB2' ' SG ' ' A' ' 48' ' ' CYS . 18.4 p -70.85 -27.31 63.75 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-N 114.813 -1.085 . . . . 5.6 109.634 176.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -155.02 88.22 3.22 Favored Pre-proline 0 N--CA 1.439 -0.986 0 N-CA-C 106.866 -1.531 . . . . 5.13 106.866 174.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -60.6 5.49 0.14 Allowed 'Trans proline' 0 N--CA 1.503 2.061 0 C-N-CA 124.212 3.275 . . . . 3.27 115.063 -172.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 65.1 m-70 -87.96 -8.58 55.5 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 109.205 -0.665 . . . . 4.25 109.205 174.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 36.9 mt . . . . . 0 CA--C 1.536 0.435 0 CA-C-N 115.848 -0.615 . . . . 5.47 111.128 -176.83 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 72.1 mtm . . . . . 0 CA--C 1.5 -0.963 0 CA-C-O 121.654 0.74 . . . . 7.62 109.122 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.584 ' HB2' ' O ' ' A' ' 55' ' ' PHE . 75.3 m -143.89 -73.04 0.27 Allowed 'General case' 0 N--CA 1.413 -2.321 0 CA-C-N 114.561 -1.2 . . . . 3.91 113.872 -174.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.594 ' O ' ' HA ' ' A' ' 54' ' ' THR . 44.3 mt -111.79 136.67 47.2 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.492 0 O-C-N 121.868 -0.52 . . . . 3.76 109.816 -177.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.641 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 19.3 tt0 -97.59 123.98 41.69 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 109.504 -0.554 . . . . 6.79 109.504 -176.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.698 ' SG ' HG22 ' A' ' 50' ' ' VAL . 34.2 t -60.46 141.78 55.98 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.725 1.61 . . . . 5.43 114.052 -173.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.431 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -72.12 -31.96 66.51 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.338 1.455 . . . . 5.91 109.467 -177.77 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.698 HG22 ' SG ' ' A' ' 48' ' ' CYS . 5.9 m -61.28 -26.58 39.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 115.868 -0.606 . . . . 7.94 111.6 -174.488 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.7 t -161.86 -76.72 0.05 OUTLIER 'General case' 0 N--CA 1.426 -1.646 0 CA-C-N 115.967 -0.56 . . . . 9.28 109.97 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.533 ' HG2' ' NE2' ' A' ' 47' ' ' GLN . 34.3 ttp 178.51 35.75 0.0 OUTLIER 'General case' 0 C--O 1.212 -0.892 0 CA-C-O 121.925 0.869 . . . . 9.44 108.84 -175.49 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.641 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 14.4 mm-40 -93.92 -164.7 1.21 Allowed 'General case' 0 C--O 1.191 -1.983 0 N-CA-C 108.0 -1.111 . . . . 9.11 108.0 -172.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.594 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 15.3 t -137.14 162.41 33.49 Favored 'General case' 0 C--N 1.313 -0.999 0 C-N-CA 116.828 -1.949 . . . . 5.93 113.184 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.584 ' O ' ' HB2' ' A' ' 45' ' ' SER . 96.6 m-85 -144.18 177.9 8.27 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 126.626 1.97 . . . . 5.27 106.978 177.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 7.5 tp -86.95 134.73 26.81 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 CA-C-O 120.977 0.418 . . . . 5.23 111.994 -176.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.558 ' CB ' ' HB3' ' A' ' 45' ' ' SER . 10.3 t -110.4 85.0 2.02 Favored 'General case' 0 N--CA 1.413 -2.296 0 N-CA-C 107.353 -1.351 . . . . 4.21 107.353 175.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.9 p -55.27 -35.13 64.69 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.17 -0.923 . . . . 6.01 111.681 174.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.65 HG23 ' H ' ' A' ' 61' ' ' GLU . 14.2 t -109.09 -155.44 0.56 Allowed 'General case' 0 CA--C 1.556 1.176 0 N-CA-C 108.723 -0.843 . . . . 6.19 108.723 -178.105 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.0 t -100.07 21.74 12.36 Favored 'General case' 0 CA--C 1.554 1.097 0 N-CA-C 109.68 -0.489 . . . . 6.47 109.68 177.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.65 ' H ' HG23 ' A' ' 59' ' ' THR . 29.7 tt0 64.78 -50.88 0.32 Allowed 'General case' 0 N--CA 1.503 2.191 0 C-N-CA 126.361 1.864 . . . . 4.86 111.942 -175.163 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.518 ' HA ' ' HB3' ' A' ' 65' ' ' ARG . 57.7 t -51.01 -29.49 7.9 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 C-N-CA 125.361 1.464 . . . . 7.23 112.956 -176.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.53 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 4.7 tmtm? -72.5 -38.07 68.23 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 122.038 0.923 . . . . 9.36 108.898 -179.311 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 85.6 m -75.78 -29.28 58.72 Favored 'General case' 0 C--N 1.284 -2.259 0 N-CA-C 109.038 -0.727 . . . . 5.9 109.038 176.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.518 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 21.8 tpt180 -56.86 -55.34 35.65 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.421 1.088 . . . . 7.69 111.34 177.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -59.1 -37.61 77.55 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 123.981 0.801 . . . . 9.78 110.73 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 52.8 t60 -76.7 -26.77 55.08 Favored 'General case' 0 C--O 1.21 -1.023 0 C-N-CA 120.368 -0.533 . . . . 8.97 111.501 -178.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . 0.457 ' O ' ' HB2' ' A' ' 72' ' ' HIS . . . -82.13 -38.03 25.38 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 111.771 0.286 . . . . 6.53 111.771 -177.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -73.49 -23.49 60.06 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.3 0.571 . . . . 8.5 110.297 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -89.63 -7.0 55.69 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.596 -0.729 . . . . 9.41 111.437 178.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -136.0 -85.87 0.36 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 111.962 0.356 . . . . 10.32 111.962 -177.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.457 ' HB2' ' O ' ' A' ' 68' ' ' ALA . 44.3 t-80 51.25 51.8 10.95 Favored Pre-proline 0 CA--C 1.561 1.37 0 C-N-CA 123.743 0.817 . . . . 7.47 110.272 -178.197 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.45 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 31.4 Cg_exo -61.11 -46.67 14.7 Favored 'Trans proline' 0 C--N 1.382 2.301 0 C-N-CA 121.481 1.454 . . . . 6.81 110.79 -176.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 15.5 pttp -167.49 106.23 0.55 Allowed 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 115.196 -0.911 . . . . 7.32 109.075 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.433 ' O ' HG22 ' A' ' 78' ' ' VAL . . . -57.7 -54.7 43.94 Favored 'General case' 0 CA--C 1.564 1.518 0 N-CA-C 114.494 1.294 . . . . 4.52 114.494 177.645 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 56.43 -94.73 0.05 OUTLIER 'General case' 0 N--CA 1.518 2.958 0 C-N-CA 124.455 1.102 . . . . 6.82 113.136 -178.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.6 m -85.66 -17.03 9.72 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.746 0 CA-C-N 115.353 -0.84 . . . . 8.15 110.894 -176.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.433 HG22 ' O ' ' A' ' 75' ' ' ALA . 26.3 m -103.18 13.51 6.94 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.639 0 N-CA-C 109.079 -0.711 . . . . 5.65 109.079 175.154 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.9 -12.91 28.31 Favored 'General case' 0 N--CA 1.489 1.483 0 CA-C-O 121.429 0.633 . . . . 4.24 111.687 176.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 71.6 m -74.98 -11.59 60.14 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-N 115.803 -0.635 . . . . 5.6 110.262 176.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.455 ' CE2' ' HB2' ' A' ' 83' ' ' HIS . 25.8 t80 -167.78 83.37 0.8 Allowed Pre-proline 0 N--CA 1.435 -1.198 0 N-CA-C 108.226 -1.027 . . . . 5.13 108.226 172.108 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -63.07 11.26 0.09 OUTLIER 'Trans proline' 0 N--CA 1.498 1.741 0 C-N-CA 124.384 3.39 . . . . 3.27 116.053 -173.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.455 ' HB2' ' CE2' ' A' ' 81' ' ' PHE . 50.3 m170 -87.19 -1.62 58.03 Favored 'General case' 0 C--O 1.193 -1.908 0 N-CA-C 109.026 -0.731 . . . . 4.25 109.026 174.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 45.2 mt . . . . . 0 C--O 1.241 0.647 0 N-CA-C 113.556 0.947 . . . . 5.47 113.556 -172.952 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 47.2 tpp . . . . . 0 N--CA 1.503 2.213 0 CA-C-O 121.358 0.599 . . . . 7.62 111.757 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . 0.264 32.6 p 48.02 -98.74 0.05 OUTLIER 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 116.177 1.917 . . . . 3.91 116.177 179.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.54 ' O ' ' HA ' ' A' ' 54' ' ' THR . 70.2 mt -127.32 127.07 68.77 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.251 0 N-CA-C 109.414 -0.587 . . . . 3.76 109.414 -177.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.611 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 26.1 tt0 -99.52 133.38 43.93 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 109.133 -0.691 . . . . 6.79 109.133 -178.025 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.495 ' SG ' HG22 ' A' ' 50' ' ' VAL . 49.5 t -72.53 131.75 42.91 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 115.69 -0.687 . . . . 5.43 112.584 -177.465 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 5.9 ttpt -52.9 -29.39 28.11 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 127.097 2.159 . . . . 5.91 112.465 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.495 HG22 ' SG ' ' A' ' 48' ' ' CYS . 14.6 m -63.58 -27.78 43.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.984 -0.553 . . . . 7.94 112.223 -172.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 48.2 t -170.72 -77.5 0.02 OUTLIER 'General case' 0 N--CA 1.434 -1.267 0 CA-C-N 116.208 -0.451 . . . . 9.28 110.047 -178.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.409 ' O ' ' HG2' ' A' ' 52' ' ' MET . 26.9 ttt -171.51 39.85 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.664 0 CA-C-O 121.965 0.888 . . . . 9.44 109.817 -175.172 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.611 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 18.4 mm-40 -92.52 -173.41 3.36 Favored 'General case' 0 C--O 1.203 -1.394 0 N-CA-C 108.38 -0.971 . . . . 9.11 108.38 -177.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.54 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 9.6 t -139.21 161.81 36.51 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 118.111 -1.436 . . . . 5.93 112.461 -177.589 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -141.1 148.62 40.42 Favored 'General case' 0 N--CA 1.433 -1.322 0 C-N-CA 126.244 1.818 . . . . 5.27 106.527 178.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.1 tp -70.43 136.37 26.16 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.694 0 CA-C-O 121.061 0.458 . . . . 5.23 111.975 -177.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 16.6 p -81.68 76.66 8.58 Favored 'General case' 0 N--CA 1.423 -1.78 0 CA-C-O 121.811 0.815 . . . . 4.21 110.534 175.096 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.5 m -63.46 -8.59 9.66 Favored 'General case' 0 CA--C 1.568 1.659 0 CA-C-N 114.817 -1.083 . . . . 6.01 110.752 175.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.424 HG22 ' H ' ' A' ' 60' ' ' SER . 32.9 m -146.21 172.99 12.63 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 105.555 -2.017 . . . . 6.19 105.555 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.424 ' H ' HG22 ' A' ' 59' ' ' THR . 12.5 m -74.54 15.85 0.32 Allowed 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 118.987 0.812 . . . . 6.47 112.233 -174.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.428 ' CD ' HH21 ' A' ' 65' ' ' ARG . 35.1 tt0 63.1 -61.67 0.13 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 125.195 1.398 . . . . 4.86 112.066 -177.246 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.0 p -61.06 -28.28 43.37 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.966 0 C-N-CA 123.679 0.792 . . . . 7.23 110.735 -176.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.409 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 5.7 tmtt? -66.2 -41.78 89.69 Favored 'General case' 0 C--O 1.249 1.078 0 N-CA-C 107.142 -1.429 . . . . 9.36 107.142 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 55.6 m -66.16 -33.52 75.96 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 114.663 -1.153 . . . . 5.9 108.073 176.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.649 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 94.0 mtt180 -62.01 -37.49 85.07 Favored 'General case' 0 C--O 1.199 -1.559 0 CA-C-N 115.405 -0.816 . . . . 7.69 111.769 178.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -56.37 -50.26 72.07 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.642 0.734 . . . . 9.78 109.227 -179.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 76.4 t60 -68.37 -32.13 71.99 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 114.517 -1.219 . . . . 8.97 111.229 -179.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.8 -44.66 31.84 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 112.475 0.546 . . . . 6.53 112.475 -175.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.649 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 11.5 mm-40 -63.51 -32.66 74.18 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.362 0.601 . . . . 8.5 109.467 -178.154 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -88.74 7.97 31.17 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-N 115.312 -0.858 . . . . 9.41 111.628 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -144.17 -85.56 0.14 Allowed 'General case' 0 CA--C 1.508 -0.651 0 C-N-CA 122.501 0.321 . . . . 10.32 111.852 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.408 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 29.4 p80 43.05 57.88 11.74 Favored Pre-proline 0 CA--C 1.554 1.128 0 C-N-CA 124.013 0.925 . . . . 7.47 112.338 -177.143 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.408 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 53.6 Cg_exo -54.92 -36.53 92.13 Favored 'Trans proline' 0 C--N 1.37 1.68 0 C-N-CA 122.934 2.423 . . . . 6.81 113.694 -175.403 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 63.5 pttt -171.86 -40.41 0.02 OUTLIER 'General case' 0 C--N 1.348 0.518 0 N-CA-C 113.3 0.852 . . . . 7.32 113.3 -178.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.583 ' HB1' ' HA ' ' A' ' 79' ' ' ALA . . . 76.03 108.66 0.08 Allowed 'General case' 0 C--O 1.212 -0.892 0 C-N-CA 124.387 1.075 . . . . 4.52 109.326 -172.336 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.415 ' HB2' ' H ' ' A' ' 77' ' ' VAL . 1.7 m-20 -87.47 -105.58 0.07 Allowed 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 113.899 -1.501 . . . . 6.82 110.102 -169.327 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.415 ' H ' ' HB2' ' A' ' 76' ' ' ASP . 26.8 m -86.41 -7.65 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.838 0 N-CA-C 107.56 -1.274 . . . . 8.15 107.56 170.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . 0.409 HG22 ' H ' ' A' ' 76' ' ' ASP . 28.6 m -90.75 14.4 1.45 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.505 0 CA-C-N 113.766 -1.561 . . . . 5.65 109.266 177.2 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.583 ' HA ' ' HB1' ' A' ' 75' ' ' ALA . . . -71.35 1.05 6.77 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 122.079 0.942 . . . . 4.24 110.176 176.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . 0.413 ' HB2' ' SG ' ' A' ' 48' ' ' CYS . 19.9 p -75.76 -22.14 56.77 Favored 'General case' 0 N--CA 1.423 -1.778 0 CA-C-N 114.217 -1.356 . . . . 5.6 109.503 174.188 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.519 ' HD2' ' HG ' ' A' ' 84' ' ' LEU . 27.2 t80 -157.57 91.32 2.31 Favored Pre-proline 0 C--N 1.309 -1.163 0 N-CA-C 106.413 -1.699 . . . . 5.13 106.413 170.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -62.04 5.13 0.24 Allowed 'Trans proline' 0 N--CA 1.491 1.326 0 C-N-CA 123.762 2.975 . . . . 3.27 115.41 -172.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . 0.433 ' HB2' ' CE2' ' A' ' 81' ' ' PHE . 76.7 m-70 -100.85 9.99 41.67 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 108.789 -0.819 . . . . 4.25 108.789 177.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.519 ' HG ' ' HD2' ' A' ' 81' ' ' PHE . 60.8 mt . . . . . 0 C--O 1.242 0.68 0 CA-C-N 115.691 -0.686 . . . . 5.47 111.254 178.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.403 ' HA ' HG21 ' A' ' 54' ' ' THR . 66.5 mtt . . . . . 0 C--O 1.223 -0.297 0 CA-C-O 121.727 0.775 . . . . 7.62 110.387 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.434 ' HB3' ' CB ' ' A' ' 57' ' ' CYS . 31.0 m -52.33 -59.16 4.74 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 114.16 -1.382 . . . . 3.91 112.757 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.543 HG13 ' HB2' ' A' ' 57' ' ' CYS . 65.6 mt -127.88 128.39 69.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 109.294 -0.632 . . . . 3.76 109.294 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.6 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 1.6 tp60 -100.12 124.68 45.8 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 107.116 -1.439 . . . . 6.79 107.116 178.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.656 ' SG ' HG22 ' A' ' 50' ' ' VAL . 26.9 t -59.7 122.45 14.17 Favored 'General case' 0 C--N 1.307 -1.239 0 C-N-CA 124.135 0.974 . . . . 5.43 111.394 -176.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.577 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 1.5 tmmm? -52.02 -31.72 30.94 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 125.363 1.465 . . . . 5.91 111.411 -178.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.656 HG22 ' SG ' ' A' ' 48' ' ' CYS . 7.4 m -63.8 -28.15 44.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 112.176 0.435 . . . . 7.94 112.176 -174.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 54.1 t -161.17 -77.62 0.05 Allowed 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 120.969 -0.292 . . . . 9.28 110.863 -178.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.464 ' O ' ' HG2' ' A' ' 52' ' ' MET . 50.1 ttm -178.24 36.55 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.039 0 CA-C-O 121.523 0.678 . . . . 9.44 109.941 -176.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.6 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 22.1 mm-40 -91.99 178.73 5.8 Favored 'General case' 0 C--O 1.188 -2.145 0 O-C-N 121.13 -0.981 . . . . 9.11 109.569 -177.515 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.517 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 27.6 m -128.01 141.35 51.54 Favored 'General case' 0 N--CA 1.413 -2.276 0 C-N-CA 118.12 -1.432 . . . . 5.93 113.385 -173.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -126.24 172.55 9.98 Favored 'General case' 0 C--O 1.242 0.677 0 C-N-CA 125.275 1.43 . . . . 5.27 107.823 174.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.436 HD13 ' N ' ' A' ' 57' ' ' CYS . 0.1 OUTLIER -96.63 132.29 41.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 N-CA-C 109.434 -0.58 . . . . 5.23 109.434 -176.585 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.543 ' HB2' HG13 ' A' ' 46' ' ' ILE . 11.4 t -103.87 85.62 2.45 Favored 'General case' 0 N--CA 1.425 -1.704 0 N-CA-C 106.811 -1.551 . . . . 4.21 106.811 176.475 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 11.2 t -56.17 1.69 0.02 OUTLIER 'General case' 0 CA--C 1.579 2.072 0 N-CA-C 115.413 1.634 . . . . 6.01 115.413 178.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 14.9 t -155.33 -164.91 1.87 Allowed 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 106.919 -1.512 . . . . 6.19 106.919 178.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 41.6 t -85.05 135.39 34.02 Favored 'General case' 0 C--N 1.281 -2.375 0 N-CA-C 107.686 -1.227 . . . . 6.47 107.686 175.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.565 ' O ' ' HG3' ' A' ' 65' ' ' ARG . 42.3 tt0 -56.49 -26.89 55.69 Favored 'General case' 0 C--O 1.196 -1.76 0 N-CA-C 110.244 -0.28 . . . . 4.86 110.244 177.039 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 86.5 t -67.09 -30.31 49.02 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 O-C-N 122.06 -0.4 . . . . 7.23 110.722 179.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -71.89 -33.16 68.12 Favored 'General case' 0 C--O 1.257 1.457 0 N-CA-C 107.155 -1.424 . . . . 9.36 107.155 178.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 61' ' ' GLU . 82.1 m -69.21 -40.93 77.71 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-N 114.249 -1.342 . . . . 5.9 109.732 173.339 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.565 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 96.0 mtt180 -60.38 -50.69 72.59 Favored 'General case' 0 CA--C 1.508 -0.642 0 C-N-CA 123.271 0.628 . . . . 7.69 112.09 -177.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -62.49 -33.98 75.96 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.208 0.527 . . . . 9.78 110.687 -179.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 41.4 t60 -75.34 -31.81 60.69 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.093 -0.503 . . . . 8.97 110.936 178.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -73.66 -44.83 55.75 Favored 'General case' 0 CA--C 1.483 -1.615 0 N-CA-C 109.784 -0.45 . . . . 6.53 109.784 179.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -71.74 -7.64 49.37 Favored 'General case' 0 C--N 1.315 -0.902 0 O-C-N 123.541 0.525 . . . . 8.5 111.155 178.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.74 -54.32 4.99 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.731 -0.668 . . . . 9.41 109.862 172.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 12.3 mmmm -88.05 -77.54 0.35 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.693 -0.685 . . . . 10.32 111.221 -177.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.25 16.8 p80 40.85 63.62 5.58 Favored Pre-proline 0 N--CA 1.468 0.463 0 N-CA-C 115.087 1.514 . . . . 7.47 115.087 -177.183 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -83.12 -61.04 0.02 OUTLIER 'Trans proline' 0 N--CA 1.431 -2.171 0 C-N-CA 120.951 1.101 . . . . 6.81 111.466 176.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 13.7 pttm -161.32 120.4 2.5 Favored 'General case' 0 N--CA 1.411 -2.421 0 N-CA-C 108.037 -1.097 . . . . 7.32 108.037 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.501 ' O ' ' HB2' ' A' ' 79' ' ' ALA . . . -73.6 100.78 3.42 Favored 'General case' 0 C--N 1.286 -2.172 0 N-CA-C 108.752 -0.833 . . . . 4.52 108.752 175.058 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -95.19 -91.82 0.21 Allowed 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.448 0.642 . . . . 6.82 111.272 -177.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.1 m -79.54 -13.81 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.073 0 N-CA-C 108.151 -1.055 . . . . 8.15 108.151 176.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 13.9 m -92.95 9.32 4.4 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.874 0 CA-C-N 114.635 -1.166 . . . . 5.65 108.603 176.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.501 ' HB2' ' O ' ' A' ' 75' ' ' ALA . . . -69.33 -11.15 60.57 Favored 'General case' 0 C--O 1.253 1.249 0 CA-C-O 121.104 0.478 . . . . 4.24 111.638 178.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 66.4 m -79.96 -23.43 41.66 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 115.627 -0.715 . . . . 5.6 109.122 174.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 3.7 p90 -140.74 67.39 28.95 Favored Pre-proline 0 CA--C 1.556 1.173 0 C-N-CA 124.547 1.139 . . . . 5.13 111.334 178.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_exo -69.03 7.45 0.79 Allowed 'Trans proline' 0 C--N 1.366 1.478 0 C-N-CA 123.645 2.897 . . . . 3.27 114.013 -174.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 49.5 m170 -90.84 -7.27 52.77 Favored 'General case' 0 C--O 1.202 -1.413 0 N-CA-C 109.171 -0.677 . . . . 4.25 109.171 177.463 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.447 ' HB3' ' HB3' ' A' ' 64' ' ' CYS . 0.2 OUTLIER . . . . . 0 N--CA 1.42 -1.929 0 CA-C-N 114.921 -1.036 . . . . 5.47 110.348 178.116 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . 0.262 23.1 ptp . . . . . 0 N--CA 1.516 2.858 0 N-CA-C 115.682 1.734 . . . . 7.62 115.682 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.413 ' HB3' ' N ' ' A' ' 57' ' ' CYS . 41.2 m 70.47 -101.07 0.04 OUTLIER 'General case' 0 N--CA 1.413 -2.295 0 N-CA-C 114.91 1.448 . . . . 3.91 114.91 176.112 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.469 ' O ' ' HA ' ' A' ' 54' ' ' THR . 66.3 mt -133.52 148.45 30.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 N-CA-C 110.169 -0.308 . . . . 3.76 110.169 -172.749 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.592 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 46.3 tt0 -110.6 143.69 40.62 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 123.417 0.687 . . . . 6.79 109.993 177.6 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.546 ' SG ' HG22 ' A' ' 50' ' ' VAL . 49.0 t -82.55 129.92 35.02 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 122.986 0.514 . . . . 5.43 111.214 178.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.404 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -52.5 -35.19 52.47 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 127.791 2.436 . . . . 5.91 110.617 -178.943 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.546 HG22 ' SG ' ' A' ' 48' ' ' CYS . 9.6 m -58.32 -23.46 22.24 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 N-CA-C 112.798 0.666 . . . . 7.94 112.798 -174.376 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.8 t -172.11 -86.27 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.846 0 O-C-N 123.473 0.483 . . . . 9.28 110.532 179.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.461 ' HA ' ' CG ' ' A' ' 47' ' ' GLN . 50.0 ttp -164.68 40.51 0.08 Allowed 'General case' 0 C--O 1.239 0.544 0 CA-C-O 122.67 1.224 . . . . 9.44 110.207 -178.062 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.592 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 19.1 mm-40 -86.97 -167.77 2.0 Favored 'General case' 0 C--O 1.205 -1.25 0 N-CA-C 108.22 -1.029 . . . . 9.11 108.22 -177.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 12.9 t -144.42 154.57 43.1 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 117.536 -1.665 . . . . 5.93 112.955 -176.271 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -130.46 162.79 28.4 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 106.116 -1.809 . . . . 5.27 106.116 176.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.569 HD13 ' H ' ' A' ' 57' ' ' CYS . 0.3 OUTLIER -88.96 148.53 4.47 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 108.083 -1.08 . . . . 5.23 108.083 -177.264 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . 0.569 ' H ' HD13 ' A' ' 56' ' ' ILE . 20.7 p -76.69 77.36 3.34 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 121.45 0.643 . . . . 4.21 111.485 179.088 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 31.7 p -60.28 -26.89 66.84 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.675 -1.148 . . . . 6.01 111.18 174.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.523 ' HB ' ' SG ' ' A' ' 64' ' ' CYS . 16.3 m -143.38 173.04 11.97 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 107.178 -1.415 . . . . 6.19 107.178 -177.327 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . 0.455 ' H ' HG22 ' A' ' 59' ' ' THR . 5.4 m -76.47 18.52 0.31 Allowed 'General case' 0 CA--C 1.556 1.191 0 N-CA-C 112.875 0.695 . . . . 6.47 112.875 -174.25 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 64.04 -62.16 0.17 Allowed 'General case' 0 N--CA 1.503 2.221 0 C-N-CA 125.375 1.47 . . . . 4.86 111.24 -176.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.671 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 92.9 t -57.01 -36.42 50.75 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.477 0 C-N-CA 123.966 0.906 . . . . 7.23 111.575 -178.026 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.475 ' HA ' ' CG ' ' A' ' 66' ' ' GLU . 4.5 mptp? -68.28 -25.93 65.4 Favored 'General case' 0 C--O 1.244 0.815 0 CA-C-O 122.076 0.941 . . . . 9.36 112.296 177.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . 0.523 ' SG ' ' HB ' ' A' ' 59' ' ' THR . 57.3 m -77.41 -38.78 49.01 Favored 'General case' 0 C--N 1.272 -2.765 0 N-CA-C 107.029 -1.471 . . . . 5.9 107.029 175.089 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.487 ' HD3' ' HA ' ' A' ' 62' ' ' VAL . 57.5 mtp180 -63.53 -38.39 90.96 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 114.234 -1.348 . . . . 7.69 111.763 178.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.671 ' HG2' ' O ' ' A' ' 62' ' ' VAL . 5.0 mm-40 -52.6 -55.17 24.26 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 107.471 -1.307 . . . . 9.78 107.471 176.423 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . 0.416 ' O ' ' HB3' ' A' ' 70' ' ' ALA . 48.8 t60 -76.14 -17.06 59.74 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-N 114.327 -1.306 . . . . 8.97 111.396 -176.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -77.92 -40.4 39.78 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 122.038 -0.414 . . . . 6.53 109.949 179.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -68.83 -16.97 63.93 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.76 0.79 . . . . 8.5 109.748 177.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 67' ' ' HIS . . . -75.08 -18.24 60.32 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 114.568 -1.196 . . . . 9.41 112.058 175.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -141.04 -83.67 0.21 Allowed 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 111.987 0.366 . . . . 10.32 111.987 -178.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . 0.535 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 27.1 p80 44.48 43.43 1.2 Allowed Pre-proline 0 N--CA 1.507 2.383 0 C-N-CA 125.732 1.613 . . . . 7.47 114.682 -179.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . 0.535 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 7.5 Cg_exo -71.88 -52.33 0.2 Allowed 'Trans proline' 0 C--N 1.368 1.57 0 C-N-CA 121.48 1.453 . . . . 6.81 111.818 -176.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -154.84 122.09 5.61 Favored 'General case' 0 N--CA 1.404 -2.743 0 N-CA-C 107.751 -1.203 . . . . 7.32 107.751 -178.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.06 120.78 30.77 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 107.88 -1.156 . . . . 4.52 107.88 171.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -96.95 -90.55 0.25 Allowed 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.31 0.576 . . . . 6.82 111.678 -172.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.2 m -86.66 -12.01 11.0 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 CA-C-O 122.259 1.028 . . . . 8.15 108.595 176.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 27.6 m -96.6 12.2 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 CA-C-N 113.954 -1.475 . . . . 5.65 108.94 176.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.94 -3.42 3.44 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-O 121.46 0.648 . . . . 4.24 110.951 177.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 17.8 p -71.11 -28.45 64.32 Favored 'General case' 0 N--CA 1.426 -1.643 0 CA-C-N 115.039 -0.982 . . . . 5.6 109.717 175.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -155.94 92.38 2.63 Favored Pre-proline 0 N--CA 1.44 -0.951 0 N-CA-C 107.195 -1.409 . . . . 5.13 107.195 171.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -63.49 8.4 0.15 Allowed 'Trans proline' 0 N--CA 1.5 1.904 0 C-N-CA 124.462 3.441 . . . . 3.27 114.603 -173.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -101.25 7.45 42.94 Favored 'General case' 0 C--N 1.287 -2.109 0 C-N-CA 120.469 -0.492 . . . . 4.25 110.022 176.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 37.6 mt . . . . . 0 CA--C 1.542 0.64 0 CA-C-N 116.422 -0.353 . . . . 5.47 111.267 -178.503 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 25.2 mmt . . . . . 0 N--CA 1.472 0.633 0 CA-C-O 121.532 0.682 . . . . 7.62 110.704 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.549 ' HB2' ' O ' ' A' ' 55' ' ' PHE . 53.1 m -75.48 -84.35 0.05 Allowed 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 114.677 1.362 . . . . 3.91 114.677 -176.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.435 ' O ' ' HA ' ' A' ' 54' ' ' THR . 31.9 mt -139.95 159.29 26.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 N-CA-C 107.812 -1.181 . . . . 3.76 107.812 -174.258 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.607 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 32.4 tt0 -112.09 149.34 32.25 Favored 'General case' 0 CA--C 1.552 1.029 0 N-CA-C 109.335 -0.617 . . . . 6.79 109.335 -176.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.456 ' SG ' HG22 ' A' ' 50' ' ' VAL . 41.6 t -85.99 145.25 27.19 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 112.408 0.521 . . . . 5.43 112.408 -177.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.457 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -66.39 -23.15 66.28 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.392 1.477 . . . . 5.91 110.371 -175.235 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.456 HG22 ' SG ' ' A' ' 48' ' ' CYS . 20.4 m -62.11 -30.06 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 CA-C-N 115.169 -0.923 . . . . 7.94 112.431 -175.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 41.9 t -176.96 -110.57 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.494 0 N-CA-C 107.3 -1.37 . . . . 9.28 107.3 -175.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 4.8 mpp? -136.44 64.28 1.56 Allowed 'General case' 0 N--CA 1.427 -1.614 0 CA-C-O 121.044 0.45 . . . . 9.44 111.6 177.095 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.607 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 23.0 mm-40 -106.25 -165.05 1.06 Allowed 'General case' 0 C--O 1.19 -2.062 0 N-CA-C 108.672 -0.862 . . . . 9.11 108.672 -178.068 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.435 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 15.0 t -144.13 151.8 40.06 Favored 'General case' 0 N--CA 1.437 -1.12 0 C-N-CA 117.991 -1.484 . . . . 5.93 112.954 -178.317 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.549 ' O ' ' HB2' ' A' ' 45' ' ' SER . 89.1 m-85 -123.29 174.55 7.24 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 107.105 -1.443 . . . . 5.27 107.105 175.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 10.2 tp -100.41 142.46 15.53 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.21 0 N-CA-C 110.057 -0.349 . . . . 5.23 110.057 -178.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 49.7 t -86.37 78.35 9.29 Favored 'General case' 0 N--CA 1.415 -2.198 0 CA-C-O 121.565 0.697 . . . . 4.21 109.244 178.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 9.4 t -73.31 -12.81 60.97 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 114.993 -1.003 . . . . 6.01 111.097 175.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 28.6 m -143.79 -89.57 0.12 Allowed 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 109.767 -0.457 . . . . 6.19 109.767 178.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 65.2 p -173.06 5.03 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 112.851 0.686 . . . . 6.47 112.851 176.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.495 ' O ' ' HG3' ' A' ' 65' ' ' ARG . 36.9 tt0 67.75 -45.58 0.49 Allowed 'General case' 0 N--CA 1.498 1.937 0 C-N-CA 123.839 0.855 . . . . 4.86 111.187 -172.113 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . 0.441 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 94.8 t -56.84 -40.18 69.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 O-C-N 121.627 -0.671 . . . . 7.23 112.468 -178.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.461 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 8.0 tmtt? -61.91 -37.74 85.78 Favored 'General case' 0 CA--C 1.561 1.392 0 CA-C-O 122.293 1.044 . . . . 9.36 109.008 179.294 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . 0.403 ' SG ' ' HA ' ' A' ' 61' ' ' GLU . 29.7 p -81.49 -19.41 42.33 Favored 'General case' 0 C--O 1.204 -1.293 0 CA-C-N 115.791 -0.641 . . . . 5.9 110.152 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . 0.495 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 97.5 mtt180 -64.68 -39.8 94.3 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 108.736 -0.838 . . . . 7.69 108.736 175.198 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 62' ' ' VAL . 24.5 mt-10 -60.13 -47.8 84.4 Favored 'General case' 0 C--O 1.245 0.867 0 CA-C-N 115.232 -0.894 . . . . 9.78 108.822 179.599 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . 0.484 ' O ' ' HB3' ' A' ' 70' ' ' ALA . 41.8 t60 -74.44 -22.31 59.19 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-N 115.072 -0.967 . . . . 8.97 111.29 -178.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -74.67 -42.26 58.79 Favored 'General case' 0 CA--C 1.492 -1.265 0 C-N-CA 119.957 -0.697 . . . . 6.53 109.231 178.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -65.76 -13.89 60.26 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.824 0.821 . . . . 8.5 110.67 176.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' A' ' 67' ' ' HIS . . . -76.23 -19.17 58.6 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.099 -0.955 . . . . 9.41 110.911 174.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -146.0 -82.89 0.14 Allowed 'General case' 0 C--O 1.211 -0.939 0 CA-C-O 121.042 0.449 . . . . 10.32 111.861 -177.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.372 4.6 p80 36.45 67.24 1.72 Allowed Pre-proline 0 N--CA 1.488 1.431 0 C-N-CA 126.58 1.952 . . . . 7.47 116.052 -173.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 13.9 Cg_exo -70.02 -61.63 0.06 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 121.39 1.393 . . . . 6.81 111.214 174.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -158.56 120.05 3.47 Favored 'General case' 0 N--CA 1.418 -2.045 0 CA-C-N 115.558 -0.747 . . . . 7.32 108.986 178.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.481 ' O ' ' HB2' ' A' ' 79' ' ' ALA . . . -77.18 115.79 17.27 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 107.769 -1.197 . . . . 4.52 107.769 173.5 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -95.53 -87.1 0.29 Allowed 'General case' 0 C--O 1.201 -1.475 0 CA-C-O 121.012 0.434 . . . . 6.82 111.389 -173.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.8 m -84.6 -14.85 11.19 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.663 0 CA-C-O 122.128 0.966 . . . . 8.15 108.774 176.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 34.1 m -94.97 11.66 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.524 0 CA-C-N 114.681 -1.145 . . . . 5.65 109.223 177.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.481 ' HB2' ' O ' ' A' ' 75' ' ' ALA . . . -65.39 -6.82 11.22 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-O 121.767 0.794 . . . . 4.24 111.646 177.322 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 18.9 p -76.53 -17.67 59.13 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 115.144 -0.934 . . . . 5.6 109.701 175.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.542 ' CD1' ' HG ' ' A' ' 84' ' ' LEU . 1.6 t80 -161.93 80.13 1.95 Allowed Pre-proline 0 CA--C 1.555 1.14 0 N-CA-C 106.506 -1.665 . . . . 5.13 106.506 178.018 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -62.93 -3.85 5.25 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 124.265 3.31 . . . . 3.27 115.696 -171.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -84.77 -6.15 59.35 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 109.268 -0.641 . . . . 4.25 109.268 -179.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.542 ' HG ' ' CD1' ' A' ' 81' ' ' PHE . 42.6 mt . . . . . 0 CA--C 1.536 0.418 0 CA-C-N 116.217 -0.447 . . . . 5.47 112.188 -174.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 64.2 mtm . . . . . 0 N--CA 1.497 1.883 0 CA-C-O 121.692 0.758 . . . . 7.62 111.417 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . 0.353 12.9 p 55.6 -108.2 0.42 Allowed 'General case' 0 N--CA 1.409 -2.49 0 N-CA-C 118.141 2.645 . . . . 3.91 118.141 177.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.584 ' O ' ' HA ' ' A' ' 54' ' ' THR . 68.7 mt -127.04 132.19 70.12 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.99 0 CA-C-N 116.604 -0.271 . . . . 3.76 110.395 -174.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.635 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 9.2 tt0 -98.1 135.12 40.22 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.222 0.534 . . . . 6.79 110.397 -178.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.587 ' SG ' HG22 ' A' ' 50' ' ' VAL . 12.9 t -70.86 133.04 46.14 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-N 115.053 -0.976 . . . . 5.43 111.913 -178.224 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.6 ttpt -57.21 -30.42 64.56 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.78 1.632 . . . . 5.91 111.599 -179.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.587 HG22 ' SG ' ' A' ' 48' ' ' CYS . 16.3 m -60.24 -27.89 40.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 N-CA-C 112.944 0.72 . . . . 7.94 112.944 -175.099 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 54.1 t -174.27 -99.84 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 109.076 -0.713 . . . . 9.28 109.076 -178.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.459 ' C ' HE21 ' A' ' 53' ' ' GLN . 2.2 mpt? -145.45 60.37 1.28 Allowed 'General case' 0 N--CA 1.426 -1.67 0 C-N-CA 122.543 0.337 . . . . 9.44 110.841 179.197 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.635 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 20.9 mm-40 -107.2 -172.49 2.09 Favored 'General case' 0 CA--C 1.481 -1.677 0 N-CA-C 108.064 -1.087 . . . . 9.11 108.064 -178.83 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.584 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 8.9 t -143.12 153.71 43.17 Favored 'General case' 0 N--CA 1.424 -1.773 0 C-N-CA 118.239 -1.384 . . . . 5.93 112.476 -177.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 99.7 m-85 -130.32 140.43 50.64 Favored 'General case' 0 C--N 1.298 -1.64 0 N-CA-C 105.489 -2.041 . . . . 5.27 105.489 176.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ILE . . . . . 0.482 HG23 HG23 ' A' ' 58' ' ' THR . 8.9 tp -67.07 147.47 12.58 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 CA-C-O 121.225 0.536 . . . . 5.23 111.368 -173.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 43.6 t -78.34 73.13 4.9 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-O 121.52 0.676 . . . . 4.21 111.583 178.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.482 HG23 HG23 ' A' ' 56' ' ' ILE . 13.4 p -79.91 -22.27 42.95 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-O 121.483 0.658 . . . . 6.01 110.0 170.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' THR . . . . . 0.419 HG21 ' HB3' ' A' ' 64' ' ' CYS . 27.2 m -116.61 150.79 37.49 Favored 'General case' 0 N--CA 1.427 -1.595 0 N-CA-C 108.286 -1.005 . . . . 6.19 108.286 177.106 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 30.8 t -82.55 14.98 2.75 Favored 'General case' 0 CA--C 1.564 1.518 0 C-N-CA 122.7 0.4 . . . . 6.47 111.189 -176.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.652 ' HA ' ' SG ' ' A' ' 64' ' ' CYS . 5.5 tp10 64.96 -60.69 0.23 Allowed 'General case' 0 C--O 1.181 -2.509 0 C-N-CA 123.899 0.88 . . . . 4.86 111.858 -176.265 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 90.3 t -57.85 -29.07 34.61 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.329 0 O-C-N 121.577 -0.702 . . . . 7.23 111.956 -176.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.433 ' O ' ' HD2' ' A' ' 63' ' ' LYS . 3.2 tmmm? -77.79 -35.64 51.25 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 109.372 -0.603 . . . . 9.36 109.372 178.224 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . 0.652 ' SG ' ' HA ' ' A' ' 61' ' ' GLU . 23.1 p -76.54 -30.1 56.98 Favored 'General case' 0 C--O 1.197 -1.708 0 C-N-CA 119.514 -0.874 . . . . 5.9 109.47 177.111 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 65.0 ttt180 -56.61 -58.36 8.4 Favored 'General case' 0 N--CA 1.437 -1.118 0 C-N-CA 124.872 1.269 . . . . 7.69 112.103 177.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -62.26 -33.38 74.51 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 122.315 1.055 . . . . 9.78 109.728 -179.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 21.3 t60 -77.76 -13.38 59.91 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-N 113.933 -1.485 . . . . 8.97 110.75 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -98.24 -47.72 5.35 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 109.617 -0.512 . . . . 6.53 109.617 178.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -54.57 -37.88 66.01 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 123.757 0.661 . . . . 8.5 111.647 -179.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -87.77 2.71 50.53 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 116.076 -0.511 . . . . 9.41 112.376 -178.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -137.67 -81.9 0.34 Allowed 'General case' 0 C--N 1.343 0.287 0 CA-C-O 120.703 0.287 . . . . 10.32 111.431 -178.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.272 18.6 p80 41.99 62.88 7.18 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 125.381 1.473 . . . . 7.47 114.416 -176.262 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_exo -45.91 -56.52 2.79 Favored 'Trans proline' 0 C--N 1.378 2.089 0 C-N-CA 124.001 3.134 . . . . 6.81 114.031 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -177.39 -23.4 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 111.773 0.286 . . . . 7.32 111.773 -179.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.583 ' HB1' ' HA ' ' A' ' 79' ' ' ALA . . . 74.69 103.08 0.07 Allowed 'General case' 0 C--N 1.358 0.977 0 C-N-CA 124.222 1.009 . . . . 4.52 110.834 -179.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -100.18 -85.66 0.4 Allowed 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 114.867 -1.06 . . . . 6.82 111.298 -176.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.3 m -81.85 -15.65 12.15 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.749 0 CA-C-O 121.889 0.852 . . . . 8.15 108.836 176.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 31.8 m -97.34 11.11 5.57 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.827 0 CA-C-N 114.707 -1.133 . . . . 5.65 109.25 177.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . 0.583 ' HA ' ' HB1' ' A' ' 75' ' ' ALA . . . -63.09 -11.26 18.6 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.514 0.673 . . . . 4.24 111.663 176.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . 0.482 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 76.9 m -82.9 -8.28 59.59 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 115.369 -0.832 . . . . 5.6 110.778 177.1 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -165.86 83.57 1.03 Allowed Pre-proline 0 C--N 1.32 -0.717 0 N-CA-C 107.734 -1.21 . . . . 5.13 107.734 171.278 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -58.08 1.73 0.22 Allowed 'Trans proline' 0 N--CA 1.498 1.755 0 C-N-CA 123.785 2.99 . . . . 3.27 116.487 -173.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 67.1 m-70 -88.73 -7.42 56.32 Favored 'General case' 0 CA--C 1.499 -0.984 0 C-N-CA 120.217 -0.593 . . . . 4.25 112.12 178.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 45.6 mt . . . . . 0 C--N 1.303 -1.446 0 C-N-CA 119.749 -0.78 . . . . 5.47 109.265 -178.667 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.5 -0.853 0 N-CA-C 110.226 -1.15 . . . . 19.14 110.226 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 12.2 p80 -153.23 16.43 0.54 Allowed 'General case' 0 N--CA 1.473 0.685 0 CA-C-N 117.983 0.892 . . . . 19.74 113.125 -179.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 34.9 t60 -174.7 -41.33 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.234 0 N-CA-C 109.678 -0.49 . . . . 17.67 109.678 178.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 60.7 t60 -167.52 169.21 12.27 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 104.737 -2.32 . . . . 14.74 104.737 177.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 32.5 m170 -62.98 -70.81 0.19 Allowed 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 118.991 0.814 . . . . 14.24 112.581 -179.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 21.8 m170 -117.48 178.26 4.45 Favored 'General case' 0 C--O 1.243 0.713 0 N-CA-C 113.164 0.802 . . . . 13.67 113.164 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 56.0 m80 -137.53 103.24 4.99 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-N 115.16 -0.927 . . . . 10.3 108.845 179.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 53.6 tp 64.24 97.78 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.886 0 O-C-N 124.568 1.168 . . . . 10.1 112.154 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -86.68 -27.38 23.78 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 115.252 -0.885 . . . . 11.87 109.236 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 126.37 -41.58 1.62 Allowed Glycine 0 C--O 1.217 -0.912 0 C-N-CA 120.936 -0.649 . . . . 9.6 111.935 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -173.19 -164.93 29.33 Favored Glycine 0 N--CA 1.439 -1.13 0 C-N-CA 120.911 -0.662 . . . . 8.45 111.823 -178.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 146.98 -93.9 0.16 Allowed Glycine 0 N--CA 1.422 -2.273 0 N-CA-C 110.63 -0.988 . . . . 9.24 110.63 -178.702 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 7.0 t30 60.87 97.63 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 124.419 1.088 . . . . 9.68 112.228 -177.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -157.87 174.3 15.49 Favored 'General case' 0 C--N 1.311 -1.082 0 N-CA-C 108.309 -0.997 . . . . 11.12 108.309 -179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.453 ' HG3' ' HG3' ' A' ' 16' ' ' LYS . 29.1 pt20 -58.8 -34.81 71.91 Favored 'General case' 0 CA--C 1.558 1.253 0 CA-C-O 121.491 0.663 . . . . 15.18 111.444 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.453 ' HG3' ' HG3' ' A' ' 15' ' ' GLN . 66.0 mttm -88.27 21.24 2.9 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.014 -0.539 . . . . 15.42 110.914 -178.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 27.8 t -97.43 -18.77 18.87 Favored 'General case' 0 C--N 1.311 -1.103 0 O-C-N 121.814 -0.554 . . . . 11.21 111.402 -178.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -42.88 -34.91 1.04 Allowed 'General case' 0 N--CA 1.494 1.731 0 N-CA-C 115.788 1.773 . . . . 13.14 115.788 -173.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 64.4 mtm -124.45 -40.09 2.26 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 121.635 -0.666 . . . . 14.08 112.059 179.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.65 -46.06 84.1 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.271 -0.422 . . . . 9.77 112.013 -177.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.96 24.99 10.51 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 122.914 0.486 . . . . 10.29 111.107 -176.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.16 -33.14 70.56 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-O 122.024 0.916 . . . . 9.15 111.327 179.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm -91.27 3.08 55.75 Favored 'General case' 0 CA--C 1.481 -1.692 0 CA-C-N 115.71 -0.677 . . . . 11.12 111.339 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -85.82 -53.69 4.97 Favored 'General case' 0 N--CA 1.416 -2.173 0 C-N-CA 118.424 -1.31 . . . . 6.46 108.28 -178.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 49.1 tp -178.04 114.01 0.08 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.281 -0.872 . . . . 6.81 110.616 178.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -112.85 -16.91 12.63 Favored 'General case' 0 C--N 1.306 -1.312 0 CA-C-N 115.699 -0.682 . . . . 7.7 109.453 174.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 52.0 mttp 64.29 -85.19 0.02 OUTLIER 'General case' 0 C--N 1.352 0.716 0 CA-C-N 115.895 -0.593 . . . . 8.86 110.773 -170.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 164.12 -56.65 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 125.844 1.658 . . . . 6.48 108.012 179.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 35.3 mtmm -113.95 140.77 48.13 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 114.634 -1.166 . . . . 10.01 109.898 179.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.46 -19.08 64.54 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 112.832 0.678 . . . . 7.43 112.832 -175.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -135.8 -66.49 0.56 Allowed 'General case' 0 C--N 1.299 -1.59 0 CA-C-O 121.345 0.593 . . . . 8.16 109.916 -179.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 157.83 -128.86 2.19 Favored Glycine 0 N--CA 1.422 -2.26 0 N-CA-C 110.737 -0.945 . . . . 7.69 110.737 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -155.66 -34.64 0.09 Allowed 'General case' 0 C--N 1.297 -1.674 0 N-CA-C 108.595 -0.891 . . . . 8.86 108.595 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 163.87 -154.43 25.31 Favored Glycine 0 N--CA 1.418 -2.506 0 N-CA-C 107.984 -2.046 . . . . 8.28 107.984 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.497 ' HA ' ' HG3' ' A' ' 38' ' ' GLU . 32.2 t 69.85 88.57 0.11 Allowed 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 123.634 0.773 . . . . 9.53 112.14 177.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.417 ' C ' ' H ' ' A' ' 38' ' ' GLU . 18.1 tm0? -132.4 124.15 28.11 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 105.701 -1.963 . . . . 11.91 105.701 178.207 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 49.1 tp 69.73 -3.81 1.59 Allowed 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 124.065 0.946 . . . . 10.08 110.913 -176.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.497 ' HG3' ' HA ' ' A' ' 35' ' ' SER . 6.8 mm-40 -73.73 170.44 15.26 Favored 'General case' 0 C--N 1.317 -0.806 0 C-N-CA 125.507 1.523 . . . . 7.86 111.35 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -89.99 168.88 11.67 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.468 -0.787 . . . . 5.92 109.024 178.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -62.86 113.48 3.08 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.985 0.898 . . . . 6.88 111.909 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -117.32 17.97 14.54 Favored 'General case' 0 N--CA 1.427 -1.623 0 CA-C-O 121.543 0.687 . . . . 7.95 109.996 -177.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.1 8.33 18.45 Favored 'General case' 0 N--CA 1.478 0.941 0 N-CA-C 108.844 -0.799 . . . . 8.17 108.844 177.036 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -85.62 -5.69 59.24 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.353 -0.84 . . . . 5.93 111.78 -175.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 65.7 mtt 67.71 79.1 0.23 Allowed 'General case' 0 N--CA 1.465 0.296 0 O-C-N 124.08 0.862 . . . . 7.62 109.062 -174.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.8 p -71.95 -87.33 0.02 OUTLIER 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 115.308 1.595 . . . . 3.91 115.308 -176.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.572 ' O ' ' HA ' ' A' ' 54' ' ' THR . 80.6 mt -131.62 124.6 54.5 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.739 0 CA-C-N 116.036 -0.529 . . . . 3.76 110.641 -175.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.694 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 39.7 tt0 -86.49 137.46 32.52 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.149 0.5 . . . . 6.79 110.078 177.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.603 ' SG ' HG22 ' A' ' 50' ' ' VAL . 42.4 t -77.76 130.7 37.06 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 115.015 -0.993 . . . . 5.43 111.17 178.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.533 ' HD2' ' O ' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -58.51 -27.99 65.0 Favored 'General case' 0 C--N 1.306 -1.316 0 CA-C-N 113.593 -1.639 . . . . 5.91 111.124 -178.092 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.603 HG22 ' SG ' ' A' ' 48' ' ' CYS . 8.1 m -61.19 -31.29 49.75 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 N-CA-C 112.084 0.402 . . . . 7.94 112.084 -176.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.8 t -161.37 -82.01 0.04 OUTLIER 'General case' 0 N--CA 1.44 -0.96 0 CA-C-O 120.779 0.323 . . . . 9.28 110.863 -179.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 37.6 tpp -164.38 22.1 0.06 Allowed 'General case' 0 N--CA 1.473 0.713 0 CA-C-O 121.568 0.699 . . . . 9.44 109.267 -175.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.694 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 20.7 mm-40 -84.09 -167.81 1.9 Allowed 'General case' 0 CA--C 1.492 -1.282 0 C-N-CA 120.436 -0.506 . . . . 9.11 109.946 -171.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.572 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 11.3 t -141.46 161.08 38.78 Favored 'General case' 0 N--CA 1.419 -2.002 0 C-N-CA 118.521 -1.271 . . . . 5.93 112.833 -175.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 87.3 m-85 -140.04 153.18 46.72 Favored 'General case' 0 N--CA 1.436 -1.15 0 C-N-CA 126.732 2.013 . . . . 5.27 107.55 178.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 6.9 tp -73.39 136.13 26.11 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.473 0 CA-C-O 121.218 0.532 . . . . 5.23 112.081 -177.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 53.8 t -78.27 74.13 4.81 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-O 121.48 0.657 . . . . 4.21 110.443 176.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 25.3 m -87.03 -5.71 58.98 Favored 'General case' 0 N--CA 1.428 -1.547 0 N-CA-C 107.77 -1.196 . . . . 6.01 107.77 171.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 92.2 m -148.18 138.7 22.88 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 107.805 -1.183 . . . . 6.19 107.805 178.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.3 p -71.36 -81.38 0.05 Allowed 'General case' 0 CA--C 1.55 0.954 0 O-C-N 123.523 0.514 . . . . 6.47 112.074 -177.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.83 ' HA ' ' SG ' ' A' ' 64' ' ' CYS . 42.8 tt0 178.99 -36.13 0.01 OUTLIER 'General case' 0 C--O 1.209 -1.047 0 C-N-CA 124.873 1.269 . . . . 4.86 108.237 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.469 ' O ' ' HB3' ' A' ' 65' ' ' ARG . 80.8 t -70.49 -37.57 70.66 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 C-N-CA 120.569 -0.452 . . . . 7.23 110.865 175.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.597 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 1.0 OUTLIER -72.81 -26.68 61.59 Favored 'General case' 0 CA--C 1.553 1.079 0 N-CA-C 108.924 -0.769 . . . . 9.36 108.924 178.439 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . 0.83 ' SG ' ' HA ' ' A' ' 61' ' ' GLU . 28.9 p -82.71 -25.26 33.1 Favored 'General case' 0 C--O 1.205 -1.248 0 C-N-CA 118.634 -1.226 . . . . 5.9 110.26 176.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.469 ' HB3' ' O ' ' A' ' 62' ' ' VAL . 68.0 ttt180 -57.62 -47.71 81.45 Favored 'General case' 0 N--CA 1.441 -0.913 0 C-N-CA 123.869 0.867 . . . . 7.69 110.665 174.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -65.74 -35.62 81.25 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-O 121.496 0.665 . . . . 9.78 110.069 178.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 55.8 t60 -74.06 -24.14 59.48 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.733 -0.667 . . . . 8.97 111.066 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.616 ' HB1' ' N ' ' A' ' 86' ' ' LYS . . . -74.79 -56.81 4.39 Favored 'General case' 0 C--N 1.298 -1.663 0 CA-C-N 115.891 -0.595 . . . . 6.53 110.617 -177.007 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.443 ' OE1' ' HD2' ' A' ' 86' ' ' LYS . 5.5 mm-40 -58.52 -34.51 71.05 Favored 'General case' 0 C--N 1.317 -0.813 0 O-C-N 123.751 0.657 . . . . 8.5 111.561 179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -77.26 -12.45 59.95 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 115.118 -0.946 . . . . 9.41 112.568 -179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm -132.58 -84.57 0.48 Allowed 'General case' 0 CA--C 1.502 -0.883 0 N-CA-C 112.866 0.691 . . . . 10.32 112.866 -176.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.635 ' HB3' ' N ' ' A' ' 86' ' ' LYS . 25.6 p80 42.49 60.26 9.91 Favored Pre-proline 0 N--CA 1.479 1.015 0 N-CA-C 113.97 1.1 . . . . 7.47 113.97 -175.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.433 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 24.9 Cg_exo -64.7 -60.65 0.13 Allowed 'Trans proline' 0 C--N 1.35 0.642 0 C-N-CA 122.143 1.895 . . . . 6.81 111.412 -178.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 23.5 pttm -165.21 20.41 0.05 OUTLIER 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.183 -0.462 . . . . 7.32 110.701 -179.542 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.512 ' HB1' ' HA ' ' A' ' 79' ' ' ALA . . . 64.07 -82.3 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.594 -0.73 . . . . 4.52 109.254 -172.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 33.4 t70 53.78 -88.43 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 124.538 1.135 . . . . 6.82 113.693 175.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.7 m -73.35 -24.01 20.14 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.05 0 N-CA-C 109.585 -0.524 . . . . 8.15 109.585 177.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.521 ' HB ' ' HB2' ' A' ' 84' ' ' LEU . 19.0 m -104.43 13.96 7.21 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.376 0 CA-C-N 115.872 -0.603 . . . . 5.65 110.439 176.498 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.512 ' HA ' ' HB1' ' A' ' 75' ' ' ALA . . . -70.35 -14.58 62.64 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 121.484 0.659 . . . . 4.24 110.153 177.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 82.5 m -76.8 -19.65 57.32 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-N 114.908 -1.042 . . . . 5.6 110.491 177.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.596 ' O ' ' HG ' ' A' ' 84' ' ' LEU . 34.4 t80 -155.58 83.97 3.55 Favored Pre-proline 0 N--CA 1.447 -0.615 0 N-CA-C 107.353 -1.351 . . . . 5.13 107.353 176.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -63.19 3.44 0.58 Allowed 'Trans proline' 0 C--O 1.197 -1.552 0 C-N-CA 123.676 2.917 . . . . 3.27 115.312 -172.168 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 66.6 m-70 -72.73 -8.44 55.43 Favored 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 119.177 0.899 . . . . 4.25 110.842 174.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 81' ' ' PHE . 11.0 mt -94.92 2.4 55.39 Favored 'General case' 0 N--CA 1.416 -2.155 0 N-CA-C 107.15 -1.426 . . . . 5.47 107.15 -178.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.671 ' HD3' ' O ' ' A' ' 85' ' ' LYS . 2.3 tmtm? -141.46 105.16 4.71 Favored 'General case' 0 CA--C 1.558 1.259 0 C-N-CA 124.773 1.229 . . . . 8.04 112.579 179.235 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.635 ' N ' ' HB3' ' A' ' 72' ' ' HIS . 16.9 tptp . . . . . 0 N--CA 1.498 1.964 0 CA-C-O 118.758 -0.639 . . . . 11.1 112.652 178.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.207 -1.556 0 N-CA-C 112.041 -0.424 . . . . 19.14 112.041 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -110.74 179.23 4.12 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 117.047 0.424 . . . . 19.74 109.86 -177.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 50.3 m80 -97.51 -56.35 2.55 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 112.256 0.465 . . . . 17.67 112.256 -177.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 41.1 t60 -132.37 119.0 20.11 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.562 0.696 . . . . 14.74 110.232 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 12.2 t-80 -88.91 102.98 15.59 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 115.272 -0.876 . . . . 14.24 110.844 -179.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 7.0 p-80 -80.31 158.17 26.18 Favored 'General case' 0 C--O 1.244 0.779 0 N-CA-C 109.667 -0.494 . . . . 13.67 109.667 177.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -145.55 154.0 41.71 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 118.988 -0.53 . . . . 10.3 109.87 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 2.4 tm? 73.85 -68.31 0.23 Allowed 'General case' 0 N--CA 1.488 1.457 0 O-C-N 124.31 1.006 . . . . 10.1 109.218 -178.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -85.48 100.17 11.71 Favored 'General case' 0 N--CA 1.433 -1.288 0 CA-C-O 121.853 0.835 . . . . 11.87 110.054 178.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.01 131.33 7.26 Favored Glycine 0 N--CA 1.42 -2.379 0 CA-C-N 114.275 -1.329 . . . . 9.6 111.079 -179.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -138.37 -139.74 3.89 Favored Glycine 0 N--CA 1.429 -1.803 0 C-N-CA 119.981 -1.104 . . . . 8.45 111.794 -178.131 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 156.31 -69.47 0.28 Allowed Glycine 0 N--CA 1.438 -1.219 0 N-CA-C 109.968 -1.253 . . . . 9.24 109.968 -178.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 13.8 m120 72.63 147.25 0.08 Allowed 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 124.199 1.0 . . . . 9.68 112.049 179.199 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -169.91 -74.35 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.819 0 CA-C-O 121.015 0.436 . . . . 11.12 111.583 -178.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 10.8 pt20 -114.0 137.34 51.83 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.05 -0.523 . . . . 15.18 110.601 -178.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.572 ' HA ' ' HE3' ' A' ' 16' ' ' LYS . 0.0 OUTLIER 68.04 -10.97 0.38 Allowed 'General case' 0 N--CA 1.494 1.761 0 C-N-CA 123.996 0.918 . . . . 15.42 112.883 176.936 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 21.5 p -77.86 31.82 0.17 Allowed 'General case' 0 CA--C 1.549 0.907 0 N-CA-C 113.56 0.948 . . . . 11.21 113.56 -176.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.04 -43.5 87.34 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 122.94 0.496 . . . . 13.14 111.073 -179.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 22.7 ptp -93.67 -19.43 21.13 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.092 0.472 . . . . 14.08 110.228 178.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.15 -33.77 73.94 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.562 -0.745 . . . . 9.77 111.134 -177.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.5 ptp180 -59.47 -28.98 67.49 Favored 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 111.727 0.269 . . . . 10.29 111.727 179.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -78.52 6.57 8.31 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 121.351 0.596 . . . . 9.15 111.015 -178.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -131.08 -0.46 4.13 Favored 'General case' 0 C--N 1.316 -0.859 0 N-CA-C 108.627 -0.879 . . . . 11.12 108.627 175.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -109.55 -72.65 0.71 Allowed 'General case' 0 N--CA 1.435 -1.193 0 C-N-CA 119.635 -0.826 . . . . 6.46 111.571 -176.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 95.7 mt -142.31 127.4 18.5 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 116.202 -0.453 . . . . 6.81 110.358 -176.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -138.22 135.84 35.98 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 109.485 -0.561 . . . . 7.7 109.485 179.677 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -127.42 105.26 8.39 Favored 'General case' 0 N--CA 1.433 -1.298 0 N-CA-C 108.751 -0.833 . . . . 8.86 108.751 178.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.447 ' C ' ' HD2' ' A' ' 29' ' ' LYS . . . -127.74 -54.8 1.32 Allowed 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 108.962 -0.755 . . . . 6.48 108.962 176.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.447 ' HD2' ' C ' ' A' ' 28' ' ' ALA . 13.2 mptt -129.21 168.01 16.8 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.897 -0.592 . . . . 10.01 109.734 173.652 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.81 -27.99 62.3 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.014 0.435 . . . . 7.43 111.771 -178.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -155.85 -69.41 0.11 Allowed 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.19 -0.459 . . . . 8.16 110.482 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 84.46 -66.11 3.95 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.941 -0.647 . . . . 7.69 111.498 179.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -162.47 168.79 21.43 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 108.232 -1.025 . . . . 8.86 108.232 179.153 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -132.93 -117.49 1.83 Allowed Glycine 0 N--CA 1.431 -1.651 0 N-CA-C 110.899 -0.88 . . . . 8.28 110.899 178.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 82.3 p 59.16 -166.56 0.17 Allowed 'General case' 0 CA--C 1.557 1.215 0 C-N-CA 125.144 1.378 . . . . 9.53 112.654 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -177.38 -33.47 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.313 0 CA-C-O 121.54 0.686 . . . . 11.91 109.531 -177.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.3 pp -79.23 10.23 3.84 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 113.992 1.108 . . . . 10.08 113.992 -179.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -77.27 -20.05 55.65 Favored 'General case' 0 C--N 1.31 -1.126 0 C-N-CA 120.71 -0.396 . . . . 7.86 111.79 -177.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 70.35 -82.14 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.669 1.188 . . . . 5.92 112.464 -178.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 38.2 t30 -168.2 134.32 1.94 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 120.771 0.32 . . . . 6.88 110.181 -178.443 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -90.78 -32.65 16.03 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.166 -0.47 . . . . 7.95 110.324 -178.257 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp 67.73 102.21 0.05 Allowed 'General case' 0 C--N 1.368 1.376 0 O-C-N 124.325 1.016 . . . . 8.17 110.582 -173.001 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . 68.97 9.1 7.23 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.752 0.821 . . . . 5.93 111.983 179.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 28.0 ttt 69.37 7.52 6.27 Favored 'General case' 0 CA--C 1.555 1.142 0 C-N-CA 124.041 0.937 . . . . 7.62 112.128 177.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.484 ' OG ' HG13 ' A' ' 46' ' ' ILE . 41.2 t 56.16 -96.78 0.07 Allowed 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 113.971 1.1 . . . . 3.91 113.971 179.689 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.484 HG13 ' OG ' ' A' ' 45' ' ' SER . 14.4 mt -124.67 160.96 28.89 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 C-N-CA 123.395 0.678 . . . . 3.76 109.989 -176.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.659 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 7.5 tt0 -120.11 131.22 54.97 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 123.227 0.611 . . . . 6.79 109.399 177.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.651 ' SG ' HG22 ' A' ' 50' ' ' VAL . 21.3 t -68.83 134.51 49.77 Favored 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 124.238 1.015 . . . . 5.43 111.91 -177.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.453 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -62.68 -29.35 70.58 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.82 1.648 . . . . 5.91 109.806 -177.731 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.651 HG22 ' SG ' ' A' ' 48' ' ' CYS . 11.6 m -62.14 -25.5 37.65 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.164 -0.471 . . . . 7.94 112.169 -174.243 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.469 ' SG ' ' HG2' ' A' ' 52' ' ' MET . 47.6 t -169.26 -77.2 0.02 OUTLIER 'General case' 0 N--CA 1.438 -1.032 0 O-C-N 123.406 0.442 . . . . 9.28 110.776 179.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.469 ' HG2' ' SG ' ' A' ' 51' ' ' CYS . 19.8 ptm -169.41 32.28 0.02 OUTLIER 'General case' 0 C--O 1.21 -1.025 0 CA-C-N 116.273 -0.421 . . . . 9.44 111.732 -176.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.659 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 17.2 mm-40 -90.82 -166.14 1.51 Allowed 'General case' 0 C--O 1.205 -1.276 0 N-CA-C 108.924 -0.769 . . . . 9.11 108.924 -173.496 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.8 t -135.99 167.39 21.31 Favored 'General case' 0 C--N 1.289 -2.031 0 C-N-CA 118.442 -1.303 . . . . 5.93 112.277 -175.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.448 ' O ' ' HB3' ' A' ' 45' ' ' SER . 89.5 m-85 -135.17 153.61 51.91 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 106.095 -1.817 . . . . 5.27 106.095 175.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 7.9 tp -83.81 133.67 28.67 Favored 'Isoleucine or valine' 0 C--O 1.251 1.145 0 O-C-N 123.644 0.59 . . . . 5.23 110.929 -177.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 49.0 t -71.6 74.4 0.8 Allowed 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 121.633 0.73 . . . . 4.21 112.217 176.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 18.0 p -82.11 -3.77 55.48 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 109.158 -0.682 . . . . 6.01 109.158 169.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 87.3 m -161.66 149.83 15.22 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.009 -1.478 . . . . 6.19 107.009 178.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.0 t -79.71 139.92 37.16 Favored 'General case' 0 N--CA 1.419 -1.983 0 N-CA-C 106.981 -1.489 . . . . 6.47 106.981 179.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -53.25 -32.91 50.74 Favored 'General case' 0 C--O 1.206 -1.218 0 O-C-N 123.826 0.704 . . . . 4.86 110.534 -178.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.459 ' O ' ' HB3' ' A' ' 65' ' ' ARG . 67.7 t -62.09 -31.8 52.5 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.096 0 N-CA-C 112.832 0.678 . . . . 7.23 112.832 -177.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.587 ' O ' ' HD2' ' A' ' 63' ' ' LYS . 1.0 OUTLIER -79.85 -35.88 37.56 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 118.171 -1.411 . . . . 9.36 107.338 179.216 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 69.1 m -67.15 -27.88 67.67 Favored 'General case' 0 C--N 1.312 -1.03 0 N-CA-C 109.123 -0.695 . . . . 5.9 109.123 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.459 ' HB3' ' O ' ' A' ' 62' ' ' VAL . 72.7 ttt180 -60.61 -54.85 40.38 Favored 'General case' 0 N--CA 1.426 -1.666 0 C-N-CA 124.607 1.163 . . . . 7.69 112.17 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -63.68 -33.84 76.52 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-O 121.079 0.466 . . . . 9.78 110.39 -178.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -70.73 -37.36 73.47 Favored 'General case' 0 N--CA 1.438 -1.031 0 N-CA-C 109.167 -0.679 . . . . 8.97 109.167 179.571 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.72 -48.39 54.82 Favored 'General case' 0 N--CA 1.436 -1.172 0 CA-C-N 115.954 -0.567 . . . . 6.53 111.878 -178.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -71.73 -17.98 62.17 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.509 0.559 . . . . 8.5 112.509 -176.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -93.7 -18.17 22.42 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 116.417 -0.356 . . . . 9.41 111.28 176.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -118.27 -81.01 0.62 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 111.784 0.29 . . . . 10.32 111.784 -178.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.476 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 30.8 p80 44.47 54.21 11.99 Favored Pre-proline 0 N--CA 1.498 1.934 0 N-CA-C 114.449 1.277 . . . . 7.47 114.449 -178.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.476 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 5.3 Cg_exo -75.59 -58.87 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.126 0 C-N-CA 121.686 1.591 . . . . 6.81 113.17 -178.435 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -159.73 104.91 1.59 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 121.487 0.661 . . . . 7.32 112.066 -175.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -85.74 113.15 21.7 Favored 'General case' 0 C--N 1.292 -1.896 0 CA-C-N 116.057 -0.52 . . . . 4.52 109.788 175.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -115.12 -76.79 0.57 Allowed 'General case' 0 N--CA 1.483 1.176 0 N-CA-C 111.89 0.33 . . . . 6.82 111.89 -179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 28.2 m -73.81 -18.94 17.57 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.743 0 CA-C-O 122.368 1.08 . . . . 8.15 108.977 176.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 35.5 m -105.59 15.83 6.71 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.37 0 CA-C-N 114.359 -1.292 . . . . 5.65 109.803 175.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.58 -15.89 59.33 Favored 'General case' 0 N--CA 1.5 2.037 0 CA-C-O 121.905 0.859 . . . . 4.24 110.018 175.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.61 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 64.4 m -67.59 -16.78 64.36 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 114.285 -1.325 . . . . 5.6 110.49 176.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.487 ' CE2' ' HB2' ' A' ' 83' ' ' HIS . 14.2 t80 -167.85 89.32 0.69 Allowed Pre-proline 0 N--CA 1.444 -0.771 0 N-CA-C 108.052 -1.092 . . . . 5.13 108.052 171.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_exo -63.91 3.91 0.63 Allowed 'Trans proline' 0 N--CA 1.505 2.206 0 C-N-CA 124.087 3.192 . . . . 3.27 114.504 -173.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.487 ' HB2' ' CE2' ' A' ' 81' ' ' PHE . 13.2 m-70 -88.92 -0.67 57.6 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 109.258 -0.645 . . . . 4.25 109.258 177.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 49.0 mt -109.5 8.11 25.05 Favored 'General case' 0 C--N 1.344 0.327 0 CA-C-N 116.413 -0.358 . . . . 5.47 111.748 -177.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.2 mmmt -67.61 155.93 37.99 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-O 122.259 1.028 . . . . 8.04 113.694 -179.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 23.0 tptm . . . . . 0 C--N 1.292 -1.897 0 CA-C-N 112.988 -1.915 . . . . 11.1 109.227 -178.651 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.502 -0.729 0 N-CA-C 110.945 -0.862 . . . . 19.14 110.945 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 14.6 t-80 -113.51 -48.72 2.93 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 117.09 0.445 . . . . 19.74 111.238 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 11.0 t-160 -108.19 127.9 54.23 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 109.343 -0.614 . . . . 17.67 109.343 -179.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -65.82 152.39 44.49 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 120.915 0.388 . . . . 14.74 111.456 -179.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 45.3 m80 -125.29 152.63 44.41 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 109.25 -0.648 . . . . 14.24 109.25 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.5 p80 -74.33 141.65 45.2 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 120.738 -0.385 . . . . 13.67 110.977 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 60.5 m80 -128.61 156.19 43.78 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 116.419 -0.355 . . . . 10.3 110.24 -177.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 49.6 tp 72.84 153.93 0.14 Allowed 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.583 1.153 . . . . 10.1 112.163 177.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.8 tp10 64.98 19.28 11.82 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.081 1.352 . . . . 11.87 109.24 178.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -176.38 171.84 44.82 Favored Glycine 0 N--CA 1.426 -1.981 0 N-CA-C 109.279 -1.529 . . . . 9.6 109.279 -178.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 156.8 -37.0 0.57 Allowed Glycine 0 C--O 1.216 -0.97 0 N-CA-C 111.27 -0.732 . . . . 8.45 111.27 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 113.16 -14.03 23.63 Favored Glycine 0 N--CA 1.443 -0.881 0 C-N-CA 120.404 -0.903 . . . . 9.24 112.765 178.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 15.2 m120 67.06 -170.65 0.19 Allowed 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.316 0.646 . . . . 9.68 110.473 179.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.446 ' H ' ' HB2' ' A' ' 17' ' ' SER . . . -167.05 -103.09 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 122.619 0.368 . . . . 11.12 111.565 178.069 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 13.4 mm100 -107.97 -72.25 0.73 Allowed 'General case' 0 C--O 1.217 -0.611 0 CA-C-O 121.479 0.657 . . . . 15.18 110.612 -177.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -81.46 3.65 23.9 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-O 121.902 0.858 . . . . 15.42 110.508 -177.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.446 ' HB2' ' H ' ' A' ' 14' ' ' ALA . 19.2 m -81.17 16.94 1.38 Allowed 'General case' 0 N--CA 1.428 -1.54 0 CA-C-N 114.888 -1.051 . . . . 11.21 110.526 -178.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -73.49 -24.32 60.17 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.342 -0.39 . . . . 13.14 110.532 178.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 23.1 ptp -160.91 -28.82 0.06 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.097 -0.501 . . . . 14.08 111.941 179.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -63.97 -45.77 87.61 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 120.292 -0.563 . . . . 9.77 109.483 178.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 69.5 mtp180 -137.38 72.69 1.42 Allowed 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.429 -0.805 . . . . 10.29 109.175 175.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.96 120.31 22.64 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.4 -0.592 . . . . 9.15 109.4 179.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . 0.307 7.1 ptpp? 45.81 74.58 0.13 Allowed 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.4 1.259 . . . . 11.12 114.4 -175.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -148.09 151.77 36.21 Favored 'General case' 0 N--CA 1.411 -2.391 0 CA-C-N 115.467 -0.788 . . . . 6.46 109.403 -178.532 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 53.3 tp -135.29 -79.6 0.43 Allowed 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 108.858 -0.793 . . . . 6.81 108.858 177.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -117.74 173.06 6.96 Favored 'General case' 0 C--O 1.244 0.77 0 N-CA-C 108.368 -0.975 . . . . 7.7 108.368 177.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -116.93 104.78 11.63 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.178 -0.675 . . . . 8.86 109.178 177.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -160.32 176.6 11.51 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.795 -0.446 . . . . 6.48 109.795 -177.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -72.33 111.46 7.55 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.198 0.523 . . . . 10.01 111.679 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -148.92 166.61 28.07 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-N 115.954 -0.566 . . . . 7.43 109.802 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.64 -18.96 26.87 Favored 'General case' 0 C--O 1.245 0.825 0 CA-C-N 115.8 -0.636 . . . . 8.16 110.795 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 64.41 -114.97 7.3 Favored Glycine 0 C--N 1.339 0.723 0 CA-C-N 115.408 -0.814 . . . . 7.69 111.53 -178.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm 72.9 -53.92 0.7 Allowed 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 125.478 1.511 . . . . 8.86 113.584 175.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 104.97 103.08 2.83 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 121.39 -0.434 . . . . 8.28 112.641 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.9 t -168.86 135.22 1.78 Allowed 'General case' 0 C--O 1.248 1.026 0 N-CA-C 108.996 -0.742 . . . . 9.53 108.996 179.161 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.5 pt20 -153.22 142.23 21.28 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.638 -0.505 . . . . 11.91 109.638 178.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.3 mp 70.49 -45.25 0.59 Allowed 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 124.93 1.292 . . . . 10.08 113.552 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -72.26 -67.12 0.57 Allowed 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 123.591 0.756 . . . . 7.86 110.984 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 67.44 14.13 9.53 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.242 1.017 . . . . 5.92 112.431 179.854 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 53.9 m-80 -77.76 123.18 26.37 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.772 -0.195 . . . . 6.88 111.347 179.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -139.98 20.16 2.46 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-O 122.712 1.244 . . . . 7.95 108.698 178.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -69.47 153.26 43.79 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-N 115.091 -0.959 . . . . 8.17 110.104 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . 66.76 9.56 6.82 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.01 0.924 . . . . 5.93 113.022 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 65.8 mtt 72.32 16.78 5.0 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.303 0.641 . . . . 7.62 112.273 178.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.5 p 51.67 -104.76 0.19 Allowed 'General case' 0 N--CA 1.44 -0.936 0 N-CA-C 116.347 1.98 . . . . 3.91 116.347 177.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.433 ' O ' ' HA ' ' A' ' 54' ' ' THR . 59.0 mt -118.35 143.75 28.36 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.948 0 N-CA-C 109.657 -0.498 . . . . 3.76 109.657 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.565 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 1.1 tp-100 -112.19 133.82 54.09 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 106.549 -1.648 . . . . 6.79 106.549 178.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.593 ' SG ' HG22 ' A' ' 50' ' ' VAL . 35.7 t -66.28 135.72 54.82 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 124.512 1.125 . . . . 5.43 113.024 -175.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.403 ' HD2' ' O ' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -64.31 -26.59 68.55 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.1 1.36 . . . . 5.91 110.168 -178.266 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.593 HG22 ' SG ' ' A' ' 48' ' ' CYS . 5.4 m -66.52 -33.19 61.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 CA-C-O 120.843 0.354 . . . . 7.94 111.797 -175.202 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 83.9 m -156.67 -83.11 0.06 Allowed 'General case' 0 N--CA 1.433 -1.318 0 CA-C-N 115.801 -0.636 . . . . 9.28 110.792 -174.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 52.1 ttp 179.9 47.51 0.0 OUTLIER 'General case' 0 C--O 1.214 -0.768 0 N-CA-C 108.471 -0.937 . . . . 9.44 108.471 -178.478 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.565 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 21.2 mm-40 -101.56 -178.29 3.68 Favored 'General case' 0 C--O 1.173 -2.927 0 N-CA-C 107.263 -1.384 . . . . 9.11 107.263 -178.259 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.433 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 9.5 t -125.7 154.12 42.89 Favored 'General case' 0 C--N 1.286 -2.16 0 C-N-CA 117.53 -1.668 . . . . 5.93 113.574 -175.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.453 ' HE2' ' SG ' ' A' ' 48' ' ' CYS . 86.7 m-85 -137.59 147.9 45.43 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 113.867 -1.515 . . . . 5.27 107.634 177.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.495 HG13 ' H ' ' A' ' 58' ' ' THR . 9.2 tp -73.7 132.18 33.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 N-CA-C 109.402 -0.592 . . . . 5.23 109.402 -179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 24.9 p -74.43 -18.98 60.57 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.03 0.381 . . . . 4.21 112.03 -176.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.495 ' H ' HG13 ' A' ' 56' ' ' ILE 0.25 13.6 t 54.34 -4.89 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 127.26 2.224 . . . . 6.01 115.152 177.739 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 87.0 m -155.93 -83.9 0.06 Allowed 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 109.319 -0.623 . . . . 6.19 109.319 178.09 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 18.0 p -161.2 10.36 0.09 Allowed 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 112.242 0.46 . . . . 6.47 112.242 -178.202 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.568 ' O ' ' HG3' ' A' ' 65' ' ' ARG . 26.7 tt0 68.51 -52.04 0.56 Allowed 'General case' 0 C--O 1.183 -2.416 0 C-N-CA 124.523 1.129 . . . . 4.86 110.806 -177.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.526 HG12 ' CZ ' ' A' ' 65' ' ' ARG . 35.7 m -55.37 -39.18 51.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 O-C-N 121.354 -0.841 . . . . 7.23 112.77 -178.322 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.3 tmtp? -60.46 -42.28 95.87 Favored 'General case' 0 C--N 1.306 -1.3 0 CA-C-N 115.357 -0.838 . . . . 9.36 109.496 178.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 28.5 p -78.19 -31.81 49.71 Favored 'General case' 0 N--CA 1.428 -1.544 0 C-N-CA 119.85 -0.74 . . . . 5.9 109.621 178.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.568 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 22.3 mtm180 -59.68 -50.26 74.56 Favored 'General case' 0 CA--C 1.5 -0.966 0 N-CA-C 111.921 0.341 . . . . 7.69 111.921 179.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -66.73 -33.79 76.41 Favored 'General case' 0 C--O 1.236 0.366 0 O-C-N 123.741 0.65 . . . . 9.78 111.931 -178.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.449 ' CD2' ' HA ' ' A' ' 86' ' ' LYS . 4.9 t60 -74.39 -30.25 61.87 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 119.696 -0.802 . . . . 8.97 109.463 177.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.53 ' CB ' ' HA ' ' A' ' 83' ' ' HIS . . . -71.14 -46.86 60.7 Favored 'General case' 0 C--O 1.204 -1.333 0 CA-C-N 116.559 -0.291 . . . . 6.53 111.543 179.664 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.409 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 10.7 pt-20 -71.65 -11.6 60.92 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 121.417 0.627 . . . . 8.5 111.432 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.05 -32.06 59.13 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.009 -0.996 . . . . 9.41 109.798 173.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -120.65 -86.48 0.65 Allowed 'General case' 0 C--O 1.216 -0.698 0 CA-C-N 115.763 -0.653 . . . . 10.32 111.191 -177.184 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.471 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 20.4 t-80 45.49 55.58 14.74 Favored Pre-proline 0 CA--C 1.561 1.403 0 C-N-CA 123.85 0.86 . . . . 7.47 112.014 -178.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.471 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 34.6 Cg_exo -65.23 -44.93 8.33 Favored 'Trans proline' 0 C--N 1.37 1.661 0 C-N-CA 121.881 1.721 . . . . 6.81 110.341 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.472 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 24.5 pttm -170.03 106.14 0.33 Allowed 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 114.141 -1.391 . . . . 7.32 108.85 177.695 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 79' ' ' ALA . . . -67.16 112.77 4.64 Favored 'General case' 0 C--N 1.302 -1.476 0 C-N-CA 119.427 -0.909 . . . . 4.52 109.153 171.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.401 ' HB2' ' H ' ' A' ' 77' ' ' VAL . 8.9 m-20 -86.94 -90.75 0.11 Allowed 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 122.003 0.906 . . . . 6.82 110.709 -174.145 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.401 ' H ' ' HB2' ' A' ' 76' ' ' ASP . 28.2 m -89.49 -14.96 8.99 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.219 0 N-CA-C 108.546 -0.909 . . . . 8.15 108.546 177.057 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 24.4 m -87.03 7.44 2.54 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.833 0 CA-C-N 115.019 -0.991 . . . . 5.65 109.047 177.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.432 ' HB2' ' O ' ' A' ' 75' ' ' ALA . . . -65.33 -2.77 3.38 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-N 115.185 -0.916 . . . . 4.24 112.003 178.068 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 25.3 p -73.51 -23.22 60.0 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 115.366 -0.833 . . . . 5.6 109.213 174.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.522 ' CE2' ' HB2' ' A' ' 83' ' ' HIS . 31.8 t80 -160.36 88.67 1.81 Allowed Pre-proline 0 N--CA 1.428 -1.528 0 N-CA-C 106.456 -1.683 . . . . 5.13 106.456 170.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -60.01 6.73 0.1 OUTLIER 'Trans proline' 0 N--CA 1.509 2.395 0 C-N-CA 124.435 3.423 . . . . 3.27 115.527 -173.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.53 ' HA ' ' CB ' ' A' ' 68' ' ' ALA . 83.2 m-70 -98.87 5.58 47.28 Favored 'General case' 0 C--N 1.286 -2.163 0 N-CA-C 110.075 -0.343 . . . . 4.25 110.075 177.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.487 ' HG ' ' HD2' ' A' ' 81' ' ' PHE . 74.9 mt -107.98 4.9 25.7 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 111.982 0.364 . . . . 5.47 111.982 -179.256 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.472 ' HE3' ' O ' ' A' ' 74' ' ' LYS . 6.8 mmtt -49.07 -62.15 1.69 Allowed 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 114.456 1.28 . . . . 8.04 114.456 178.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.449 ' HA ' ' CD2' ' A' ' 67' ' ' HIS . 61.2 tttm . . . . . 0 CA--C 1.554 1.12 0 N-CA-C 113.197 0.814 . . . . 11.1 113.197 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.933 0 N-CA-C 111.359 -0.696 . . . . 19.14 111.359 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 86.5 m-70 61.84 16.18 7.74 Favored 'General case' 0 N--CA 1.499 1.995 0 C-N-CA 123.648 0.779 . . . . 19.74 112.722 176.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 43.4 m170 -82.17 85.35 6.81 Favored 'General case' 0 C--O 1.242 0.7 0 O-C-N 121.838 -0.539 . . . . 17.67 110.786 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 42.8 m80 68.58 -177.1 0.21 Allowed 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.711 0.804 . . . . 14.74 110.279 -177.489 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 58.2 m80 -117.81 117.91 30.6 Favored 'General case' 0 C--N 1.309 -1.183 0 O-C-N 121.929 -0.482 . . . . 14.24 109.769 179.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -137.86 -38.78 0.57 Allowed 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 120.903 0.382 . . . . 13.67 110.994 179.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 34.7 m-70 -142.4 148.54 38.02 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 108.203 -1.036 . . . . 10.3 108.203 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 66.4 tp 68.4 106.8 0.05 Allowed 'General case' 0 N--CA 1.479 1.013 0 O-C-N 124.865 1.353 . . . . 10.1 113.571 175.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -121.5 -71.34 0.74 Allowed 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.378 -0.971 . . . . 11.87 108.378 173.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 179.99 76.07 0.06 OUTLIER Glycine 0 N--CA 1.437 -1.298 0 CA-C-N 115.579 -0.737 . . . . 9.6 111.384 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -79.57 -56.83 3.26 Favored Glycine 0 C--O 1.217 -0.929 0 C-N-CA 120.644 -0.788 . . . . 8.45 111.803 178.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 85.17 -38.06 2.99 Favored Glycine 0 C--O 1.22 -0.726 0 C-N-CA 121.108 -0.567 . . . . 9.24 112.861 177.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 75.65 94.99 0.07 Allowed 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 125.177 1.391 . . . . 9.68 110.738 -177.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.625 ' H ' ' HB1' ' A' ' 20' ' ' ALA . . . -109.62 -167.12 1.16 Allowed 'General case' 0 C--O 1.25 1.118 0 CA-C-N 115.194 -0.912 . . . . 11.12 111.146 -178.483 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -48.28 150.03 1.37 Allowed 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 124.931 1.292 . . . . 15.18 112.948 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.5 mptp? 74.74 -43.57 0.52 Allowed 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 124.486 1.115 . . . . 15.42 111.411 -175.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 66.0 m 63.05 7.3 2.64 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 123.792 0.837 . . . . 11.21 112.535 179.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -87.35 -71.4 0.56 Allowed 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 108.716 -0.846 . . . . 13.14 108.716 176.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 51.0 ttm -78.5 -17.48 56.19 Favored 'General case' 0 C--N 1.309 -1.176 0 CA-C-N 115.43 -0.805 . . . . 14.08 109.586 178.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.625 ' HB1' ' H ' ' A' ' 14' ' ' ALA . . . -77.59 5.02 9.94 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 112.948 0.721 . . . . 9.77 112.948 -175.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 68.4 mtt180 -107.03 -45.34 4.17 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-O 119.497 -0.287 . . . . 10.29 110.416 176.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 55.38 28.31 11.31 Favored 'General case' 0 N--CA 1.481 1.124 0 N-CA-C 113.477 0.917 . . . . 9.15 113.477 174.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt 68.52 14.73 9.12 Favored 'General case' 0 C--N 1.353 0.723 0 C-N-CA 124.708 1.203 . . . . 11.12 110.429 -179.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -77.78 -21.38 51.75 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.377 0.608 . . . . 6.46 109.717 -179.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 95.3 mt -135.92 179.69 6.19 Favored 'General case' 0 C--O 1.247 0.94 0 CA-C-N 115.527 -0.761 . . . . 6.81 110.731 -176.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -84.24 -170.04 2.9 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.235 -0.893 . . . . 7.7 110.094 -179.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 46.4 mmtm -91.62 144.07 25.92 Favored 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 107.921 -1.14 . . . . 8.86 107.921 176.112 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -94.66 -3.87 48.65 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.771 -0.372 . . . . 6.48 111.747 -179.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -172.59 150.15 2.18 Favored 'General case' 0 N--CA 1.437 -1.097 0 N-CA-C 106.9 -1.518 . . . . 10.01 106.9 -178.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -150.77 -40.34 0.13 Allowed 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.737 -0.385 . . . . 7.43 111.778 179.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -93.29 158.47 15.73 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 120.776 0.322 . . . . 8.16 111.15 -178.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -137.06 -167.77 11.19 Favored Glycine 0 N--CA 1.438 -1.168 0 N-CA-C 110.602 -0.999 . . . . 7.69 110.602 179.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 63.2 tttp -61.42 109.83 1.27 Allowed 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.317 0.579 . . . . 8.86 110.525 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 116.84 -97.93 0.77 Allowed Glycine 0 N--CA 1.426 -2.023 0 N-CA-C 109.909 -1.276 . . . . 8.28 109.909 -178.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 38.1 m 58.96 -170.94 0.12 Allowed 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.383 0.673 . . . . 9.53 111.798 178.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -161.72 133.58 5.59 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.466 -0.568 . . . . 11.91 109.466 176.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.1 mt 66.85 14.11 9.68 Favored 'General case' 0 N--CA 1.485 1.301 0 O-C-N 123.98 0.8 . . . . 10.08 112.239 178.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -145.04 149.02 34.36 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 108.361 -0.977 . . . . 7.86 108.361 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 52.76 72.97 0.38 Allowed 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 124.724 1.21 . . . . 5.92 113.406 -179.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -87.79 98.99 11.77 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.811 -0.632 . . . . 6.88 111.481 -179.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.656 ' H ' ' HD3' ' A' ' 41' ' ' LYS . 0.2 OUTLIER -56.95 -38.32 72.77 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.137 0.975 . . . . 7.95 111.12 178.944 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 38.1 mtmm 61.93 -82.67 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.053 0 N-CA-C 113.741 1.015 . . . . 8.17 113.741 176.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -85.06 27.65 0.76 Allowed 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 112.634 0.605 . . . . 5.93 112.634 -174.334 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 68.6 mtm 70.28 1.66 3.67 Favored 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 124.305 1.042 . . . . 7.62 113.21 179.01 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 67.1 m 52.0 -92.18 0.03 OUTLIER 'General case' 0 CA--C 1.561 1.387 0 N-CA-C 115.594 1.701 . . . . 3.91 115.594 176.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.537 ' O ' ' HA ' ' A' ' 54' ' ' THR . 66.2 mt -131.86 133.88 60.63 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.209 0 N-CA-C 108.894 -0.78 . . . . 3.76 108.894 -177.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.685 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 35.3 tt0 -100.81 138.83 37.34 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 120.918 0.39 . . . . 6.79 110.217 -179.027 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.635 ' SG ' HG12 ' A' ' 50' ' ' VAL . 44.8 t -77.86 143.96 37.37 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 115.709 -0.678 . . . . 5.43 111.152 178.237 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.405 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -57.06 -39.07 74.19 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 126.06 1.744 . . . . 5.91 112.579 -174.37 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.635 HG12 ' SG ' ' A' ' 48' ' ' CYS . 2.1 p -49.0 -51.37 12.78 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 114.74 1.385 . . . . 7.94 114.74 -176.272 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.605 ' SG ' HG22 ' A' ' 50' ' ' VAL . 93.4 m -153.96 -67.73 0.14 Allowed 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 121.093 -0.243 . . . . 9.28 111.302 -173.104 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.446 ' HG3' ' NE2' ' A' ' 47' ' ' GLN . 39.1 ttp -174.86 35.4 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 120.109 -0.636 . . . . 9.44 109.653 -175.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.685 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 13.4 mm-40 -87.47 179.25 6.6 Favored 'General case' 0 CA--C 1.494 -1.199 0 C-N-CA 119.265 -0.974 . . . . 9.11 108.665 -174.371 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.537 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 7.5 t -137.99 154.31 49.35 Favored 'General case' 0 C--N 1.299 -1.597 0 C-N-CA 118.541 -1.264 . . . . 5.93 113.946 -175.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -132.94 151.55 52.04 Favored 'General case' 0 N--CA 1.409 -2.497 0 N-CA-C 105.877 -1.897 . . . . 5.27 105.877 175.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 10.8 tp -75.57 146.32 9.42 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.563 0 N-CA-C 109.459 -0.571 . . . . 5.23 109.459 -177.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 45.1 t -76.95 72.68 3.53 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 121.883 0.849 . . . . 4.21 110.941 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 8.9 t -84.94 -3.2 58.64 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.103 -0.953 . . . . 6.01 110.097 174.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 95.0 m -160.29 140.28 11.36 Favored 'General case' 0 N--CA 1.448 -0.55 0 N-CA-C 106.721 -1.585 . . . . 6.19 106.721 177.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 35.7 p -75.65 139.32 41.93 Favored 'General case' 0 N--CA 1.42 -1.946 0 N-CA-C 109.396 -0.594 . . . . 6.47 109.396 179.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.722 ' HA ' ' SG ' ' A' ' 64' ' ' CYS . 14.4 pt-20 -52.53 -35.02 52.56 Favored 'General case' 0 C--O 1.206 -1.184 0 C-N-CA 123.543 0.737 . . . . 4.86 111.824 178.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.428 ' O ' ' HB3' ' A' ' 65' ' ' ARG . 99.4 t -67.16 -38.97 82.12 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.844 0 C-N-CA 123.155 0.582 . . . . 7.23 112.494 178.001 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -73.01 -35.93 66.9 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 121.476 0.655 . . . . 9.36 109.683 -178.111 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . 0.722 ' SG ' ' HA ' ' A' ' 61' ' ' GLU . 1.8 p -74.52 -27.34 60.5 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 115.656 -0.702 . . . . 5.9 111.044 174.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.452 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 54.8 ttt180 -59.68 -52.65 64.58 Favored 'General case' 0 N--CA 1.439 -1.018 0 C-N-CA 123.627 0.771 . . . . 7.69 112.251 178.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -68.98 -30.24 68.61 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 120.37 -0.532 . . . . 9.78 110.99 -179.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 61.3 t60 -66.96 -37.96 85.22 Favored 'General case' 0 C--O 1.241 0.644 0 CA-C-N 116.158 -0.474 . . . . 8.97 109.805 176.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.25 -42.16 72.55 Favored 'General case' 0 C--O 1.213 -0.82 0 CA-C-N 115.966 -0.561 . . . . 6.53 110.379 178.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 6.0 mm-40 -63.63 -17.95 63.43 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-O 121.157 0.503 . . . . 8.5 111.698 -179.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -84.46 -11.3 56.43 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.994 -0.548 . . . . 9.41 111.06 176.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm -142.52 -84.83 0.17 Allowed 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 112.611 0.597 . . . . 10.32 112.611 -177.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.469 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 34.9 p80 41.76 47.81 2.65 Favored Pre-proline 0 N--CA 1.502 2.158 0 C-N-CA 125.357 1.463 . . . . 7.47 114.036 -176.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.469 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 1.3 Cg_endo -73.75 -41.75 1.01 Allowed 'Trans proline' 0 N--CA 1.444 -1.414 0 C-N-CA 121.015 1.143 . . . . 6.81 112.374 -175.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.462 ' O ' ' HE3' ' A' ' 85' ' ' LYS . 0.1 OUTLIER -160.53 116.16 2.29 Favored 'General case' 0 C--N 1.3 -1.569 0 N-CA-C 108.48 -0.933 . . . . 7.32 108.48 -179.324 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.506 ' O ' HG22 ' A' ' 78' ' ' VAL . . . -73.05 -51.58 17.58 Favored 'General case' 0 C--N 1.286 -2.187 0 C-N-CA 118.738 -1.185 . . . . 4.52 108.654 173.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.45 ' OD1' HG13 ' A' ' 77' ' ' VAL . 11.3 t70 61.0 -86.5 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.823 0 C-N-CA 124.111 0.965 . . . . 6.82 113.037 170.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.45 HG13 ' OD1' ' A' ' 76' ' ' ASP . 35.6 m -92.63 -19.32 6.88 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.742 0 CA-C-O 121.166 0.508 . . . . 8.15 109.884 178.247 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.506 HG22 ' O ' ' A' ' 75' ' ' ALA . 21.1 m -102.34 18.39 3.84 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.504 0 N-CA-C 107.973 -1.121 . . . . 5.65 107.973 174.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.423 ' HA ' ' HB1' ' A' ' 75' ' ' ALA . . . -64.48 -11.97 39.15 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-O 121.803 0.811 . . . . 4.24 111.496 178.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.548 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 89.2 m -75.4 -15.56 60.44 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-N 115.135 -0.939 . . . . 5.6 110.025 174.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.586 ' CD1' HD12 ' A' ' 84' ' ' LEU . 11.9 p90 -154.45 69.86 6.03 Favored Pre-proline 0 CA--C 1.563 1.47 0 C-N-CA 124.64 1.176 . . . . 5.13 111.401 178.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_exo -64.22 -17.46 59.8 Favored 'Trans proline' 0 N--CA 1.5 1.854 0 C-N-CA 123.814 3.009 . . . . 3.27 115.375 -172.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -81.48 4.47 21.04 Favored 'General case' 0 C--N 1.31 -1.143 0 C-N-CA 120.549 -0.46 . . . . 4.25 111.601 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.586 HD12 ' CD1' ' A' ' 81' ' ' PHE . 17.0 mt -115.64 4.19 14.07 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 120.391 -0.524 . . . . 5.47 110.687 -177.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.506 ' HD2' ' H ' ' A' ' 86' ' ' LYS . 27.9 tptp -65.08 152.83 42.51 Favored 'General case' 0 C--O 1.244 0.787 0 CA-C-O 122.496 1.141 . . . . 8.04 112.172 -178.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.506 ' H ' ' HD2' ' A' ' 85' ' ' LYS . 22.0 pttp . . . . . 0 C--N 1.283 -2.321 0 N-CA-C 106.204 -1.776 . . . . 11.1 106.204 178.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.499 -0.934 0 N-CA-C 111.534 -0.626 . . . . 19.14 111.534 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 19.2 p-80 -158.5 137.29 11.21 Favored 'General case' 0 C--O 1.214 -0.765 0 N-CA-C 107.424 -1.325 . . . . 19.74 107.424 176.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -128.68 18.87 6.21 Favored 'General case' 0 C--N 1.32 -0.683 0 C-N-CA 119.243 -0.983 . . . . 17.67 112.998 -176.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -135.58 -73.02 0.46 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 119.847 -0.741 . . . . 14.74 112.474 177.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -139.42 -169.94 2.79 Favored 'General case' 0 C--O 1.242 0.697 0 C-N-CA 120.2 -0.6 . . . . 14.24 111.662 -176.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 57.5 m80 -70.73 165.02 23.89 Favored 'General case' 0 C--N 1.331 -0.223 0 O-C-N 124.011 0.819 . . . . 13.67 111.015 179.232 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 14.0 p-80 -105.26 163.53 12.53 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 108.74 -0.837 . . . . 10.3 108.74 177.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 58.5 tp 56.81 68.57 0.84 Allowed 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.998 0.904 . . . . 10.1 109.317 -176.455 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -122.93 -68.26 0.9 Allowed 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 114.678 -1.147 . . . . 11.87 108.606 -175.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -118.58 -76.48 0.53 Allowed Glycine 0 N--CA 1.438 -1.215 0 N-CA-C 110.844 -0.902 . . . . 9.6 110.844 177.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.4 ' HA2' ' HB2' ' A' ' 25' ' ' LEU . . . 108.53 164.37 20.86 Favored Glycine 0 CA--C 1.484 -1.876 0 C-N-CA 120.216 -0.992 . . . . 8.45 111.99 179.154 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -139.45 -78.46 0.06 OUTLIER Glycine 0 N--CA 1.425 -2.094 0 C-N-CA 120.341 -0.933 . . . . 9.24 111.35 179.119 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 29.2 p30 -154.94 154.62 32.89 Favored 'General case' 0 C--N 1.307 -1.257 0 N-CA-C 112.048 0.388 . . . . 9.68 112.048 -175.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -175.2 129.94 0.29 Allowed 'General case' 0 C--O 1.245 0.854 0 C-N-CA 124.701 1.201 . . . . 11.12 108.275 178.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.497 ' C ' ' H ' ' A' ' 17' ' ' SER 0.363 22.2 mp0 41.33 83.34 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 115.686 1.735 . . . . 15.18 115.686 177.608 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.3 mtmp? 71.81 -24.02 0.18 Allowed 'General case' 0 C--O 1.214 -0.783 0 CA-C-N 114.153 -1.385 . . . . 15.42 112.392 -177.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.497 ' H ' ' C ' ' A' ' 15' ' ' GLN . 43.2 p 59.88 1.02 0.29 Allowed 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 126.46 1.904 . . . . 11.21 114.242 178.037 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.29 -36.44 84.11 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 115.802 -0.635 . . . . 13.14 109.927 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 28.0 ttt -155.77 -30.62 0.1 Allowed 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.718 -0.674 . . . . 14.08 111.923 179.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.29 -19.77 37.35 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 113.037 0.755 . . . . 9.77 113.037 -176.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -66.05 -48.4 71.18 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 120.418 -0.513 . . . . 10.29 111.478 -179.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 46.62 32.2 1.61 Allowed 'General case' 0 N--CA 1.507 2.378 0 N-CA-C 112.906 0.706 . . . . 9.15 112.906 179.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt 69.4 88.74 0.11 Allowed 'General case' 0 CA--C 1.501 -0.925 0 C-N-CA 124.529 1.132 . . . . 11.12 112.09 -173.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -148.17 147.94 30.01 Favored 'General case' 0 C--N 1.295 -1.802 0 C-N-CA 120.04 -0.664 . . . . 6.46 109.535 179.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.4 ' HB2' ' HA2' ' A' ' 11' ' ' GLY . 2.1 tm? -157.65 114.87 2.99 Favored 'General case' 0 N--CA 1.439 -0.991 0 N-CA-C 105.948 -1.871 . . . . 6.81 105.948 178.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -108.0 -79.86 0.57 Allowed 'General case' 0 C--N 1.308 -1.2 0 O-C-N 123.644 0.59 . . . . 7.7 110.359 179.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.3 pttt -110.4 -9.32 14.62 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.745 -0.382 . . . . 8.86 112.026 -179.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 61.55 -169.87 0.17 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.732 0.813 . . . . 6.48 111.479 -178.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -94.88 -25.68 16.48 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 120.954 0.407 . . . . 10.01 110.582 179.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -127.33 113.26 16.03 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 116.582 -0.281 . . . . 7.43 110.912 -178.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -96.95 -49.32 5.07 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-O 121.179 0.514 . . . . 8.16 110.855 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 162.22 -133.5 3.14 Favored Glycine 0 N--CA 1.435 -1.417 0 N-CA-C 111.141 -0.784 . . . . 7.69 111.141 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 11.4 mptt -93.25 -1.77 55.79 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 121.104 0.478 . . . . 8.86 110.203 -178.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 172.82 179.29 43.46 Favored Glycine 0 N--CA 1.425 -2.036 0 N-CA-C 110.212 -1.155 . . . . 8.28 110.212 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.9 m -68.75 -67.19 0.49 Allowed 'General case' 0 C--O 1.248 0.974 0 O-C-N 123.733 0.313 . . . . 9.53 110.925 179.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 177.35 -72.31 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 108.737 -0.838 . . . . 11.91 108.737 179.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 94.3 mt -107.35 106.4 16.8 Favored 'General case' 0 N--CA 1.429 -1.516 0 N-CA-C 108.022 -1.103 . . . . 10.08 108.022 176.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -146.17 -64.58 0.31 Allowed 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 109.307 -0.627 . . . . 7.86 109.307 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -132.87 179.71 6.0 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.898 -0.779 . . . . 5.92 108.898 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -69.16 138.26 54.0 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 109.806 -0.442 . . . . 6.88 109.806 179.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 50.3 mttp 76.68 -154.99 0.03 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.409 1.483 . . . . 7.95 108.078 -177.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 35.4 mmtp 78.9 -44.14 0.35 Allowed 'General case' 0 N--CA 1.484 1.266 0 N-CA-C 113.58 0.956 . . . . 8.17 113.58 176.363 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -59.58 -72.13 0.11 Allowed 'General case' 0 N--CA 1.469 0.482 0 O-C-N 123.424 0.452 . . . . 5.93 111.531 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.522 ' O ' HG23 ' A' ' 54' ' ' THR . 0.0 OUTLIER 178.99 -32.78 0.01 OUTLIER 'General case' 0 C--O 1.207 -1.159 0 C-N-CA 123.444 0.698 . . . . 7.62 111.742 177.208 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.446 ' HB3' ' N ' ' A' ' 57' ' ' CYS . 54.7 m 60.84 -80.11 0.02 OUTLIER 'General case' 0 CA--C 1.563 1.479 0 N-CA-C 114.618 1.34 . . . . 3.91 114.618 178.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.442 ' HB ' ' HB2' ' A' ' 55' ' ' PHE . 57.2 mt -139.86 144.81 27.58 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 N-CA-C 109.053 -0.721 . . . . 3.76 109.053 -178.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.621 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 1.1 tp-100 -109.36 136.78 48.23 Favored 'General case' 0 CA--C 1.549 0.93 0 CA-C-O 121.015 0.436 . . . . 6.79 110.592 -178.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.563 ' SG ' HG22 ' A' ' 50' ' ' VAL . 38.1 t -74.28 145.05 44.31 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 124.803 1.241 . . . . 5.43 113.483 -175.504 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 21.6 ttpt -63.86 -34.97 79.13 Favored 'General case' 0 C--O 1.216 -0.689 0 C-N-CA 125.796 1.639 . . . . 5.91 111.332 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.563 HG22 ' SG ' ' A' ' 48' ' ' CYS . 8.5 m -61.04 -25.05 34.95 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 N-CA-C 113.286 0.847 . . . . 7.94 113.286 -171.3 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.5 t -170.07 -76.25 0.02 OUTLIER 'General case' 0 N--CA 1.436 -1.149 0 N-CA-C 108.825 -0.805 . . . . 9.28 108.825 -178.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.445 ' C ' HE21 ' A' ' 53' ' ' GLN . 27.5 ttt -179.89 60.86 0.01 OUTLIER 'General case' 0 C--O 1.208 -1.11 0 N-CA-C 107.303 -1.369 . . . . 9.44 107.303 179.141 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.621 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 23.3 mm-40 -106.43 -174.24 2.49 Favored 'General case' 0 C--O 1.195 -1.809 0 N-CA-C 109.475 -0.565 . . . . 9.11 109.475 -176.009 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.522 HG23 ' O ' ' A' ' 44' ' ' MET . 97.4 m -120.57 142.89 48.95 Favored 'General case' 0 C--N 1.273 -2.718 0 N-CA-C 114.255 1.206 . . . . 5.93 114.255 -170.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.442 ' HB2' ' HB ' ' A' ' 46' ' ' ILE . 79.9 m-85 -130.41 172.75 11.53 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 125.698 1.599 . . . . 5.27 108.435 175.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.1 tp -100.21 137.36 27.97 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 CA-C-O 121.035 0.445 . . . . 5.23 112.114 -175.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.446 ' N ' ' HB3' ' A' ' 45' ' ' SER . 25.8 p -89.01 77.48 7.65 Favored 'General case' 0 N--CA 1.418 -2.031 0 CA-C-O 121.571 0.7 . . . . 4.21 110.258 176.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 8.2 m -67.47 -9.44 42.06 Favored 'General case' 0 CA--C 1.576 1.968 0 CA-C-O 122.29 1.043 . . . . 6.01 110.189 174.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.443 HG22 ' H ' ' A' ' 60' ' ' SER . 33.2 m -149.75 173.76 13.35 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 104.681 -2.34 . . . . 6.19 104.681 178.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.443 ' H ' HG22 ' A' ' 59' ' ' THR . 15.5 m -75.75 20.42 0.18 Allowed 'General case' 0 CA--C 1.552 1.051 0 CA-C-N 119.533 1.06 . . . . 6.47 112.517 -174.042 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 65.23 -52.22 0.35 Allowed 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 126.929 2.092 . . . . 4.86 111.542 -178.223 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.639 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 28.3 m -55.47 -41.93 65.44 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.411 0 N-CA-C 113.388 0.884 . . . . 7.23 113.388 -177.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.481 ' HA ' ' OE1' ' A' ' 66' ' ' GLU . 0.6 OUTLIER -59.9 -35.26 74.49 Favored 'General case' 0 CA--C 1.55 0.953 0 CA-C-O 122.037 0.922 . . . . 9.36 109.466 178.34 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 55.7 m -73.7 -36.26 65.23 Favored 'General case' 0 N--CA 1.439 -1.016 0 N-CA-C 108.45 -0.944 . . . . 5.9 108.45 179.123 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -59.3 -42.76 92.08 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 115.615 -0.72 . . . . 7.69 110.93 178.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.639 ' HG3' ' O ' ' A' ' 62' ' ' VAL . 25.3 mt-10 -59.14 -45.46 90.89 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 124.35 1.031 . . . . 9.78 109.894 -177.29 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.45 ' CD2' ' HA ' ' A' ' 86' ' ' LYS . 7.4 t60 -75.65 -24.59 56.4 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 115.281 -0.872 . . . . 8.97 109.721 -178.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.97 -43.86 33.39 Favored 'General case' 0 C--O 1.206 -1.189 0 CA-C-N 116.179 -0.464 . . . . 6.53 111.485 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -68.93 -18.83 64.15 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 121.098 0.475 . . . . 8.5 110.186 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.09 -29.5 67.6 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.16 -0.927 . . . . 9.41 110.733 175.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -128.16 -76.13 0.56 Allowed 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 112.327 0.491 . . . . 10.32 112.327 -175.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.416 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 13.4 p80 39.13 60.62 5.63 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 125.148 1.379 . . . . 7.47 113.695 -175.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.416 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 51.1 Cg_exo -59.58 -51.43 6.19 Favored 'Trans proline' 0 C--N 1.358 1.057 0 C-N-CA 122.36 2.04 . . . . 6.81 112.483 -178.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.28 -32.03 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 113.619 0.97 . . . . 7.32 113.619 177.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.409 ' O ' ' HB2' ' A' ' 79' ' ' ALA . . . 71.45 116.53 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.74 0.816 . . . . 4.52 109.956 -176.274 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -104.21 -80.87 0.53 Allowed 'General case' 0 C--N 1.309 -1.154 0 CA-C-O 121.062 0.458 . . . . 6.82 111.129 -174.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.8 m -81.53 -18.06 11.64 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-O 121.657 0.741 . . . . 8.15 109.174 176.118 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 35.3 m -97.0 12.03 4.84 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.305 0 CA-C-N 115.003 -0.999 . . . . 5.65 109.514 176.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.409 ' HB2' ' O ' ' A' ' 75' ' ' ALA . . . -59.99 -12.89 9.02 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-O 121.41 0.624 . . . . 4.24 111.996 178.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.442 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 71.2 m -84.16 -8.64 59.02 Favored 'General case' 0 C--N 1.306 -1.315 0 CA-C-N 115.42 -0.809 . . . . 5.6 111.384 178.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.469 ' HD2' ' HG ' ' A' ' 84' ' ' LEU . 19.9 t80 -168.12 84.1 0.75 Allowed Pre-proline 0 N--CA 1.434 -1.269 0 N-CA-C 108.158 -1.053 . . . . 5.13 108.158 168.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -62.14 5.97 0.2 Allowed 'Trans proline' 0 N--CA 1.508 2.371 0 C-N-CA 124.57 3.513 . . . . 3.27 115.199 -174.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.434 ' HB2' ' CE2' ' A' ' 81' ' ' PHE . 90.3 m-70 -92.81 3.34 55.84 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 109.803 -0.443 . . . . 4.25 109.803 177.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.469 ' HG ' ' HD2' ' A' ' 81' ' ' PHE . 45.7 mt -111.54 10.33 21.25 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.96 -0.564 . . . . 5.47 110.641 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.499 ' HD3' ' N ' ' A' ' 86' ' ' LYS . 5.0 tmtm? -51.47 -60.7 2.85 Favored 'General case' 0 C--N 1.357 0.911 0 N-CA-C 113.376 0.88 . . . . 8.04 113.376 -179.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.499 ' N ' ' HD3' ' A' ' 85' ' ' LYS . 58.0 tttm . . . . . 0 C--N 1.355 0.819 0 CA-C-O 118.428 -0.796 . . . . 11.1 110.516 174.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.215 -1.042 0 CA-C-O 119.59 -0.561 . . . . 19.14 113.26 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 46.8 m-70 78.78 123.26 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 124.154 0.982 . . . . 19.74 109.5 -172.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 44.6 t-80 -126.51 98.36 5.38 Favored 'General case' 0 C--N 1.292 -1.903 0 CA-C-N 116.488 -0.324 . . . . 17.67 110.821 -174.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 42.4 t-80 -163.59 102.75 0.93 Allowed 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 120.989 0.423 . . . . 14.74 111.192 178.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.0 m80 -88.33 172.41 9.43 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 116.468 -0.333 . . . . 14.24 110.602 175.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 69.21 116.25 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.198 0.999 . . . . 13.67 112.598 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 19.8 p-80 -176.39 21.86 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.993 0 N-CA-C 107.67 -1.234 . . . . 10.3 107.67 174.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 1.5 pp -165.45 172.76 11.79 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-N 115.066 -0.97 . . . . 10.1 108.966 -173.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 66.19 99.07 0.05 OUTLIER 'General case' 0 CA--C 1.543 0.705 0 O-C-N 125.168 1.542 . . . . 11.87 111.027 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 157.71 -117.67 0.79 Allowed Glycine 0 N--CA 1.434 -1.45 0 C-N-CA 119.982 -1.104 . . . . 9.6 112.686 -178.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -54.1 -31.94 49.37 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 115.191 0.837 . . . . 8.45 115.191 -176.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -166.84 -57.13 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 119.605 -1.283 . . . . 9.24 113.524 -177.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 60.3 t30 71.38 163.81 0.27 Allowed 'General case' 0 N--CA 1.499 2.004 0 C-N-CA 124.375 1.07 . . . . 9.68 109.694 -175.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -150.16 113.01 4.79 Favored 'General case' 0 C--N 1.321 -0.673 0 O-C-N 121.865 -0.522 . . . . 11.12 110.428 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -79.84 7.23 9.13 Favored 'General case' 0 C--N 1.316 -0.872 0 N-CA-C 112.867 0.692 . . . . 15.18 112.867 -177.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -86.13 -5.19 59.25 Favored 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 120.647 -0.421 . . . . 15.42 110.028 172.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.6 m 71.17 -35.25 0.32 Allowed 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 125.216 1.406 . . . . 11.21 112.416 179.057 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.98 -31.32 72.41 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 123.614 0.766 . . . . 13.14 112.454 -177.019 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 26.1 mmt -107.66 17.68 22.32 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.723 -0.217 . . . . 14.08 111.399 -178.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -79.44 18.21 0.75 Allowed 'General case' 0 N--CA 1.486 1.37 0 CA-C-O 121.852 0.834 . . . . 9.77 111.567 -178.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 17.0 ptm180 -137.28 6.2 2.79 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 115.343 -0.844 . . . . 10.29 109.391 176.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -92.7 -45.4 8.07 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-O 121.898 0.856 . . . . 9.15 108.901 179.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -124.23 125.38 44.32 Favored 'General case' 0 N--CA 1.433 -1.312 0 CA-C-N 114.942 -1.026 . . . . 11.12 109.546 176.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -146.38 -29.51 0.39 Allowed 'General case' 0 C--N 1.3 -1.559 0 CA-C-N 116.047 -0.524 . . . . 6.46 110.981 -179.447 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.417 ' H ' HD23 ' A' ' 25' ' ' LEU . 1.8 pt? -61.77 154.55 25.35 Favored 'General case' 0 C--N 1.316 -0.882 0 C-N-CA 123.71 0.804 . . . . 6.81 111.46 179.389 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -79.24 -72.4 0.39 Allowed 'General case' 0 C--O 1.219 -0.534 0 CA-C-O 121.944 0.878 . . . . 7.7 111.538 178.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.7 pttm -165.23 -177.09 4.36 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 114.207 -1.36 . . . . 8.86 109.127 -170.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -138.84 178.46 7.14 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 120.729 0.3 . . . . 6.48 111.079 -177.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -84.3 106.07 15.63 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 109.7 -0.481 . . . . 10.01 109.7 179.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -146.45 -177.72 5.78 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 109.711 -0.477 . . . . 7.43 109.711 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -104.26 -74.83 0.63 Allowed 'General case' 0 N--CA 1.444 -0.767 0 CA-C-O 120.755 0.312 . . . . 8.16 110.843 178.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 120.96 -132.5 9.2 Favored Glycine 0 N--CA 1.438 -1.224 0 N-CA-C 110.382 -1.087 . . . . 7.69 110.382 -179.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 6.8 ptpp? -154.06 118.83 4.95 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 116.939 0.37 . . . . 8.86 110.123 177.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 99.7 150.32 25.06 Favored Glycine 0 N--CA 1.44 -1.08 0 N-CA-C 110.89 -0.884 . . . . 8.28 110.89 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 42.1 t -117.01 8.64 13.44 Favored 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 120.338 -0.545 . . . . 9.53 110.196 -178.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -138.56 141.59 39.25 Favored 'General case' 0 C--O 1.245 0.829 0 C-N-CA 120.825 -0.35 . . . . 11.91 110.421 -178.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 95.5 mt 63.57 12.18 6.27 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.243 1.017 . . . . 10.08 113.28 176.813 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -85.62 138.98 31.78 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 109.61 -0.515 . . . . 7.86 109.61 178.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -167.91 -55.2 0.02 OUTLIER 'General case' 0 N--CA 1.439 -0.999 0 CA-C-N 115.185 -0.916 . . . . 5.92 110.047 -178.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.542 HD21 ' HB2' ' A' ' 42' ' ' LYS . 8.3 t30 -167.17 142.28 4.02 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.16 -0.473 . . . . 6.88 111.223 -176.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.414 ' HE3' ' HA ' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -87.56 -53.38 4.83 Favored 'General case' 0 N--CA 1.483 1.22 0 CA-C-O 120.818 0.342 . . . . 7.95 110.267 178.38 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.542 ' HB2' HD21 ' A' ' 40' ' ' ASN . 36.9 ttpt 73.29 125.89 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 126.058 1.743 . . . . 8.17 112.266 -176.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . 61.73 12.06 4.4 Favored 'General case' 0 N--CA 1.495 1.801 0 C-N-CA 124.264 1.026 . . . . 5.93 113.423 176.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 68.1 mtm 72.38 10.47 5.81 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 124.153 0.981 . . . . 7.62 112.002 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 13.7 p 48.25 -101.1 0.07 Allowed 'General case' 0 CA--C 1.546 0.8 0 N-CA-C 115.666 1.728 . . . . 3.91 115.666 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.529 ' O ' ' HA ' ' A' ' 54' ' ' THR . 62.0 mt -122.83 136.64 58.98 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.059 0 N-CA-C 109.006 -0.738 . . . . 3.76 109.006 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.632 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 7.3 tt0 -102.89 141.84 35.02 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-O 120.779 0.324 . . . . 6.79 110.618 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.552 ' SG ' HG12 ' A' ' 50' ' ' VAL . 48.7 t -80.0 144.68 33.04 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.985 -0.552 . . . . 5.43 110.911 177.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.412 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 1.8 tmmm? -59.92 -44.67 94.18 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 125.061 1.344 . . . . 5.91 112.299 -174.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.552 HG12 ' SG ' ' A' ' 48' ' ' CYS . 7.5 p -46.95 -37.86 3.88 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 N-CA-C 114.885 1.439 . . . . 7.94 114.885 -171.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 50.1 t -159.96 -67.26 0.07 Allowed 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.388 -0.525 . . . . 9.28 110.072 -179.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.44 ' C ' HE21 ' A' ' 53' ' ' GLN . 27.5 ttt 178.21 60.24 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.417 0 O-C-N 123.758 0.662 . . . . 9.44 109.904 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.632 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 19.1 mm-40 -103.55 -170.78 1.83 Allowed 'General case' 0 C--O 1.203 -1.384 0 N-CA-C 107.478 -1.304 . . . . 9.11 107.478 -177.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.529 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 9.0 t -141.94 157.97 44.33 Favored 'General case' 0 N--CA 1.42 -1.952 0 C-N-CA 118.333 -1.347 . . . . 5.93 113.013 -178.205 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -140.39 139.98 35.41 Favored 'General case' 0 C--N 1.302 -1.472 0 N-CA-C 106.026 -1.842 . . . . 5.27 106.026 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 7.1 tp -63.49 140.62 19.35 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 O-C-N 123.413 0.445 . . . . 5.23 111.623 -178.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 12.6 p -75.08 72.13 2.18 Favored 'General case' 0 N--CA 1.426 -1.638 0 CA-C-O 121.747 0.784 . . . . 4.21 112.71 178.16 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 24.5 p -82.46 -4.47 57.51 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-N 115.312 -0.858 . . . . 6.01 109.872 171.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.553 HG21 ' SG ' ' A' ' 64' ' ' CYS . 25.1 m -143.31 161.0 39.48 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 106.586 -1.635 . . . . 6.19 106.586 176.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.5 m -87.27 17.22 4.51 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 112.219 0.452 . . . . 6.47 112.219 -174.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.527 ' CD ' ' HE ' ' A' ' 65' ' ' ARG . 5.4 tp10 67.58 -64.85 0.26 Allowed 'General case' 0 N--CA 1.495 1.803 0 N-CA-C 112.225 0.454 . . . . 4.86 112.225 179.229 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.403 ' HA ' ' HB2' ' A' ' 65' ' ' ARG . 5.4 p -63.9 -25.86 39.19 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 C-N-CA 123.014 0.526 . . . . 7.23 111.016 -175.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -62.28 -41.59 98.62 Favored 'General case' 0 C--O 1.25 1.104 0 N-CA-C 108.106 -1.072 . . . . 9.36 108.106 177.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . 0.553 ' SG ' HG21 ' A' ' 59' ' ' THR . 63.9 m -77.48 -29.42 52.65 Favored 'General case' 0 N--CA 1.424 -1.741 0 CA-C-N 115.058 -0.974 . . . . 5.9 108.904 176.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.527 ' HE ' ' CD ' ' A' ' 61' ' ' GLU . 97.1 mtt180 -57.78 -47.18 83.29 Favored 'General case' 0 CA--C 1.5 -0.957 0 N-CA-C 113.114 0.783 . . . . 7.69 113.114 179.047 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -65.35 -40.69 93.94 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 119.95 -0.7 . . . . 9.78 110.49 -179.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.42 ' O ' ' HB3' ' A' ' 70' ' ' ALA . 3.7 t-160 -75.91 -26.95 57.44 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 115.937 -0.574 . . . . 8.97 110.725 -175.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.599 ' O ' ' HB2' ' A' ' 72' ' ' HIS . . . -77.62 -49.85 13.74 Favored 'General case' 0 C--O 1.186 -2.255 0 N-CA-C 109.935 -0.395 . . . . 6.53 109.935 178.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 17.4 mm-40 -67.81 -8.45 36.08 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.39 0.614 . . . . 8.5 111.049 -179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.42 ' HB3' ' O ' ' A' ' 67' ' ' HIS . . . -73.12 -31.37 64.26 Favored 'General case' 0 N--CA 1.44 -0.944 0 CA-C-N 115.047 -0.979 . . . . 9.41 109.446 173.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -131.39 -79.07 0.52 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.793 -0.64 . . . . 10.32 110.113 -176.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.599 ' HB2' ' O ' ' A' ' 68' ' ' ALA . 5.8 t-160 47.07 48.43 5.71 Favored Pre-proline 0 CA--C 1.566 1.587 0 C-N-CA 124.809 1.244 . . . . 7.47 111.643 176.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.441 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 45.7 Cg_exo -56.61 -51.09 9.89 Favored 'Trans proline' 0 C--N 1.387 2.556 0 C-N-CA 121.903 1.735 . . . . 6.81 111.789 -174.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -163.69 106.86 0.98 Allowed 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.68 -0.691 . . . . 7.32 109.727 178.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -64.27 111.35 2.57 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 120.039 -0.665 . . . . 4.52 109.338 173.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -107.01 -87.62 0.47 Allowed 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 114.871 -1.058 . . . . 6.82 110.858 -170.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 30.3 m -82.16 -1.69 5.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 CA-C-O 122.468 1.127 . . . . 8.15 108.973 174.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.509 HG21 ' HA ' ' A' ' 85' ' ' LYS . 32.7 m -110.01 10.05 8.83 Favored 'Isoleucine or valine' 0 C--O 1.183 -2.403 0 CA-C-N 113.286 -1.779 . . . . 5.65 108.517 176.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.57 -21.38 62.54 Favored 'General case' 0 N--CA 1.48 1.048 0 CA-C-O 121.598 0.714 . . . . 4.24 112.156 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.466 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 72.3 m -76.37 -15.92 59.85 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 115.557 -0.747 . . . . 5.6 110.876 176.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.65 ' CD1' HD12 ' A' ' 84' ' ' LEU . 4.4 p90 -153.61 71.49 6.7 Favored Pre-proline 0 CA--C 1.555 1.164 0 C-N-CA 124.728 1.211 . . . . 5.13 111.119 -179.366 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -64.63 -1.56 4.17 Favored 'Trans proline' 0 C--N 1.364 1.371 0 C-N-CA 123.944 3.096 . . . . 3.27 116.239 -172.047 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -91.86 -0.49 57.51 Favored 'General case' 0 C--N 1.297 -1.688 0 C-N-CA 119.502 -0.879 . . . . 4.25 109.891 177.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.65 HD12 ' CD1' ' A' ' 81' ' ' PHE . 20.0 mt -116.28 17.24 15.69 Favored 'General case' 0 N--CA 1.425 -1.676 0 C-N-CA 121.011 -0.276 . . . . 5.47 111.347 -175.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.509 ' HA ' HG21 ' A' ' 78' ' ' VAL . 27.0 tptp -53.27 -50.55 64.62 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 112.908 0.707 . . . . 8.04 112.908 178.6 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt . . . . . 0 N--CA 1.417 -2.114 0 N-CA-C 106.904 -1.517 . . . . 11.1 106.904 178.611 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.223 -0.566 0 N-CA-C 112.909 -0.077 . . . . 19.14 112.909 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 59.8 m-70 -118.31 -17.53 9.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.08 0.467 . . . . 19.74 111.27 176.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 36.7 m80 -132.14 127.05 35.11 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.099 -1.075 . . . . 17.67 108.099 178.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 21.0 m-70 -99.22 -54.59 2.93 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-O 120.659 0.266 . . . . 14.74 111.344 -178.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 27.0 p80 -162.2 176.21 10.87 Favored 'General case' 0 CA--C 1.499 -1.006 0 N-CA-C 109.299 -0.63 . . . . 14.24 109.299 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 94.1 m-70 -125.13 -156.22 0.72 Allowed 'General case' 0 C--N 1.31 -1.15 0 N-CA-C 107.324 -1.361 . . . . 13.67 107.324 179.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -139.96 169.24 18.08 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 106.776 -1.565 . . . . 10.3 106.776 175.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.4 HD13 ' H ' ' A' ' 25' ' ' LEU . 60.1 tp 74.51 88.0 0.09 Allowed 'General case' 0 N--CA 1.455 -0.191 0 O-C-N 124.723 1.264 . . . . 10.1 110.075 -172.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -84.03 2.63 38.16 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 115.214 -0.903 . . . . 11.87 108.839 179.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 135.82 -35.63 2.12 Favored Glycine 0 N--CA 1.443 -0.884 0 N-CA-C 109.507 -1.437 . . . . 9.6 109.507 -176.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.412 ' HA2' ' OD1' ' A' ' 24' ' ' ASN . . . 118.23 170.22 14.88 Favored Glycine 0 N--CA 1.437 -1.288 0 C-N-CA 120.67 -0.776 . . . . 8.45 112.55 177.344 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 111.83 -90.13 0.55 Allowed Glycine 0 N--CA 1.435 -1.387 0 C-N-CA 120.707 -0.759 . . . . 9.24 113.048 176.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -154.02 154.72 34.21 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 119.806 -0.14 . . . . 9.68 110.646 -173.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -164.57 160.62 20.42 Favored 'General case' 0 C--O 1.255 1.357 0 O-C-N 124.013 0.82 . . . . 11.12 109.531 179.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -94.26 119.59 33.27 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 112.88 0.696 . . . . 15.18 112.88 -176.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt 167.58 -57.24 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 126.624 1.97 . . . . 15.42 107.802 173.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.563 ' H ' ' HB2' ' A' ' 22' ' ' ALA . 19.4 m -97.44 13.27 30.4 Favored 'General case' 0 CA--C 1.494 -1.183 0 CA-C-N 115.349 -0.841 . . . . 11.21 110.082 178.22 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 54.09 45.38 27.63 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 123.738 0.649 . . . . 13.14 110.72 -178.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 56.1 ttp 71.99 1.76 4.04 Favored 'General case' 0 CA--C 1.55 0.955 0 CA-C-N 114.507 -1.224 . . . . 14.08 112.079 -179.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -68.81 -36.61 78.43 Favored 'General case' 0 C--N 1.356 0.871 0 C-N-CA 119.215 -0.994 . . . . 9.77 111.236 -178.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 -170.38 27.38 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 116.089 -0.505 . . . . 10.29 111.333 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.563 ' HB2' ' H ' ' A' ' 17' ' ' SER . . . -77.09 96.47 4.46 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 112.35 0.5 . . . . 9.15 112.35 -174.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 93.8 mttt 68.38 -4.37 1.12 Allowed 'General case' 0 N--CA 1.485 1.295 0 N-CA-C 114.907 1.447 . . . . 11.12 114.907 176.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.412 ' OD1' ' HA2' ' A' ' 11' ' ' GLY . 57.8 t30 -78.86 120.44 23.48 Favored 'General case' 0 C--N 1.282 -2.333 0 C-N-CA 119.132 -1.027 . . . . 6.46 111.832 -172.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.4 ' H ' HD13 ' A' ' 8' ' ' LEU . 85.2 mt 63.4 -168.04 0.21 Allowed 'General case' 0 C--O 1.253 1.254 0 CA-C-N 114.504 -1.225 . . . . 6.81 112.928 176.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.417 ' HG3' ' HD3' ' A' ' 27' ' ' LYS . 9.8 pt-20 -132.01 -50.24 0.95 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 115.737 -0.665 . . . . 7.7 110.762 177.243 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.417 ' HD3' ' HG3' ' A' ' 26' ' ' GLU . 13.4 mptt -98.76 145.59 26.78 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-O 120.605 0.241 . . . . 8.86 110.593 176.373 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -107.34 2.98 24.87 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 121.336 0.588 . . . . 6.48 110.533 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.405 ' HZ2' ' CD ' ' A' ' 38' ' ' GLU . 12.3 ptmm? -82.61 161.36 22.25 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 115.5 -0.773 . . . . 10.01 110.498 178.542 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -78.39 112.25 15.22 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 116.02 -0.536 . . . . 7.43 110.684 -179.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -100.15 141.07 33.48 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 108.63 -0.878 . . . . 8.16 108.63 176.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -83.6 49.56 4.25 Favored Glycine 0 C--N 1.315 -0.592 0 C-N-CA 120.748 -0.739 . . . . 7.69 111.854 -179.225 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 49.7 mmtm 72.0 -15.11 0.48 Allowed 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 124.542 1.137 . . . . 8.86 113.042 -179.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 162.67 95.81 0.11 Allowed Glycine 0 N--CA 1.441 -1.033 0 N-CA-C 110.606 -0.998 . . . . 8.28 110.606 179.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.0 m -88.03 -40.07 14.14 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 112.89 0.7 . . . . 9.53 112.89 -176.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -159.38 -85.8 0.04 OUTLIER 'General case' 0 C--O 1.208 -1.132 0 N-CA-C 109.685 -0.487 . . . . 11.91 109.685 178.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 43.9 tp -102.56 -12.49 17.73 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 107.486 -1.302 . . . . 10.08 107.486 174.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.405 ' CD ' ' HZ2' ' A' ' 29' ' ' LYS . 40.9 tt0 -84.33 102.93 13.08 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 114.177 -1.374 . . . . 7.86 109.156 178.5 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -164.07 149.74 10.83 Favored 'General case' 0 N--CA 1.438 -1.06 0 C-N-CA 123.791 0.836 . . . . 5.92 108.907 179.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 50.6 t30 -101.32 -6.57 23.94 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-O 122.568 1.175 . . . . 6.88 108.8 177.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.401 ' HE3' ' OG ' ' A' ' 45' ' ' SER . 19.5 ptmt -117.34 88.36 2.89 Favored 'General case' 0 N--CA 1.413 -2.308 0 CA-C-N 114.936 -1.029 . . . . 7.95 110.427 -177.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.593 ' HD3' ' H ' ' A' ' 42' ' ' LYS . 0.1 OUTLIER -78.31 152.99 32.12 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 114.16 -1.382 . . . . 8.17 110.589 -178.145 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . 65.04 14.11 9.13 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 124.509 1.124 . . . . 5.93 112.728 177.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 26.1 mmt 68.98 12.52 8.64 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.607 0.763 . . . . 7.62 111.889 178.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.401 ' OG ' ' HE3' ' A' ' 41' ' ' LYS . 13.7 p 46.69 -98.55 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.157 0 N-CA-C 116.485 2.032 . . . . 3.91 116.485 176.073 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.472 ' O ' ' HA ' ' A' ' 54' ' ' THR . 66.5 mt -119.99 149.87 22.65 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.024 0 N-CA-C 108.294 -1.002 . . . . 3.76 108.294 -179.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.638 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 0.0 OUTLIER -119.22 141.33 49.0 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 108.841 -0.8 . . . . 6.79 108.841 -177.407 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.695 ' SG ' HG12 ' A' ' 50' ' ' VAL . 22.6 t -78.99 147.65 32.83 Favored 'General case' 0 C--N 1.314 -0.97 0 N-CA-C 112.217 0.451 . . . . 5.43 112.217 -177.2 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 2.5 tmmm? -64.29 -46.37 83.94 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.827 1.251 . . . . 5.91 110.978 -177.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.695 HG12 ' SG ' ' A' ' 48' ' ' CYS . 8.5 p -51.19 -32.55 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 N-CA-C 113.962 1.097 . . . . 7.94 113.962 -173.172 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 41.9 t -159.01 -74.06 0.08 Allowed 'General case' 0 C--N 1.3 -1.583 0 C-N-CA 120.79 -0.364 . . . . 9.28 110.044 -177.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 35.2 ttp 176.38 40.64 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 108.967 -0.753 . . . . 9.44 108.967 -176.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.638 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 13.9 mm-40 -89.69 -176.22 4.91 Favored 'General case' 0 C--O 1.193 -1.894 0 N-CA-C 107.72 -1.215 . . . . 9.11 107.72 -174.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.472 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 5.2 t -133.17 152.19 51.95 Favored 'General case' 0 C--N 1.286 -2.185 0 C-N-CA 117.73 -1.588 . . . . 5.93 113.506 -175.076 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 99.0 m-85 -135.18 156.55 48.8 Favored 'General case' 0 N--CA 1.427 -1.613 0 N-CA-C 106.489 -1.671 . . . . 5.27 106.489 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.2 tp -70.83 138.34 22.03 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.657 0 O-C-N 123.713 0.633 . . . . 5.23 111.88 -176.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 19.0 p -86.36 74.15 10.02 Favored 'General case' 0 N--CA 1.418 -2.064 0 CA-C-O 121.588 0.709 . . . . 4.21 111.132 178.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 21.1 p -70.78 -16.01 62.71 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.356 -0.838 . . . . 6.01 109.931 173.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 60.7 m -155.14 153.18 30.41 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 106.299 -1.741 . . . . 6.19 106.299 176.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.9 m -77.4 138.27 39.19 Favored 'General case' 0 N--CA 1.418 -2.03 0 N-CA-C 106.459 -1.682 . . . . 6.47 106.459 179.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -52.17 -39.31 59.86 Favored 'General case' 0 C--O 1.185 -2.291 0 C-N-CA 120.749 -0.381 . . . . 4.86 110.402 -179.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.548 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 17.2 m -53.38 -41.42 44.33 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.205 0 N-CA-C 114.403 1.26 . . . . 7.23 114.403 -178.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.4 tmtt? -72.37 -33.08 66.98 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-O 122.137 0.97 . . . . 9.36 108.851 -179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 60.0 m -73.48 -31.34 63.7 Favored 'General case' 0 C--N 1.31 -1.135 0 N-CA-C 108.39 -0.967 . . . . 5.9 108.39 178.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.45 ' HB3' ' O ' ' A' ' 62' ' ' VAL . 27.1 ttm180 -64.86 -42.85 94.53 Favored 'General case' 0 N--CA 1.426 -1.65 0 C-N-CA 125.472 1.509 . . . . 7.69 110.967 177.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.548 ' HG3' ' O ' ' A' ' 62' ' ' VAL . 27.9 mt-10 -55.43 -47.92 75.24 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 122.372 1.082 . . . . 9.78 108.44 178.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 17.1 t60 -75.59 -16.82 60.19 Favored 'General case' 0 C--N 1.293 -1.87 0 CA-C-N 113.768 -1.56 . . . . 8.97 110.943 -178.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.603 ' HA ' ' CD2' ' A' ' 72' ' ' HIS . . . -88.56 -41.46 12.68 Favored 'General case' 0 CA--C 1.489 -1.386 0 N-CA-C 112.423 0.527 . . . . 6.53 112.423 -177.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 33.0 mm-40 -68.2 -25.06 65.04 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 107.854 -1.165 . . . . 8.5 107.854 178.405 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.483 ' O ' ' HD3' ' A' ' 71' ' ' LYS . . . -75.8 -31.24 59.35 Favored 'General case' 0 C--O 1.245 0.854 0 CA-C-N 114.783 -1.099 . . . . 9.41 111.192 176.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.483 ' HD3' ' O ' ' A' ' 70' ' ' ALA . 73.4 mmtt -135.43 -111.08 0.21 Allowed 'General case' 0 C--N 1.355 0.842 0 N-CA-C 109.682 -0.488 . . . . 10.32 109.682 -177.239 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.603 ' CD2' ' HA ' ' A' ' 68' ' ' ALA . 9.7 m170 29.23 51.62 0.4 Allowed Pre-proline 0 N--CA 1.501 2.086 0 N-CA-C 115.758 1.762 . . . . 7.47 115.758 178.336 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.535 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 1.0 OUTLIER -79.85 -3.35 12.75 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 122.375 2.05 . . . . 6.81 113.838 -175.069 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.568 ' O ' ' HG3' ' A' ' 85' ' ' LYS . 18.4 ptmt -161.45 109.3 1.47 Allowed 'General case' 0 C--O 1.199 -1.597 0 N-CA-C 111.987 0.365 . . . . 7.32 111.987 -177.198 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -97.62 122.04 40.24 Favored 'General case' 0 C--N 1.303 -1.422 0 N-CA-C 108.221 -1.029 . . . . 4.52 108.221 174.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -98.95 -90.65 0.29 Allowed 'General case' 0 C--O 1.211 -0.942 0 CA-C-N 115.815 -0.629 . . . . 6.82 110.818 -173.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 32.7 m -82.44 -11.95 12.22 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 CA-C-O 122.284 1.04 . . . . 8.15 109.044 176.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.479 HG21 ' HA ' ' A' ' 85' ' ' LYS . 35.8 m -99.19 13.57 5.0 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 CA-C-N 113.881 -1.509 . . . . 5.65 108.707 177.382 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.85 -15.2 53.64 Favored 'General case' 0 C--O 1.251 1.132 0 CA-C-O 121.622 0.725 . . . . 4.24 111.539 178.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.426 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 73.6 m -75.56 -15.81 60.33 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-N 115.295 -0.866 . . . . 5.6 110.701 175.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.522 ' CD1' HD12 ' A' ' 84' ' ' LEU . 16.4 p90 -154.1 70.6 6.34 Favored Pre-proline 0 CA--C 1.561 1.382 0 C-N-CA 124.454 1.102 . . . . 5.13 111.527 179.068 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -57.38 -22.96 52.6 Favored 'Trans proline' 0 N--CA 1.495 1.589 0 C-N-CA 123.481 2.787 . . . . 3.27 114.478 -173.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -73.71 -1.38 18.86 Favored 'General case' 0 C--N 1.309 -1.181 0 C-N-CA 120.161 -0.615 . . . . 4.25 111.825 -178.051 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.522 HD12 ' CD1' ' A' ' 81' ' ' PHE . 19.3 mt -123.01 14.66 9.89 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 118.162 0.437 . . . . 5.47 111.011 -177.134 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.568 ' HG3' ' O ' ' A' ' 74' ' ' LYS . 4.7 tmtt? -53.92 -83.38 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 113.764 1.024 . . . . 8.04 113.764 -177.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.485 ' HG2' ' HD2' ' A' ' 85' ' ' LYS . 31.9 mmmt . . . . . 0 CA--C 1.503 -0.861 0 CA-C-O 118.913 -0.565 . . . . 11.1 110.919 179.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.803 0 N-CA-C 111.991 -0.443 . . . . 19.14 111.991 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 97.5 m-70 63.37 14.29 7.77 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.427 1.091 . . . . 19.74 112.886 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 95.2 m-70 -148.45 162.0 40.48 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 108.833 -0.803 . . . . 17.67 108.833 179.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -69.35 148.53 49.55 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 120.482 0.182 . . . . 14.74 110.563 178.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 27.3 p80 -131.45 138.79 49.19 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 120.622 0.249 . . . . 14.24 111.011 -176.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 15.1 t-80 -156.69 138.96 14.69 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 107.889 -1.152 . . . . 13.67 107.889 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 67.4 m-70 -133.74 128.94 35.93 Favored 'General case' 0 C--N 1.312 -1.059 0 N-CA-C 109.801 -0.444 . . . . 10.3 109.801 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.7 mp 62.46 -174.65 0.14 Allowed 'General case' 0 CA--C 1.557 1.242 0 O-C-N 124.336 1.022 . . . . 10.1 111.95 179.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 64.35 16.45 10.15 Favored 'General case' 0 N--CA 1.498 1.943 0 C-N-CA 124.252 1.021 . . . . 11.87 110.541 178.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 177.55 -167.43 38.44 Favored Glycine 0 N--CA 1.427 -1.941 0 N-CA-C 109.065 -1.614 . . . . 9.6 109.065 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -99.7 92.2 1.12 Allowed Glycine 0 N--CA 1.433 -1.518 0 C-N-CA 120.407 -0.901 . . . . 8.45 111.09 178.237 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -96.88 63.65 1.04 Allowed Glycine 0 C--N 1.312 -0.76 0 C-N-CA 121.025 -0.607 . . . . 9.24 111.796 -179.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -83.8 113.72 21.12 Favored 'General case' 0 C--N 1.308 -1.223 0 CA-C-O 122.183 0.992 . . . . 9.68 111.667 -178.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -88.02 179.59 6.39 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 114.959 -1.019 . . . . 11.12 110.088 177.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . 0.476 ' C ' ' H ' ' A' ' 17' ' ' SER . 47.3 mt-30 -72.77 168.19 19.31 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-N 116.078 -0.51 . . . . 15.18 111.905 -179.773 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 79.02 -31.69 0.15 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.213 1.805 . . . . 15.42 108.363 -173.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.476 ' H ' ' C ' ' A' ' 15' ' ' GLN . 32.7 t 70.92 -38.34 0.42 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 126.665 1.986 . . . . 11.21 112.811 175.409 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.53 -51.92 65.44 Favored 'General case' 0 C--N 1.311 -1.105 0 C-N-CA 123.228 0.611 . . . . 13.14 112.553 -177.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -85.09 -1.81 57.28 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.447 -0.342 . . . . 14.08 111.264 -178.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -90.94 -28.92 17.75 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.622 0.725 . . . . 9.77 109.77 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 74.8 mtp180 -96.08 10.43 37.6 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 114.981 -1.009 . . . . 10.29 110.186 -178.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.55 -35.53 70.65 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.754 -0.657 . . . . 9.15 110.818 179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -136.55 -90.67 0.27 Allowed 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 109.036 -0.728 . . . . 11.12 109.036 178.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 54.7 t30 58.87 -71.42 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 114.636 1.347 . . . . 6.46 114.636 175.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 59.6 tp -121.39 116.29 24.51 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-O 121.378 0.609 . . . . 6.81 110.314 -175.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -84.11 -27.88 27.89 Favored 'General case' 0 C--N 1.3 -1.574 0 N-CA-C 113.761 1.022 . . . . 7.7 113.761 -176.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -82.1 16.48 1.93 Allowed 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 113.083 0.771 . . . . 8.86 113.083 -174.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -108.89 -171.88 1.94 Allowed 'General case' 0 C--N 1.303 -1.432 0 C-N-CA 122.76 0.424 . . . . 6.48 110.474 179.635 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -129.12 151.01 50.26 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 123.361 0.665 . . . . 10.01 109.358 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -113.63 -170.9 1.79 Allowed 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 109.608 -0.516 . . . . 7.43 109.608 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -91.54 -176.54 4.54 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.837 0.351 . . . . 8.16 110.636 -178.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -144.98 -60.47 0.02 OUTLIER Glycine 0 N--CA 1.439 -1.105 0 C-N-CA 120.8 -0.714 . . . . 7.69 111.393 -179.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 67.6 mttm -90.85 139.69 30.51 Favored 'General case' 0 C--O 1.25 1.114 0 N-CA-C 109.842 -0.429 . . . . 8.86 109.842 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -70.64 137.44 27.28 Favored Glycine 0 N--CA 1.439 -1.151 0 O-C-N 123.959 0.787 . . . . 8.28 112.902 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.502 ' HB2' ' HB3' ' A' ' 38' ' ' GLU . 22.9 p -89.64 169.39 11.36 Favored 'General case' 0 N--CA 1.425 -1.7 0 C-N-CA 123.051 0.54 . . . . 9.53 111.604 -178.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -126.15 -67.05 0.89 Allowed 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.727 -0.471 . . . . 11.91 109.727 178.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.5 mt -104.35 -35.36 7.98 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.604 -0.517 . . . . 10.08 109.604 176.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.502 ' HB3' ' HB2' ' A' ' 35' ' ' SER . 12.2 pt-20 52.79 -168.78 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 125.494 1.518 . . . . 7.86 113.591 178.6 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . 71.7 -17.28 0.35 Allowed 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.627 1.171 . . . . 5.92 113.763 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -73.71 18.19 0.14 Allowed 'General case' 0 N--CA 1.481 1.077 0 N-CA-C 113.52 0.933 . . . . 6.88 113.52 -177.793 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.499 ' HE2' HG12 ' A' ' 56' ' ' ILE . 34.2 ttmt -131.26 -74.72 0.52 Allowed 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.345 -0.942 . . . . 7.95 109.58 178.133 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt 64.4 -33.63 0.15 Allowed 'General case' 0 CA--C 1.571 1.755 0 N-CA-C 114.855 1.428 . . . . 8.17 114.855 176.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -89.85 -15.82 31.41 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 113.464 0.913 . . . . 5.93 113.464 -175.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 1.3 mpt? 61.42 90.04 0.07 Allowed 'General case' 0 N--CA 1.473 0.696 0 O-C-N 123.898 0.748 . . . . 7.62 110.795 -173.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.506 ' OG ' HG13 ' A' ' 46' ' ' ILE . 22.7 t -60.0 -81.86 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 114.889 -1.05 . . . . 3.91 113.767 -178.263 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.506 HG13 ' OG ' ' A' ' 45' ' ' SER . 13.2 mt -129.41 159.34 41.55 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 CA-C-N 115.968 -0.56 . . . . 3.76 110.056 -172.368 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.624 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 34.9 tt0 -108.98 135.03 50.83 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.914 0.885 . . . . 6.79 109.196 178.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.678 ' SG ' HG12 ' A' ' 50' ' ' VAL . 47.6 t -77.55 144.81 37.31 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.516 -0.765 . . . . 5.43 111.06 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.514 ' HD3' ' O ' ' A' ' 79' ' ' ALA . 14.7 ttpt -59.13 -47.07 86.63 Favored 'General case' 0 C--O 1.224 -0.265 0 C-N-CA 124.897 1.279 . . . . 5.91 112.426 -175.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.678 HG12 ' SG ' ' A' ' 48' ' ' CYS . 7.1 p -49.48 -32.84 6.81 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-N 114.542 -1.208 . . . . 7.94 113.902 -170.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.436 ' SG ' ' HG2' ' A' ' 52' ' ' MET . 52.7 t -160.02 -71.23 0.07 Allowed 'General case' 0 N--CA 1.419 -2.01 0 C-N-CA 119.915 -0.714 . . . . 9.28 110.492 -177.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.436 ' HG2' ' SG ' ' A' ' 51' ' ' CYS . 24.3 ptt? -178.95 28.12 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 O-C-N 123.5 0.5 . . . . 9.44 111.195 -174.568 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.624 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 10.6 mm-40 -83.95 178.6 7.81 Favored 'General case' 0 C--O 1.201 -1.456 0 N-CA-C 108.177 -1.045 . . . . 9.11 108.177 -171.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.491 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 9.5 t -134.86 145.1 47.97 Favored 'General case' 0 C--N 1.279 -2.483 0 C-N-CA 117.894 -1.523 . . . . 5.93 112.303 -175.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.487 ' O ' ' HB3' ' A' ' 45' ' ' SER . 96.8 m-85 -107.31 173.42 6.33 Favored 'General case' 0 N--CA 1.424 -1.762 0 CA-C-N 114.317 -1.311 . . . . 5.27 108.27 176.404 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.613 HD13 ' H ' ' A' ' 57' ' ' CYS . 0.3 OUTLIER -104.51 148.79 8.7 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.547 0 N-CA-C 107.287 -1.375 . . . . 5.23 107.287 -177.217 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.613 ' H ' HD13 ' A' ' 56' ' ' ILE . 42.5 t -71.82 77.58 0.87 Allowed 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.895 0.855 . . . . 4.21 110.322 176.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 9.9 t -96.95 -11.02 25.15 Favored 'General case' 0 N--CA 1.43 -1.44 0 CA-C-N 114.859 -1.064 . . . . 6.01 108.706 174.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 47.2 m -161.95 150.81 15.47 Favored 'General case' 0 N--CA 1.443 -0.799 0 N-CA-C 106.76 -1.57 . . . . 6.19 106.76 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 11.3 m -89.4 131.16 35.59 Favored 'General case' 0 N--CA 1.406 -2.647 0 N-CA-C 105.719 -1.956 . . . . 6.47 105.719 178.279 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.545 ' O ' ' HG3' ' A' ' 65' ' ' ARG . 42.7 mt-10 -52.45 -29.98 27.35 Favored 'General case' 0 C--O 1.186 -2.256 0 N-CA-C 112.787 0.662 . . . . 4.86 112.787 -177.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.406 HG22 ' NH2' ' A' ' 65' ' ' ARG . 86.5 t -58.91 -36.86 63.77 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.4 0 N-CA-C 111.721 0.267 . . . . 7.23 111.721 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 12.1 tmtt? -71.56 -30.59 66.04 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 108.02 -1.104 . . . . 9.36 108.02 -179.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 69.8 m -80.2 -25.68 39.55 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 114.726 -1.125 . . . . 5.9 110.956 176.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.545 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 65.8 mtm180 -64.78 -49.12 71.95 Favored 'General case' 0 CA--C 1.5 -0.958 0 N-CA-C 111.972 0.36 . . . . 7.69 111.972 -179.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -63.68 -39.48 94.42 Favored 'General case' 0 C--O 1.217 -0.617 0 C-N-CA 119.967 -0.693 . . . . 9.78 109.673 177.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -62.72 -30.85 71.73 Favored 'General case' 0 CA--C 1.558 1.271 0 CA-C-N 115.918 -0.583 . . . . 8.97 111.085 179.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -77.67 -50.36 12.62 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 116.295 -0.411 . . . . 6.53 111.17 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.459 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 10.8 pt-20 -69.17 -18.09 63.89 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 121.103 0.478 . . . . 8.5 111.743 -178.527 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.0 -17.56 59.64 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.424 -0.807 . . . . 9.41 111.287 176.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.421 ' HG3' ' HG2' ' A' ' 86' ' ' LYS . 47.2 mmtm -138.19 -73.99 0.4 Allowed 'General case' 0 C--O 1.211 -0.93 0 CA-C-O 120.691 0.281 . . . . 10.32 111.31 -174.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 18.5 p80 43.5 63.06 8.36 Favored Pre-proline 0 N--CA 1.478 0.963 0 N-CA-C 114.864 1.431 . . . . 7.47 114.864 -178.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -79.74 -60.64 0.03 OUTLIER 'Trans proline' 0 N--CA 1.445 -1.343 0 C-N-CA 121.244 1.296 . . . . 6.81 114.101 178.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 16.7 ptpt -158.21 107.29 2.03 Favored 'General case' 0 N--CA 1.44 -0.942 0 C-N-CA 119.587 -0.845 . . . . 7.32 112.555 -173.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.746 ' HB2' ' HG2' ' A' ' 85' ' ' LYS . . . -85.0 89.96 7.72 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.374 -0.83 . . . . 4.52 110.201 176.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -113.98 -72.48 0.7 Allowed 'General case' 0 N--CA 1.482 1.165 0 CA-C-O 121.101 0.477 . . . . 6.82 111.647 -178.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 27.2 m -77.51 -14.56 14.3 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.63 0 CA-C-O 122.079 0.942 . . . . 8.15 108.973 176.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.62 HG21 ' HA ' ' A' ' 85' ' ' LYS . 29.1 m -105.22 11.08 8.81 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.141 0 CA-C-N 114.346 -1.297 . . . . 5.65 108.979 175.141 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.514 ' O ' ' HD3' ' A' ' 49' ' ' LYS . . . -61.21 -18.2 57.06 Favored 'General case' 0 N--CA 1.485 1.281 0 N-CA-C 112.076 0.398 . . . . 4.24 112.076 179.405 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.534 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 78.2 m -76.99 -13.1 60.0 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 116.212 -0.449 . . . . 5.6 111.293 178.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.41 ' CZ ' HG21 ' A' ' 46' ' ' ILE . 0.5 OUTLIER -151.69 75.27 7.75 Favored Pre-proline 0 C--N 1.306 -1.29 0 N-CA-C 106.69 -1.596 . . . . 5.13 106.69 174.634 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -67.88 9.44 0.36 Allowed 'Trans proline' 0 C--N 1.367 1.538 0 C-N-CA 123.7 2.933 . . . . 3.27 114.345 -173.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 38.7 m170 -91.08 -4.6 56.15 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.946 -0.761 . . . . 4.25 108.946 175.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 13.4 mt -120.59 21.09 11.67 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-N 116.299 -0.409 . . . . 5.47 110.435 -174.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.746 ' HG2' ' HB2' ' A' ' 75' ' ' ALA . 58.6 mttp -36.86 -49.02 0.78 Allowed 'General case' 0 CA--C 1.561 1.375 0 N-CA-C 117.607 2.447 . . . . 8.04 117.607 -173.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.421 ' HG2' ' HG3' ' A' ' 71' ' ' LYS . 54.5 tptt . . . . . 0 C--N 1.326 -0.432 0 CA-C-O 118.752 -0.642 . . . . 11.1 112.712 -177.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.488 -1.616 0 N-CA-C 109.649 -1.38 . . . . 19.14 109.649 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 15.7 t60 -140.65 127.63 20.69 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 109.474 -0.565 . . . . 19.74 109.474 -179.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 25.7 t-80 71.98 131.0 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.139 0.975 . . . . 17.67 112.298 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 74.1 m-70 -64.26 122.02 15.65 Favored 'General case' 0 C--N 1.318 -0.789 0 N-CA-C 108.213 -1.032 . . . . 14.74 108.213 177.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 43.7 p-80 -155.41 161.33 41.02 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.685 -0.406 . . . . 14.24 111.026 -177.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.4 m170 72.98 178.71 0.23 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 124.646 1.179 . . . . 13.67 112.384 -176.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.507 ' HD2' ' O ' ' A' ' 20' ' ' ALA . 25.4 t-80 -163.43 144.51 9.25 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 106.882 -1.525 . . . . 10.3 106.882 -178.387 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.547 ' HB2' ' O ' ' A' ' 23' ' ' LYS . 54.5 tp -54.36 -69.39 0.13 Allowed 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 121.321 0.581 . . . . 10.1 111.963 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -88.04 112.06 22.22 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-N 115.34 -0.845 . . . . 11.87 108.854 -177.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.88 -28.69 7.91 Favored Glycine 0 C--N 1.309 -0.943 0 C-N-CA 120.617 -0.801 . . . . 9.6 111.531 -178.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 73.94 -58.27 2.22 Favored Glycine 0 C--O 1.249 1.083 0 N-CA-C 115.388 0.915 . . . . 8.45 115.388 177.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -77.31 52.64 3.43 Favored Glycine 0 CA--C 1.525 0.709 0 N-CA-C 115.801 1.08 . . . . 9.24 115.801 -172.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 65.52 -172.73 0.18 Allowed 'General case' 0 CA--C 1.559 1.322 0 C-N-CA 123.954 0.902 . . . . 9.68 110.759 174.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -179.33 164.11 1.32 Allowed 'General case' 0 C--O 1.249 1.077 0 C-N-CA 124.05 0.94 . . . . 11.12 109.09 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -73.03 176.59 5.63 Favored 'General case' 0 C--O 1.239 0.544 0 O-C-N 123.216 0.322 . . . . 15.18 110.46 177.163 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 60.3 pttt 47.65 43.3 16.36 Favored 'General case' 0 C--N 1.365 1.275 0 CA-C-O 122.333 1.063 . . . . 15.42 109.942 -173.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.464 ' HA ' ' HB3' ' A' ' 20' ' ' ALA . 14.3 m -57.22 -5.62 0.31 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 127.096 2.158 . . . . 11.21 113.927 -175.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.77 -59.41 4.59 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.69 -0.485 . . . . 13.14 109.69 177.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 26.2 mmt -101.32 -11.18 19.65 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.144 -0.48 . . . . 14.08 111.266 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.507 ' O ' ' HD2' ' A' ' 7' ' ' HIS . . . -72.08 -11.64 60.84 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.2 0.524 . . . . 9.77 111.258 -179.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.88 -1.65 58.11 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 112.557 0.577 . . . . 10.29 112.557 178.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.53 105.29 1.8 Allowed 'General case' 0 C--O 1.237 0.41 0 N-CA-C 109.06 -0.719 . . . . 9.15 109.06 177.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.547 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 13.7 mmmm 67.11 117.46 0.03 OUTLIER 'General case' 0 C--N 1.353 0.718 0 O-C-N 124.421 1.076 . . . . 11.12 111.262 -172.209 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.6 p30 -145.82 133.64 21.22 Favored 'General case' 0 C--N 1.297 -1.701 0 C-N-CA 120.243 -0.583 . . . . 6.46 109.735 175.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 88.3 mt 59.1 85.07 0.1 Allowed 'General case' 0 N--CA 1.468 0.447 0 O-C-N 124.643 1.215 . . . . 6.81 112.002 -177.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -79.11 149.34 32.09 Favored 'General case' 0 N--CA 1.427 -1.579 0 N-CA-C 108.797 -0.816 . . . . 7.7 108.797 -179.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -127.81 -73.49 0.6 Allowed 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 116.588 -0.278 . . . . 8.86 111.351 -176.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -144.87 100.14 3.45 Favored 'General case' 0 N--CA 1.431 -1.378 0 CA-C-O 120.868 0.366 . . . . 6.48 111.046 -177.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -100.31 142.97 31.05 Favored 'General case' 0 C--O 1.252 1.207 0 CA-C-N 115.365 -0.834 . . . . 10.01 109.651 176.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -77.99 123.9 27.37 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.647 -0.706 . . . . 7.43 110.879 -178.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -128.41 104.78 7.89 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 109.242 -0.651 . . . . 8.16 109.242 178.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -166.77 -62.85 0.03 OUTLIER Glycine 0 N--CA 1.442 -0.963 0 N-CA-C 110.858 -0.897 . . . . 7.69 110.858 -178.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 14.9 mmmm -86.15 -178.17 6.45 Favored 'General case' 0 C--O 1.247 0.923 0 N-CA-C 109.269 -0.641 . . . . 8.86 109.269 178.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -77.65 82.79 1.16 Allowed Glycine 0 N--CA 1.447 -0.584 0 C-N-CA 120.921 -0.657 . . . . 8.28 113.366 -177.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 36.4 p -78.05 105.99 9.63 Favored 'General case' 0 N--CA 1.434 -1.252 0 N-CA-C 108.913 -0.773 . . . . 9.53 108.913 176.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -121.15 -76.26 0.59 Allowed 'General case' 0 C--N 1.31 -1.144 0 C-N-CA 120.562 -0.455 . . . . 11.91 110.687 -177.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.0 mp -100.26 -35.7 9.53 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 120.449 -0.501 . . . . 10.08 111.389 178.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.51 ' O ' ' HD2' ' A' ' 42' ' ' LYS . 30.9 tt0 59.59 94.54 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 124.083 0.953 . . . . 7.86 110.798 -177.125 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -158.07 -46.77 0.06 Allowed 'General case' 0 CA--C 1.504 -0.799 0 CA-C-N 116.142 -0.481 . . . . 5.92 110.24 -178.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 25.3 p-10 -47.17 -46.77 23.85 Favored 'General case' 0 C--O 1.215 -0.742 0 N-CA-C 114.513 1.301 . . . . 6.88 114.513 -176.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -136.84 32.95 2.68 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.624 -0.43 . . . . 7.95 111.946 -177.312 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.51 ' HD2' ' O ' ' A' ' 38' ' ' GLU . 20.2 ptmt -83.46 8.6 13.41 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 120.228 -0.589 . . . . 8.17 110.747 -179.049 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -98.65 0.16 44.16 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.413 -0.812 . . . . 5.93 110.085 178.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 1.3 mpt? 56.27 78.02 0.22 Allowed 'General case' 0 C--N 1.347 0.492 0 O-C-N 124.276 0.985 . . . . 7.62 111.496 -176.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.508 ' HB2' ' O ' ' A' ' 55' ' ' PHE . 62.6 m -61.26 -72.52 0.12 Allowed 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 114.816 -1.084 . . . . 3.91 112.253 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.525 ' O ' ' HA ' ' A' ' 54' ' ' THR . 75.4 mt -129.6 129.73 66.75 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 N-CA-C 108.019 -1.104 . . . . 3.76 108.019 -178.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.584 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 28.8 tt0 -97.9 130.33 44.79 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 108.728 -0.841 . . . . 6.79 108.728 178.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.594 ' SG ' HG22 ' A' ' 50' ' ' VAL . 41.9 t -67.56 123.6 20.89 Favored 'General case' 0 N--CA 1.421 -1.88 0 CA-C-N 115.708 -0.678 . . . . 5.43 110.479 178.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.444 ' HD2' ' O ' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -50.07 -33.15 17.51 Favored 'General case' 0 C--N 1.303 -1.45 0 C-N-CA 127.17 2.188 . . . . 5.91 111.608 -177.759 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.594 HG22 ' SG ' ' A' ' 48' ' ' CYS . 10.2 m -59.1 -23.18 23.77 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 N-CA-C 112.765 0.654 . . . . 7.94 112.765 -175.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.9 t -173.63 -81.93 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 120.734 0.302 . . . . 9.28 110.89 178.29 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.535 ' HA ' ' CG ' ' A' ' 47' ' ' GLN . 55.0 ttp -165.5 36.73 0.06 Allowed 'General case' 0 CA--C 1.547 0.832 0 CA-C-O 122.326 1.06 . . . . 9.44 109.736 -174.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.584 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 14.7 mm-40 -88.99 -177.27 5.42 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 107.302 -1.369 . . . . 9.11 107.302 -178.497 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.525 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 13.3 t -144.32 149.22 35.87 Favored 'General case' 0 N--CA 1.42 -1.952 0 C-N-CA 117.156 -1.817 . . . . 5.93 113.041 -177.613 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.508 ' O ' ' HB2' ' A' ' 45' ' ' SER . 98.4 m-85 -125.93 153.74 43.82 Favored 'General case' 0 N--CA 1.418 -2.068 0 N-CA-C 106.826 -1.546 . . . . 5.27 106.826 177.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 9.0 tp -79.32 139.72 17.91 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.342 0 O-C-N 123.411 0.444 . . . . 5.23 110.377 -178.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.443 ' HB2' ' HB3' ' A' ' 45' ' ' SER . 43.0 t -81.16 74.7 8.16 Favored 'General case' 0 N--CA 1.429 -1.525 0 N-CA-C 108.683 -0.858 . . . . 4.21 108.683 177.103 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 9.8 t -92.26 1.14 57.4 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 115.406 -0.816 . . . . 6.01 109.951 177.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 92.5 m -156.54 137.26 13.29 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 108.014 -1.106 . . . . 6.19 108.014 178.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 17.9 m -78.72 138.23 38.16 Favored 'General case' 0 N--CA 1.419 -1.997 0 O-C-N 123.522 0.514 . . . . 6.47 110.038 -175.893 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -51.08 -29.33 12.73 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 124.915 1.286 . . . . 4.86 112.295 178.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 64.3 t -72.54 -32.42 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.78 0 CA-C-O 120.913 0.387 . . . . 7.23 111.384 178.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 2.9 tppp? -71.52 -39.59 70.67 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-O 122.322 1.058 . . . . 9.36 108.96 177.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 55.6 m -62.47 -38.16 88.75 Favored 'General case' 0 C--N 1.271 -2.814 0 CA-C-N 113.885 -1.507 . . . . 5.9 109.462 174.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 23.5 ttt180 -57.68 -51.74 68.29 Favored 'General case' 0 N--CA 1.444 -0.768 0 C-N-CA 123.811 0.845 . . . . 7.69 112.895 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -61.7 -38.22 87.03 Favored 'General case' 0 C--O 1.24 0.556 0 CA-C-O 121.488 0.661 . . . . 9.78 111.346 -177.341 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 32.0 t60 -76.67 -31.8 57.53 Favored 'General case' 0 C--N 1.306 -1.287 0 CA-C-N 115.857 -0.61 . . . . 8.97 109.898 -177.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.446 ' HB1' ' CG ' ' A' ' 85' ' ' LYS . . . -75.99 -25.39 55.74 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 115.753 -0.658 . . . . 6.53 111.717 -177.624 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -83.17 -21.03 33.64 Favored 'General case' 0 C--N 1.294 -1.839 0 C-N-CA 120.03 -0.668 . . . . 8.5 111.512 176.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.47 -32.44 37.11 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.08 0.466 . . . . 9.41 110.493 175.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.441 ' HB3' ' HD3' ' A' ' 73' ' ' PRO . 13.5 mptt -101.45 -86.54 0.41 Allowed 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.948 0.721 . . . . 10.32 112.948 -179.002 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.461 ' N ' ' HD3' ' A' ' 73' ' ' PRO 0.256 23.9 p80 46.38 59.01 16.21 Favored Pre-proline 0 N--CA 1.485 1.276 0 N-CA-C 116.052 1.871 . . . . 7.47 116.052 -177.306 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.461 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 6.2 Cg_exo -82.34 -55.43 0.03 OUTLIER 'Trans proline' 0 N--CA 1.434 -2.016 0 C-N-CA 121.77 1.647 . . . . 6.81 112.063 175.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 12.7 ptmm? -160.84 108.82 1.56 Allowed 'General case' 0 N--CA 1.436 -1.16 0 CA-C-O 121.435 0.636 . . . . 7.32 111.819 -177.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.414 ' O ' ' HB2' ' A' ' 79' ' ' ALA . . . -73.07 88.88 1.43 Allowed 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 106.777 -1.564 . . . . 4.52 106.777 171.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -113.19 -75.24 0.6 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.014 -0.994 . . . . 6.82 110.66 -172.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 34.8 m -78.64 -11.91 13.34 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.832 0 CA-C-O 121.893 0.854 . . . . 8.15 108.743 176.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 33.4 m -109.29 13.1 8.68 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.025 0 CA-C-N 114.393 -1.276 . . . . 5.65 109.246 177.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.414 ' HB2' ' O ' ' A' ' 75' ' ' ALA . . . -66.32 -6.0 12.55 Favored 'General case' 0 N--CA 1.481 1.112 0 CA-C-O 121.725 0.774 . . . . 4.24 110.604 177.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.405 ' HB2' ' SG ' ' A' ' 48' ' ' CYS . 18.4 p -70.85 -27.31 63.75 Favored 'General case' 0 N--CA 1.422 -1.866 0 CA-C-N 114.813 -1.085 . . . . 5.6 109.634 176.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 34.6 t80 -155.02 88.22 3.22 Favored Pre-proline 0 N--CA 1.439 -0.986 0 N-CA-C 106.866 -1.531 . . . . 5.13 106.866 174.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -60.6 5.49 0.14 Allowed 'Trans proline' 0 N--CA 1.503 2.061 0 C-N-CA 124.212 3.275 . . . . 3.27 115.063 -172.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 65.1 m-70 -87.96 -8.58 55.5 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 109.205 -0.665 . . . . 4.25 109.205 174.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 36.9 mt -99.32 8.77 44.4 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.848 -0.615 . . . . 5.47 111.128 -176.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.446 ' CG ' ' HB1' ' A' ' 68' ' ' ALA . 18.9 pttp -50.65 105.74 0.11 Allowed 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 122.003 0.906 . . . . 8.04 113.227 179.588 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 81.7 tttt . . . . . 0 N--CA 1.441 -0.908 0 CA-C-N 113.696 -1.593 . . . . 11.1 110.154 -175.087 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.215 -1.092 0 N-CA-C 110.714 -0.954 . . . . 19.14 110.714 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 9.1 p-80 -98.44 178.93 4.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 117.231 0.515 . . . . 19.74 111.652 -178.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 53.4 m80 -100.44 158.33 15.98 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.193 -0.458 . . . . 17.67 110.024 178.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 31.1 t60 -102.18 128.68 48.58 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 120.745 0.307 . . . . 14.74 110.49 -176.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 73.0 t60 -158.68 138.0 11.58 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 108.506 -0.924 . . . . 14.24 108.506 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 44.8 t-80 -61.29 128.36 36.01 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 108.906 -0.776 . . . . 13.67 108.906 -179.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 39.9 m80 -67.49 156.97 35.38 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.698 -0.401 . . . . 10.3 110.608 178.919 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 84.2 mt 82.59 -17.08 0.54 Allowed 'General case' 0 N--CA 1.497 1.887 0 C-N-CA 125.555 1.542 . . . . 10.1 111.337 -176.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -87.15 100.54 12.74 Favored 'General case' 0 C--O 1.244 0.806 0 CA-C-O 119.356 -0.354 . . . . 11.87 110.292 -179.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 76.92 129.71 0.38 Allowed Glycine 0 C--O 1.246 0.892 0 C-N-CA 120.82 -0.705 . . . . 9.6 112.934 177.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -76.18 80.62 1.1 Allowed Glycine 0 N--CA 1.447 -0.612 0 C-N-CA 121.642 -0.313 . . . . 8.45 112.789 -176.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -113.3 41.93 2.08 Favored Glycine 0 C--N 1.316 -0.566 0 C-N-CA 120.852 -0.69 . . . . 9.24 112.678 179.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.646 ' O ' ' HA ' ' A' ' 19' ' ' MET . 13.4 m120 -126.21 140.4 52.58 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 122.619 -0.342 . . . . 9.68 110.752 -179.067 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.538 ' HA ' ' HG2' ' A' ' 19' ' ' MET . . . -89.11 166.05 14.1 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 114.025 1.121 . . . . 11.12 114.025 -172.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 71.75 173.23 0.31 Allowed 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 125.421 1.489 . . . . 15.18 110.111 -179.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.596 ' HB3' ' HA ' ' A' ' 22' ' ' ALA . 23.0 tptm 75.32 -56.67 0.61 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 124.611 1.164 . . . . 15.42 113.369 174.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.491 ' HB2' ' H ' ' A' ' 21' ' ' ARG . 38.6 m -132.21 26.36 4.52 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 116.252 -0.431 . . . . 11.21 109.962 -178.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . 55.06 41.66 31.55 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.647 -0.706 . . . . 13.14 109.679 -179.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.646 ' HA ' ' O ' ' A' ' 13' ' ' ASN . 65.5 mtt 78.97 6.27 2.22 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-N 114.637 -1.165 . . . . 14.08 112.335 -178.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.474 ' HB3' ' HB3' ' A' ' 17' ' ' SER . . . -75.9 -30.83 58.94 Favored 'General case' 0 C--O 1.225 -0.233 0 C-N-CA 118.512 -1.275 . . . . 9.77 109.477 178.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.491 ' H ' ' HB2' ' A' ' 17' ' ' SER . 25.1 ptt180 -178.2 83.71 0.02 OUTLIER 'General case' 0 C--O 1.206 -1.222 0 C-N-CA 124.204 1.002 . . . . 10.29 110.862 -178.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.596 ' HA ' ' HB3' ' A' ' 16' ' ' LYS . . . -63.53 -82.83 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 119.305 -0.958 . . . . 9.15 111.702 175.214 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -131.4 15.91 4.98 Favored 'General case' 0 CA--C 1.491 -1.31 0 N-CA-C 106.193 -1.78 . . . . 11.12 106.193 175.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -84.31 -35.84 23.02 Favored 'General case' 0 C--N 1.3 -1.561 0 CA-C-N 113.724 -1.58 . . . . 6.46 112.411 -172.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -120.18 -79.03 0.6 Allowed 'General case' 0 C--O 1.213 -0.817 0 C-N-CA 120.163 -0.615 . . . . 6.81 110.123 -174.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 52.24 95.07 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 114.87 1.433 . . . . 7.7 114.87 -178.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.432 ' HB3' ' HB3' ' A' ' 30' ' ' ALA . 75.4 mmtt 70.37 102.16 0.06 Allowed 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.296 1.038 . . . . 8.86 111.49 179.16 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -71.93 -53.98 11.42 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 115.302 -0.863 . . . . 6.48 112.428 -175.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -113.69 8.46 17.54 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-O 121.334 0.588 . . . . 10.01 110.164 -177.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.432 ' HB3' ' HB3' ' A' ' 27' ' ' LYS . . . -117.87 20.54 13.31 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 115.437 -0.801 . . . . 7.43 109.776 179.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.01 141.44 43.93 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 115.039 -0.982 . . . . 8.16 111.108 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -102.01 -139.98 10.86 Favored Glycine 0 C--O 1.251 1.207 0 C-N-CA 120.976 -0.631 . . . . 7.69 113.472 -178.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 46.5 mmtm -147.71 31.95 0.87 Allowed 'General case' 0 C--O 1.244 0.815 0 C-N-CA 124.647 1.179 . . . . 8.86 109.776 -178.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -115.84 176.43 16.49 Favored Glycine 0 N--CA 1.445 -0.711 0 CA-C-N 115.864 -0.607 . . . . 8.28 111.912 -178.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 31.3 t 174.47 -40.09 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 107.298 -1.371 . . . . 9.53 107.298 -178.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -78.53 -173.08 3.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.52 -1.218 . . . . 11.91 109.379 177.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 54.1 tp -55.67 -45.74 77.67 Favored 'General case' 0 N--CA 1.467 0.398 0 O-C-N 123.502 0.501 . . . . 10.08 110.432 177.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 66.95 118.5 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.245 0 CA-C-O 122.523 1.154 . . . . 7.86 114.062 175.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -87.51 149.99 24.02 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 115.284 -0.871 . . . . 5.92 110.885 -178.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -53.74 -45.78 70.66 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 123.562 0.539 . . . . 6.88 110.7 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 92.0 mttt -96.44 33.92 1.72 Allowed 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.228 0.455 . . . . 7.95 112.228 -179.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 79.0 tttt -59.91 -39.14 84.41 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 108.93 -0.767 . . . . 8.17 108.93 173.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . 176.62 -20.28 0.0 OUTLIER 'General case' 0 CA--C 1.493 -1.213 0 CA-C-N 115.02 -0.991 . . . . 5.93 110.978 178.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 72.1 mtm -70.19 89.35 0.64 Allowed 'General case' 0 CA--C 1.5 -0.963 0 CA-C-O 121.654 0.74 . . . . 7.62 109.122 178.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.584 ' HB2' ' O ' ' A' ' 55' ' ' PHE . 75.3 m -143.89 -73.04 0.27 Allowed 'General case' 0 N--CA 1.413 -2.321 0 CA-C-N 114.561 -1.2 . . . . 3.91 113.872 -174.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.594 ' O ' ' HA ' ' A' ' 54' ' ' THR . 44.3 mt -111.79 136.67 47.2 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.492 0 O-C-N 121.868 -0.52 . . . . 3.76 109.816 -177.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.641 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 19.3 tt0 -97.59 123.98 41.69 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 109.504 -0.554 . . . . 6.79 109.504 -176.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.698 ' SG ' HG22 ' A' ' 50' ' ' VAL . 34.2 t -60.46 141.78 55.98 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 125.725 1.61 . . . . 5.43 114.052 -173.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.431 ' HD2' ' O ' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -72.12 -31.96 66.51 Favored 'General case' 0 N--CA 1.468 0.428 0 C-N-CA 125.338 1.455 . . . . 5.91 109.467 -177.77 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.698 HG22 ' SG ' ' A' ' 48' ' ' CYS . 5.9 m -61.28 -26.58 39.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.044 0 CA-C-N 115.868 -0.606 . . . . 7.94 111.6 -174.488 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.7 t -161.86 -76.72 0.05 OUTLIER 'General case' 0 N--CA 1.426 -1.646 0 CA-C-N 115.967 -0.56 . . . . 9.28 109.97 179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.533 ' HG2' ' NE2' ' A' ' 47' ' ' GLN . 34.3 ttp 178.51 35.75 0.0 OUTLIER 'General case' 0 C--O 1.212 -0.892 0 CA-C-O 121.925 0.869 . . . . 9.44 108.84 -175.49 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.641 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 14.4 mm-40 -93.92 -164.7 1.21 Allowed 'General case' 0 C--O 1.191 -1.983 0 N-CA-C 108.0 -1.111 . . . . 9.11 108.0 -172.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.594 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 15.3 t -137.14 162.41 33.49 Favored 'General case' 0 C--N 1.313 -0.999 0 C-N-CA 116.828 -1.949 . . . . 5.93 113.184 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.584 ' O ' ' HB2' ' A' ' 45' ' ' SER . 96.6 m-85 -144.18 177.9 8.27 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 126.626 1.97 . . . . 5.27 106.978 177.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 7.5 tp -86.95 134.73 26.81 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 CA-C-O 120.977 0.418 . . . . 5.23 111.994 -176.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.558 ' CB ' ' HB3' ' A' ' 45' ' ' SER . 10.3 t -110.4 85.0 2.02 Favored 'General case' 0 N--CA 1.413 -2.296 0 N-CA-C 107.353 -1.351 . . . . 4.21 107.353 175.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 28.9 p -55.27 -35.13 64.69 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.17 -0.923 . . . . 6.01 111.681 174.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.65 HG23 ' H ' ' A' ' 61' ' ' GLU . 14.2 t -109.09 -155.44 0.56 Allowed 'General case' 0 CA--C 1.556 1.176 0 N-CA-C 108.723 -0.843 . . . . 6.19 108.723 -178.105 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.0 t -100.07 21.74 12.36 Favored 'General case' 0 CA--C 1.554 1.097 0 N-CA-C 109.68 -0.489 . . . . 6.47 109.68 177.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.65 ' H ' HG23 ' A' ' 59' ' ' THR . 29.7 tt0 64.78 -50.88 0.32 Allowed 'General case' 0 N--CA 1.503 2.191 0 C-N-CA 126.361 1.864 . . . . 4.86 111.942 -175.163 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.518 ' HA ' ' HB3' ' A' ' 65' ' ' ARG . 57.7 t -51.01 -29.49 7.9 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 C-N-CA 125.361 1.464 . . . . 7.23 112.956 -176.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.53 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 4.7 tmtm? -72.5 -38.07 68.23 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-O 122.038 0.923 . . . . 9.36 108.898 -179.311 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 85.6 m -75.78 -29.28 58.72 Favored 'General case' 0 C--N 1.284 -2.259 0 N-CA-C 109.038 -0.727 . . . . 5.9 109.038 176.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.518 ' HB3' ' HA ' ' A' ' 62' ' ' VAL . 21.8 tpt180 -56.86 -55.34 35.65 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.421 1.088 . . . . 7.69 111.34 177.631 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -59.1 -37.61 77.55 Favored 'General case' 0 C--N 1.329 -0.289 0 O-C-N 123.981 0.801 . . . . 9.78 110.73 179.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 52.8 t60 -76.7 -26.77 55.08 Favored 'General case' 0 C--O 1.21 -1.023 0 C-N-CA 120.368 -0.533 . . . . 8.97 111.501 -178.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . 0.457 ' O ' ' HB2' ' A' ' 72' ' ' HIS . . . -82.13 -38.03 25.38 Favored 'General case' 0 C--N 1.304 -1.381 0 N-CA-C 111.771 0.286 . . . . 6.53 111.771 -177.08 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -73.49 -23.49 60.06 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.3 0.571 . . . . 8.5 110.297 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -89.63 -7.0 55.69 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 115.596 -0.729 . . . . 9.41 111.437 178.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 31.1 mmmt -136.0 -85.87 0.36 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 111.962 0.356 . . . . 10.32 111.962 -177.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.457 ' HB2' ' O ' ' A' ' 68' ' ' ALA . 44.3 t-80 51.25 51.8 10.95 Favored Pre-proline 0 CA--C 1.561 1.37 0 C-N-CA 123.743 0.817 . . . . 7.47 110.272 -178.197 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.45 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 31.4 Cg_exo -61.11 -46.67 14.7 Favored 'Trans proline' 0 C--N 1.382 2.301 0 C-N-CA 121.481 1.454 . . . . 6.81 110.79 -176.104 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 15.5 pttp -167.49 106.23 0.55 Allowed 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 115.196 -0.911 . . . . 7.32 109.075 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.488 ' HA ' ' CG ' ' A' ' 85' ' ' LYS . . . -57.7 -54.7 43.94 Favored 'General case' 0 CA--C 1.564 1.518 0 N-CA-C 114.494 1.294 . . . . 4.52 114.494 177.645 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 13.5 m-20 56.43 -94.73 0.05 OUTLIER 'General case' 0 N--CA 1.518 2.958 0 C-N-CA 124.455 1.102 . . . . 6.82 113.136 -178.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.6 m -85.66 -17.03 9.72 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.746 0 CA-C-N 115.353 -0.84 . . . . 8.15 110.894 -176.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.459 ' CG2' ' HG2' ' A' ' 85' ' ' LYS . 26.3 m -103.18 13.51 6.94 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.639 0 N-CA-C 109.079 -0.711 . . . . 5.65 109.079 175.154 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.9 -12.91 28.31 Favored 'General case' 0 N--CA 1.489 1.483 0 CA-C-O 121.429 0.633 . . . . 4.24 111.687 176.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 71.6 m -74.98 -11.59 60.14 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-N 115.803 -0.635 . . . . 5.6 110.262 176.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.455 ' CE2' ' HB2' ' A' ' 83' ' ' HIS . 25.8 t80 -167.78 83.37 0.8 Allowed Pre-proline 0 N--CA 1.435 -1.198 0 N-CA-C 108.226 -1.027 . . . . 5.13 108.226 172.108 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo -63.07 11.26 0.09 OUTLIER 'Trans proline' 0 N--CA 1.498 1.741 0 C-N-CA 124.384 3.39 . . . . 3.27 116.053 -173.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.455 ' HB2' ' CE2' ' A' ' 81' ' ' PHE . 50.3 m170 -87.19 -1.62 58.03 Favored 'General case' 0 C--O 1.193 -1.908 0 N-CA-C 109.026 -0.731 . . . . 4.25 109.026 174.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 45.2 mt -101.54 0.17 36.05 Favored 'General case' 0 C--O 1.241 0.647 0 N-CA-C 113.556 0.947 . . . . 5.47 113.556 -172.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.488 ' CG ' ' HA ' ' A' ' 75' ' ' ALA 0.314 21.9 mmmt -67.86 156.85 36.2 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 117.308 2.336 . . . . 8.04 117.308 -179.951 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.479 ' H ' ' HE3' ' A' ' 85' ' ' LYS . 14.0 mmmm . . . . . 0 C--N 1.297 -1.714 0 CA-C-N 111.753 -2.476 . . . . 11.1 108.068 -179.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.18 0 N-CA-C 111.409 -0.676 . . . . 19.14 111.409 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 37.0 m-70 -83.34 141.71 31.58 Favored 'General case' 0 C--O 1.247 0.932 0 CA-C-O 121.168 0.509 . . . . 19.74 110.912 -178.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 77.0 m-70 -93.12 157.98 16.0 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 115.723 -0.672 . . . . 17.67 109.498 -178.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 26.5 m80 68.05 83.63 0.16 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.183 0.993 . . . . 14.74 110.262 -179.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 13.6 p-80 -144.72 121.75 11.4 Favored 'General case' 0 C--O 1.207 -1.168 0 C-N-CA 119.724 -0.791 . . . . 14.24 111.588 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 35.7 m80 35.53 92.27 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.202 0 N-CA-C 115.181 1.549 . . . . 13.67 115.181 173.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 32.2 m-70 -105.7 152.64 22.9 Favored 'General case' 0 C--N 1.314 -0.948 0 O-C-N 121.643 -0.66 . . . . 10.3 112.599 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.49 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 2.7 pp -124.08 2.24 8.61 Favored 'General case' 0 C--N 1.316 -0.869 0 C-N-CA 124.915 1.286 . . . . 10.1 108.622 174.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.3 tm-20 -112.76 129.52 56.39 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 105.128 -2.175 . . . . 11.87 105.128 -179.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 106.55 138.3 8.98 Favored Glycine 0 N--CA 1.431 -1.657 0 C-N-CA 120.918 -0.658 . . . . 9.6 111.539 -177.213 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -154.88 170.44 33.13 Favored Glycine 0 N--CA 1.435 -1.371 0 N-CA-C 109.919 -1.272 . . . . 8.45 109.919 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 110.02 -7.83 31.23 Favored Glycine 0 CA--C 1.502 -0.774 0 C-N-CA 120.716 -0.754 . . . . 9.24 111.801 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 71.05 175.09 0.29 Allowed 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.252 1.021 . . . . 9.68 112.026 178.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -147.85 26.89 0.99 Allowed 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 109.229 -0.656 . . . . 11.12 109.229 179.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 11.8 mm100 71.0 -64.33 0.38 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.083 1.353 . . . . 15.18 111.36 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 8.2 mtpm? -89.18 21.73 3.11 Favored 'General case' 0 C--N 1.312 -1.045 0 CA-C-O 121.734 0.778 . . . . 15.42 110.086 179.057 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.508 ' HA ' ' HB3' ' A' ' 20' ' ' ALA . 4.7 p -76.02 -3.59 36.57 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.389 1.076 . . . . 11.21 113.59 -177.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -45.13 -48.09 12.2 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.466 1.106 . . . . 13.14 113.161 -176.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 88.0 mtp -121.61 3.86 10.13 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.304 0.574 . . . . 14.08 110.563 178.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.508 ' HB3' ' HA ' ' A' ' 17' ' ' SER . . . -86.82 -23.95 25.17 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.662 -0.699 . . . . 9.77 110.1 -179.632 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.572 ' HE ' ' HA ' ' A' ' 21' ' ' ARG . 0.2 OUTLIER -101.76 -60.28 1.56 Allowed 'General case' 0 C--O 1.245 0.823 0 CA-C-N 116.224 -0.444 . . . . 10.29 110.348 178.747 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . 67.59 -54.69 0.48 Allowed 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 124.893 1.277 . . . . 9.15 113.7 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.49 ' HD2' ' HB3' ' A' ' 8' ' ' LEU . 23.9 ttmm -98.17 -72.99 0.63 Allowed 'General case' 0 N--CA 1.412 -2.361 0 C-N-CA 122.878 0.471 . . . . 11.12 110.179 -179.17 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.429 ' HB3' ' HB3' ' A' ' 21' ' ' ARG . 3.3 p-10 47.8 -174.32 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 126.782 2.033 . . . . 6.46 114.826 178.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 62.9 tp -90.39 127.11 36.1 Favored 'General case' 0 N--CA 1.439 -1.004 0 CA-C-N 115.233 -0.894 . . . . 6.81 109.365 177.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -89.94 154.85 19.53 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.325 -0.852 . . . . 7.7 110.778 -178.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 6.9 mtpm? -117.65 -83.67 0.64 Allowed 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.241 0.543 . . . . 8.86 109.927 177.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -104.54 171.16 7.48 Favored 'General case' 0 N--CA 1.433 -1.282 0 N-CA-C 109.071 -0.715 . . . . 6.48 109.071 -179.868 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.01 144.53 16.28 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.839 -0.619 . . . . 10.01 109.392 178.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -151.07 165.31 34.22 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 109.391 -0.596 . . . . 7.43 109.391 179.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -145.04 139.83 27.69 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 108.47 -0.937 . . . . 8.16 108.47 177.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 178.38 -159.0 24.07 Favored Glycine 0 N--CA 1.43 -1.761 0 N-CA-C 110.39 -1.084 . . . . 7.69 110.39 -178.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -135.59 104.83 5.95 Favored 'General case' 0 C--N 1.318 -0.785 0 N-CA-C 109.351 -0.611 . . . . 8.86 109.351 -179.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -149.59 114.63 0.67 Allowed Glycine 0 N--CA 1.44 -1.038 0 C-N-CA 121.099 -0.572 . . . . 8.28 111.803 -178.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 43.0 m -152.84 172.7 16.34 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 107.594 -1.261 . . . . 9.53 107.594 179.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -154.88 134.42 12.68 Favored 'General case' 0 CA--C 1.502 -0.901 0 N-CA-C 109.945 -0.391 . . . . 11.91 109.945 -179.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 54.8 tp 69.63 -59.25 0.5 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.837 1.255 . . . . 10.08 111.004 -178.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -87.35 128.6 35.19 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 123.784 0.833 . . . . 7.86 110.147 -179.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -159.87 110.75 1.94 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.027 -0.731 . . . . 5.92 109.027 178.813 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 13.0 m120 -108.92 21.04 17.75 Favored 'General case' 0 C--N 1.312 -1.038 0 CA-C-O 120.907 0.384 . . . . 6.88 111.968 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -78.81 13.51 1.67 Allowed 'General case' 0 N--CA 1.482 1.171 0 O-C-N 121.938 -0.476 . . . . 7.95 112.264 -178.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -69.43 -19.75 63.79 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.19 0.519 . . . . 8.17 110.985 -179.335 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -91.82 12.58 20.98 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 116.145 -0.48 . . . . 5.93 111.64 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 47.2 tpp 75.33 -3.85 2.5 Favored 'General case' 0 N--CA 1.503 2.213 0 C-N-CA 124.486 1.114 . . . . 7.62 111.757 178.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . 0.264 32.6 p 48.02 -98.74 0.05 OUTLIER 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 116.177 1.917 . . . . 3.91 116.177 179.058 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.54 ' O ' ' HA ' ' A' ' 54' ' ' THR . 70.2 mt -127.32 127.07 68.77 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.251 0 N-CA-C 109.414 -0.587 . . . . 3.76 109.414 -177.524 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.611 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 26.1 tt0 -99.52 133.38 43.93 Favored 'General case' 0 N--CA 1.473 0.698 0 N-CA-C 109.133 -0.691 . . . . 6.79 109.133 -178.025 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.495 ' SG ' HG22 ' A' ' 50' ' ' VAL . 49.5 t -72.53 131.75 42.91 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-N 115.69 -0.687 . . . . 5.43 112.584 -177.465 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 5.9 ttpt -52.9 -29.39 28.11 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 127.097 2.159 . . . . 5.91 112.465 -179.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.495 HG22 ' SG ' ' A' ' 48' ' ' CYS . 14.6 m -63.58 -27.78 43.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.984 -0.553 . . . . 7.94 112.223 -172.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 48.2 t -170.72 -77.5 0.02 OUTLIER 'General case' 0 N--CA 1.434 -1.267 0 CA-C-N 116.208 -0.451 . . . . 9.28 110.047 -178.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.409 ' O ' ' HG2' ' A' ' 52' ' ' MET . 26.9 ttt -171.51 39.85 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.664 0 CA-C-O 121.965 0.888 . . . . 9.44 109.817 -175.172 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.611 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 18.4 mm-40 -92.52 -173.41 3.36 Favored 'General case' 0 C--O 1.203 -1.394 0 N-CA-C 108.38 -0.971 . . . . 9.11 108.38 -177.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.54 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 9.6 t -139.21 161.81 36.51 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 118.111 -1.436 . . . . 5.93 112.461 -177.589 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -141.1 148.62 40.42 Favored 'General case' 0 N--CA 1.433 -1.322 0 C-N-CA 126.244 1.818 . . . . 5.27 106.527 178.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 8.1 tp -70.43 136.37 26.16 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.694 0 CA-C-O 121.061 0.458 . . . . 5.23 111.975 -177.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 16.6 p -81.68 76.66 8.58 Favored 'General case' 0 N--CA 1.423 -1.78 0 CA-C-O 121.811 0.815 . . . . 4.21 110.534 175.096 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.5 m -63.46 -8.59 9.66 Favored 'General case' 0 CA--C 1.568 1.659 0 CA-C-N 114.817 -1.083 . . . . 6.01 110.752 175.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.424 HG22 ' H ' ' A' ' 60' ' ' SER . 32.9 m -146.21 172.99 12.63 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 105.555 -2.017 . . . . 6.19 105.555 179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.424 ' H ' HG22 ' A' ' 59' ' ' THR . 12.5 m -74.54 15.85 0.32 Allowed 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 118.987 0.812 . . . . 6.47 112.233 -174.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.428 ' CD ' HH21 ' A' ' 65' ' ' ARG . 35.1 tt0 63.1 -61.67 0.13 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 125.195 1.398 . . . . 4.86 112.066 -177.246 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 4.0 p -61.06 -28.28 43.37 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.966 0 C-N-CA 123.679 0.792 . . . . 7.23 110.735 -176.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.409 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 5.7 tmtt? -66.2 -41.78 89.69 Favored 'General case' 0 C--O 1.249 1.078 0 N-CA-C 107.142 -1.429 . . . . 9.36 107.142 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 55.6 m -66.16 -33.52 75.96 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 114.663 -1.153 . . . . 5.9 108.073 176.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.649 ' O ' ' HG2' ' A' ' 69' ' ' GLU . 94.0 mtt180 -62.01 -37.49 85.07 Favored 'General case' 0 C--O 1.199 -1.559 0 CA-C-N 115.405 -0.816 . . . . 7.69 111.769 178.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -56.37 -50.26 72.07 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-O 121.642 0.734 . . . . 9.78 109.227 -179.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.414 ' CD2' ' HA ' ' A' ' 86' ' ' LYS . 76.4 t60 -68.37 -32.13 71.99 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 114.517 -1.219 . . . . 8.97 111.229 -179.573 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -76.8 -44.66 31.84 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 112.475 0.546 . . . . 6.53 112.475 -175.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.649 ' HG2' ' O ' ' A' ' 65' ' ' ARG . 11.5 mm-40 -63.51 -32.66 74.18 Favored 'General case' 0 C--N 1.315 -0.927 0 CA-C-O 121.362 0.601 . . . . 8.5 109.467 -178.154 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -88.74 7.97 31.17 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-N 115.312 -0.858 . . . . 9.41 111.628 179.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 39.5 mmtm -144.17 -85.56 0.14 Allowed 'General case' 0 CA--C 1.508 -0.651 0 C-N-CA 122.501 0.321 . . . . 10.32 111.852 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.408 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 29.4 p80 43.05 57.88 11.74 Favored Pre-proline 0 CA--C 1.554 1.128 0 C-N-CA 124.013 0.925 . . . . 7.47 112.338 -177.143 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.512 ' HD2' ' HD2' ' A' ' 85' ' ' LYS . 53.6 Cg_exo -54.92 -36.53 92.13 Favored 'Trans proline' 0 C--N 1.37 1.68 0 C-N-CA 122.934 2.423 . . . . 6.81 113.694 -175.403 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 63.5 pttt -171.86 -40.41 0.02 OUTLIER 'General case' 0 C--N 1.348 0.518 0 N-CA-C 113.3 0.852 . . . . 7.32 113.3 -178.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.583 ' HB1' ' HA ' ' A' ' 79' ' ' ALA . . . 76.03 108.66 0.08 Allowed 'General case' 0 C--O 1.212 -0.892 0 C-N-CA 124.387 1.075 . . . . 4.52 109.326 -172.336 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.415 ' HB2' ' H ' ' A' ' 77' ' ' VAL . 1.7 m-20 -87.47 -105.58 0.07 Allowed 'General case' 0 C--N 1.31 -1.137 0 CA-C-N 113.899 -1.501 . . . . 6.82 110.102 -169.327 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.415 ' H ' ' HB2' ' A' ' 76' ' ' ASP . 26.8 m -86.41 -7.65 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.838 0 N-CA-C 107.56 -1.274 . . . . 8.15 107.56 170.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.409 HG22 ' H ' ' A' ' 76' ' ' ASP . 28.6 m -90.75 14.4 1.45 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.505 0 CA-C-N 113.766 -1.561 . . . . 5.65 109.266 177.2 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.583 ' HA ' ' HB1' ' A' ' 75' ' ' ALA . . . -71.35 1.05 6.77 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 122.079 0.942 . . . . 4.24 110.176 176.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.413 ' HB2' ' SG ' ' A' ' 48' ' ' CYS . 19.9 p -75.76 -22.14 56.77 Favored 'General case' 0 N--CA 1.423 -1.778 0 CA-C-N 114.217 -1.356 . . . . 5.6 109.503 174.188 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.519 ' HD2' ' HG ' ' A' ' 84' ' ' LEU . 27.2 t80 -157.57 91.32 2.31 Favored Pre-proline 0 C--N 1.309 -1.163 0 N-CA-C 106.413 -1.699 . . . . 5.13 106.413 170.59 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_exo -62.04 5.13 0.24 Allowed 'Trans proline' 0 N--CA 1.491 1.326 0 C-N-CA 123.762 2.975 . . . . 3.27 115.41 -172.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.433 ' HB2' ' CE2' ' A' ' 81' ' ' PHE . 76.7 m-70 -100.85 9.99 41.67 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 108.789 -0.819 . . . . 4.25 108.789 177.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.519 ' HG ' ' HD2' ' A' ' 81' ' ' PHE . 60.8 mt -111.31 1.43 17.1 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-N 115.691 -0.686 . . . . 5.47 111.254 178.448 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.755 ' HD3' ' H ' ' A' ' 86' ' ' LYS . 5.7 tmtm? -74.58 157.55 35.24 Favored 'General case' 0 N--CA 1.446 -0.666 0 N-CA-C 105.509 -2.034 . . . . 8.04 105.509 177.375 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.755 ' H ' ' HD3' ' A' ' 85' ' ' LYS . 23.5 pttm . . . . . 0 C--N 1.248 -3.833 0 CA-C-O 117.523 -1.227 . . . . 11.1 110.88 -174.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.699 0 N-CA-C 111.349 -0.7 . . . . 19.14 111.349 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 42.0 m80 73.14 127.52 0.04 OUTLIER 'General case' 0 C--N 1.349 0.583 0 C-N-CA 124.263 1.025 . . . . 19.74 111.971 -178.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 94.2 m-70 74.98 -168.01 0.09 Allowed 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.97 0.908 . . . . 17.67 110.184 -177.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 38.5 m170 -93.42 166.89 12.06 Favored 'General case' 0 C--N 1.322 -0.606 0 C-N-CA 120.579 -0.448 . . . . 14.74 111.253 -176.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -73.41 -28.67 62.12 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 112.596 0.591 . . . . 14.24 112.596 -177.535 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 46.0 m80 -123.18 130.97 53.47 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 120.251 -0.579 . . . . 13.67 111.232 -177.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 60.9 t60 -134.75 119.89 18.77 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.136 -0.484 . . . . 10.3 109.937 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 6.0 tt 68.56 -64.64 0.3 Allowed 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 125.696 1.598 . . . . 10.1 112.484 178.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -75.61 21.35 0.15 Allowed 'General case' 0 N--CA 1.486 1.336 0 CA-C-O 121.281 0.563 . . . . 11.87 112.213 -176.386 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -118.46 -40.51 0.67 Allowed Glycine 0 N--CA 1.424 -2.122 0 CA-C-N 115.884 -0.598 . . . . 9.6 112.619 -178.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 78.23 -131.56 11.0 Favored Glycine 0 CA--C 1.505 -0.585 0 C-N-CA 120.418 -0.896 . . . . 8.45 111.199 -176.844 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 76.74 62.53 2.5 Favored Glycine 0 N--CA 1.448 -0.534 0 C-N-CA 120.65 -0.786 . . . . 9.24 113.822 177.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 39.2 t30 -80.0 102.63 9.37 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 108.618 -0.882 . . . . 9.68 108.618 175.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -141.38 91.55 2.39 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.074 0.464 . . . . 11.12 110.206 179.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 52.3 mt-30 64.23 169.23 0.17 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.35 1.06 . . . . 15.18 110.755 -177.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.428 ' HZ2' ' HB2' ' A' ' 16' ' ' LYS . 0.1 OUTLIER 60.65 24.06 13.85 Favored 'General case' 0 N--CA 1.486 1.337 0 CA-C-O 121.588 0.709 . . . . 15.42 109.719 -177.291 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 16.2 m -65.2 -3.42 3.87 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.55 1.14 . . . . 11.21 112.957 -175.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.61 -35.5 81.0 Favored 'General case' 0 N--CA 1.439 -1.017 0 N-CA-C 109.405 -0.591 . . . . 13.14 109.405 175.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 89.1 mtp -126.28 -19.1 4.77 Favored 'General case' 0 C--O 1.219 -0.527 0 N-CA-C 112.557 0.577 . . . . 14.08 112.557 178.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -70.9 -7.95 49.37 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 112.456 0.539 . . . . 9.77 112.456 -178.58 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 85.3 mtm180 -100.08 -17.79 17.29 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.365 0.602 . . . . 10.29 109.815 176.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -77.13 133.24 39.05 Favored 'General case' 0 N--CA 1.434 -1.229 0 CA-C-N 115.825 -0.625 . . . . 9.15 109.453 -178.151 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.579 ' H ' ' HG3' ' A' ' 27' ' ' LYS . 40.2 tttp 71.13 -38.68 0.43 Allowed 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 125.755 1.622 . . . . 11.12 112.107 -178.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 53.8 t30 -57.09 -74.79 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.718 1.207 . . . . 6.46 112.513 -176.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.4 mt -115.42 -83.06 0.62 Allowed 'General case' 0 C--O 1.244 0.777 0 C-N-CA 120.27 -0.572 . . . . 6.81 112.257 -178.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -103.78 117.43 34.34 Favored 'General case' 0 C--N 1.309 -1.174 0 CA-C-O 121.533 0.682 . . . . 7.7 111.247 179.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.579 ' HG3' ' H ' ' A' ' 23' ' ' LYS . 2.9 mppt? -83.42 97.79 9.15 Favored 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 114.949 -1.023 . . . . 8.86 111.067 -176.425 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -76.19 118.14 18.61 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.458 -0.792 . . . . 6.48 111.169 -179.078 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -137.74 133.8 34.55 Favored 'General case' 0 C--N 1.312 -1.033 0 C-N-CA 123.874 0.869 . . . . 10.01 108.709 176.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -133.0 8.89 4.1 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.048 0.452 . . . . 7.43 111.066 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -107.53 100.2 9.64 Favored 'General case' 0 N--CA 1.44 -0.943 0 CA-C-O 120.889 0.376 . . . . 8.16 110.927 -177.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -102.36 -85.32 1.86 Allowed Glycine 0 C--O 1.219 -0.844 0 N-CA-C 111.37 -0.692 . . . . 7.69 111.37 178.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -91.39 26.05 2.38 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-O 121.13 0.49 . . . . 8.86 109.982 178.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -78.79 100.24 1.7 Allowed Glycine 0 N--CA 1.443 -0.894 0 N-CA-C 111.183 -0.767 . . . . 8.28 111.183 -179.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.0 p -61.3 -45.23 95.32 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 123.07 0.548 . . . . 9.53 111.211 179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -171.2 105.18 0.23 Allowed 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 105.496 -2.039 . . . . 11.91 105.496 176.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 66.9 tp 68.52 -78.36 0.04 OUTLIER 'General case' 0 C--O 1.252 1.197 0 C-N-CA 123.856 0.862 . . . . 10.08 111.556 -178.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 53.61 83.43 0.07 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.498 0.719 . . . . 7.86 111.417 -175.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -75.52 124.61 27.48 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-N 115.924 -0.58 . . . . 5.92 111.417 -176.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 15.0 m120 64.98 -175.06 0.17 Allowed 'General case' 0 N--CA 1.483 1.191 0 CA-C-N 115.262 -0.881 . . . . 6.88 111.281 179.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 40.9 mmtm 68.41 4.66 4.35 Favored 'General case' 0 N--CA 1.502 2.154 0 C-N-CA 124.543 1.137 . . . . 7.95 110.741 175.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 17.1 ttmm -93.17 10.86 29.99 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 122.017 0.913 . . . . 8.17 109.064 -172.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -98.6 9.43 43.28 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.027 -0.988 . . . . 5.93 110.569 -177.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.403 ' HA ' HG21 ' A' ' 54' ' ' THR . 66.5 mtt 62.21 74.55 0.43 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.478 -0.783 . . . . 7.62 110.387 -176.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.434 ' HB3' ' CB ' ' A' ' 57' ' ' CYS . 31.0 m -52.33 -59.16 4.74 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 114.16 -1.382 . . . . 3.91 112.757 -179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.543 HG13 ' HB2' ' A' ' 57' ' ' CYS . 65.6 mt -127.88 128.39 69.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 109.294 -0.632 . . . . 3.76 109.294 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.6 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 1.6 tp60 -100.12 124.68 45.8 Favored 'General case' 0 C--N 1.314 -0.942 0 N-CA-C 107.116 -1.439 . . . . 6.79 107.116 178.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.656 ' SG ' HG22 ' A' ' 50' ' ' VAL . 26.9 t -59.7 122.45 14.17 Favored 'General case' 0 C--N 1.307 -1.239 0 C-N-CA 124.135 0.974 . . . . 5.43 111.394 -176.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.577 ' HD2' ' O ' ' A' ' 49' ' ' LYS . 1.5 tmmm? -52.02 -31.72 30.94 Favored 'General case' 0 C--O 1.217 -0.62 0 C-N-CA 125.363 1.465 . . . . 5.91 111.411 -178.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.656 HG22 ' SG ' ' A' ' 48' ' ' CYS . 7.4 m -63.8 -28.15 44.37 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 N-CA-C 112.176 0.435 . . . . 7.94 112.176 -174.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 54.1 t -161.17 -77.62 0.05 Allowed 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 120.969 -0.292 . . . . 9.28 110.863 -178.031 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.464 ' O ' ' HG2' ' A' ' 52' ' ' MET . 50.1 ttm -178.24 36.55 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.039 0 CA-C-O 121.523 0.678 . . . . 9.44 109.941 -176.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.6 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 22.1 mm-40 -91.99 178.73 5.8 Favored 'General case' 0 C--O 1.188 -2.145 0 O-C-N 121.13 -0.981 . . . . 9.11 109.569 -177.515 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.517 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 27.6 m -128.01 141.35 51.54 Favored 'General case' 0 N--CA 1.413 -2.276 0 C-N-CA 118.12 -1.432 . . . . 5.93 113.385 -173.371 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 96.6 m-85 -126.24 172.55 9.98 Favored 'General case' 0 C--O 1.242 0.677 0 C-N-CA 125.275 1.43 . . . . 5.27 107.823 174.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.436 HD13 ' N ' ' A' ' 57' ' ' CYS . 0.1 OUTLIER -96.63 132.29 41.37 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 N-CA-C 109.434 -0.58 . . . . 5.23 109.434 -176.585 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.543 ' HB2' HG13 ' A' ' 46' ' ' ILE . 11.4 t -103.87 85.62 2.45 Favored 'General case' 0 N--CA 1.425 -1.704 0 N-CA-C 106.811 -1.551 . . . . 4.21 106.811 176.475 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 11.2 t -56.17 1.69 0.02 OUTLIER 'General case' 0 CA--C 1.579 2.072 0 N-CA-C 115.413 1.634 . . . . 6.01 115.413 178.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 14.9 t -155.33 -164.91 1.87 Allowed 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 106.919 -1.512 . . . . 6.19 106.919 178.025 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 41.6 t -85.05 135.39 34.02 Favored 'General case' 0 C--N 1.281 -2.375 0 N-CA-C 107.686 -1.227 . . . . 6.47 107.686 175.798 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.565 ' O ' ' HG3' ' A' ' 65' ' ' ARG . 42.3 tt0 -56.49 -26.89 55.69 Favored 'General case' 0 C--O 1.196 -1.76 0 N-CA-C 110.244 -0.28 . . . . 4.86 110.244 177.039 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 86.5 t -67.09 -30.31 49.02 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.763 0 O-C-N 122.06 -0.4 . . . . 7.23 110.722 179.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.7 tmtt? -71.89 -33.16 68.12 Favored 'General case' 0 C--O 1.257 1.457 0 N-CA-C 107.155 -1.424 . . . . 9.36 107.155 178.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 61' ' ' GLU . 82.1 m -69.21 -40.93 77.71 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-N 114.249 -1.342 . . . . 5.9 109.732 173.339 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.565 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 96.0 mtt180 -60.38 -50.69 72.59 Favored 'General case' 0 CA--C 1.508 -0.642 0 C-N-CA 123.271 0.628 . . . . 7.69 112.09 -177.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -62.49 -33.98 75.96 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.208 0.527 . . . . 9.78 110.687 -179.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 41.4 t60 -75.34 -31.81 60.69 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.093 -0.503 . . . . 8.97 110.936 178.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -73.66 -44.83 55.75 Favored 'General case' 0 CA--C 1.483 -1.615 0 N-CA-C 109.784 -0.45 . . . . 6.53 109.784 179.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -71.74 -7.64 49.37 Favored 'General case' 0 C--N 1.315 -0.902 0 O-C-N 123.541 0.525 . . . . 8.5 111.155 178.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.74 -54.32 4.99 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 115.731 -0.668 . . . . 9.41 109.862 172.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.643 ' HG3' ' OXT' ' A' ' 86' ' ' LYS . 12.3 mmmm -88.05 -77.54 0.35 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.693 -0.685 . . . . 10.32 111.221 -177.36 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.25 16.8 p80 40.85 63.62 5.58 Favored Pre-proline 0 N--CA 1.468 0.463 0 N-CA-C 115.087 1.514 . . . . 7.47 115.087 -177.183 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -83.12 -61.04 0.02 OUTLIER 'Trans proline' 0 N--CA 1.431 -2.171 0 C-N-CA 120.951 1.101 . . . . 6.81 111.466 176.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 13.7 pttm -161.32 120.4 2.5 Favored 'General case' 0 N--CA 1.411 -2.421 0 N-CA-C 108.037 -1.097 . . . . 7.32 108.037 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.501 ' O ' ' HB2' ' A' ' 79' ' ' ALA . . . -73.6 100.78 3.42 Favored 'General case' 0 C--N 1.286 -2.172 0 N-CA-C 108.752 -0.833 . . . . 4.52 108.752 175.058 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 -95.19 -91.82 0.21 Allowed 'General case' 0 N--CA 1.494 1.757 0 CA-C-O 121.448 0.642 . . . . 6.82 111.272 -177.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.1 m -79.54 -13.81 13.31 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.073 0 N-CA-C 108.151 -1.055 . . . . 8.15 108.151 176.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.637 HG21 ' HA ' ' A' ' 85' ' ' LYS . 13.9 m -92.95 9.32 4.4 Favored 'Isoleucine or valine' 0 C--O 1.193 -1.874 0 CA-C-N 114.635 -1.166 . . . . 5.65 108.603 176.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.501 ' HB2' ' O ' ' A' ' 75' ' ' ALA . . . -69.33 -11.15 60.57 Favored 'General case' 0 C--O 1.253 1.249 0 CA-C-O 121.104 0.478 . . . . 4.24 111.638 178.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 66.4 m -79.96 -23.43 41.66 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 115.627 -0.715 . . . . 5.6 109.122 174.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 3.7 p90 -140.74 67.39 28.95 Favored Pre-proline 0 CA--C 1.556 1.173 0 C-N-CA 124.547 1.139 . . . . 5.13 111.334 178.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . 0.432 ' O ' ' HG3' ' A' ' 85' ' ' LYS . 19.7 Cg_exo -69.03 7.45 0.79 Allowed 'Trans proline' 0 C--N 1.366 1.478 0 C-N-CA 123.645 2.897 . . . . 3.27 114.013 -174.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 49.5 m170 -90.84 -7.27 52.77 Favored 'General case' 0 C--O 1.202 -1.413 0 N-CA-C 109.171 -0.677 . . . . 4.25 109.171 177.463 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.447 ' HB3' ' HB3' ' A' ' 64' ' ' CYS . 0.2 OUTLIER -133.51 45.5 2.67 Favored 'General case' 0 N--CA 1.42 -1.929 0 CA-C-N 114.921 -1.036 . . . . 5.47 110.348 178.116 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.637 ' HA ' HG21 ' A' ' 78' ' ' VAL . 98.5 mttt -44.28 -26.03 0.29 Allowed 'General case' 0 CA--C 1.579 2.09 0 N-CA-C 114.822 1.415 . . . . 8.04 114.822 177.009 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.643 ' OXT' ' HG3' ' A' ' 71' ' ' LYS . 23.4 tptm . . . . . 0 N--CA 1.497 1.879 0 N-CA-C 114.053 1.131 . . . . 11.1 114.053 170.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.46 0.264 0 N-CA-C 111.838 -0.505 . . . . 19.14 111.838 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 49.9 t-80 -65.66 -25.75 67.49 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 124.22 1.008 . . . . 19.74 112.664 -176.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 38.8 m-70 80.7 146.62 0.09 Allowed 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 125.022 1.329 . . . . 17.67 108.872 -171.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 5.4 p-80 -159.29 143.99 15.5 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 109.684 -0.487 . . . . 14.74 109.684 178.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.401 ' O ' ' HB3' ' A' ' 6' ' ' HIS . 32.4 m-70 -104.1 -18.92 14.35 Favored 'General case' 0 C--N 1.308 -1.218 0 O-C-N 122.993 0.183 . . . . 14.24 111.141 179.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.401 ' HB3' ' O ' ' A' ' 5' ' ' HIS . 73.4 t60 75.78 112.04 0.07 Allowed 'General case' 0 C--O 1.211 -0.923 0 O-C-N 124.2 0.937 . . . . 13.67 110.206 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.9 t-80 -64.77 -44.57 89.61 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 115.847 -0.615 . . . . 10.3 112.0 -173.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 59.4 tp 69.82 -78.83 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.115 0.966 . . . . 10.1 112.56 176.307 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -91.26 133.53 35.32 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.703 -0.851 . . . . 11.87 108.703 -179.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.1 74.98 1.08 Allowed Glycine 0 C--N 1.29 -1.999 0 N-CA-C 109.106 -1.598 . . . . 9.6 109.106 -174.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -100.33 58.06 0.76 Allowed Glycine 0 C--N 1.304 -1.232 0 C-N-CA 121.121 -0.561 . . . . 8.45 112.479 -177.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -86.61 -1.11 85.8 Favored Glycine 0 C--O 1.215 -1.037 0 C-N-CA 120.945 -0.645 . . . . 9.24 112.692 179.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 2.4 p30 59.2 -179.2 0.08 Allowed 'General case' 0 N--CA 1.505 2.319 0 C-N-CA 126.619 1.968 . . . . 9.68 111.378 -178.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -151.12 57.74 0.9 Allowed 'General case' 0 C--O 1.24 0.588 0 O-C-N 121.957 -0.465 . . . . 11.12 111.68 -178.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 64.12 -87.2 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 113.979 1.103 . . . . 15.18 113.979 175.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 62.4 pttt -84.91 19.49 2.09 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.331 0.586 . . . . 15.42 110.766 -177.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 69.8 p -81.54 32.05 0.35 Allowed 'General case' 0 N--CA 1.44 -0.943 0 C-N-CA 123.389 0.676 . . . . 11.21 109.806 177.397 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.461 ' O ' ' HG2' ' A' ' 21' ' ' ARG . . . -53.71 -42.48 68.1 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.475 0.71 . . . . 13.14 111.854 179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 66.2 mtt -94.79 -13.04 25.99 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.836 0.351 . . . . 14.08 111.23 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -88.81 -10.86 46.58 Favored 'General case' 0 C--N 1.314 -0.978 0 CA-C-O 121.094 0.473 . . . . 9.77 110.806 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.461 ' HG2' ' O ' ' A' ' 18' ' ' ALA . 10.5 ptp180 -88.32 -7.26 57.0 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 109.663 -0.495 . . . . 10.29 109.663 178.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.6 -39.68 77.4 Favored 'General case' 0 N--CA 1.466 0.34 0 CA-C-N 115.086 -0.961 . . . . 9.15 111.747 -178.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.9 mtmp? -139.43 98.64 3.54 Favored 'General case' 0 CA--C 1.484 -1.576 0 N-CA-C 112.806 0.669 . . . . 11.12 112.806 178.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -141.04 -70.76 0.37 Allowed 'General case' 0 C--N 1.3 -1.554 0 CA-C-N 115.858 -0.61 . . . . 6.46 109.96 175.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 58.5 tp -96.76 -83.27 0.39 Allowed 'General case' 0 CA--C 1.551 0.99 0 CA-C-O 120.881 0.372 . . . . 6.81 110.829 -179.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -141.7 163.57 32.55 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 108.006 -1.109 . . . . 7.7 108.006 178.377 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 60.7 pttt -118.79 -42.4 2.73 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 123.334 0.396 . . . . 8.86 111.938 -179.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -130.76 106.4 8.43 Favored 'General case' 0 CA--C 1.516 -0.357 0 O-C-N 121.93 -0.481 . . . . 6.48 111.368 -179.028 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -125.29 -11.43 6.93 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-O 121.315 0.578 . . . . 10.01 109.802 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -155.82 160.6 40.37 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 108.83 -0.804 . . . . 7.43 108.83 -177.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -92.99 100.59 13.0 Favored 'General case' 0 C--N 1.319 -0.758 0 O-C-N 123.368 0.418 . . . . 8.16 110.884 -178.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -71.41 -42.31 56.65 Favored Glycine 0 C--O 1.219 -0.788 0 CA-C-N 115.967 -0.561 . . . . 7.69 112.09 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 96.0 mttt 63.72 15.56 9.08 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 124.149 0.98 . . . . 8.86 113.226 177.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 152.25 84.0 0.04 OUTLIER Glycine 0 C--O 1.244 0.758 0 C-N-CA 120.54 -0.838 . . . . 8.28 111.768 178.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 22.4 t -81.86 92.52 6.71 Favored 'General case' 0 N--CA 1.435 -1.207 0 CA-C-O 122.225 1.012 . . . . 9.53 111.042 -176.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -138.84 -48.27 0.5 Allowed 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 106.573 -1.64 . . . . 11.91 106.573 175.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.2 mp -106.78 -57.52 2.05 Favored 'General case' 0 N--CA 1.436 -1.13 0 N-CA-C 106.804 -1.554 . . . . 10.08 106.804 173.449 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 67.46 92.88 0.08 Allowed 'General case' 0 C--N 1.351 0.644 0 C-N-CA 124.962 1.305 . . . . 7.86 110.619 177.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -120.95 127.33 51.72 Favored 'General case' 0 C--O 1.241 0.658 0 CA-C-N 115.49 -0.777 . . . . 5.92 111.905 -174.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -75.49 137.75 41.11 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.245 -0.889 . . . . 6.88 112.0 -179.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -113.98 -17.76 11.9 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 108.042 -1.095 . . . . 7.95 108.042 173.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt 65.32 -59.85 0.26 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.678 1.591 . . . . 8.17 112.635 -179.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.421 ' C ' ' H ' ' A' ' 45' ' ' SER . . . -88.65 15.15 8.56 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 112.138 0.422 . . . . 5.93 112.138 -177.507 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . 0.262 23.1 ptp 60.11 -23.36 0.03 OUTLIER 'General case' 0 N--CA 1.516 2.858 0 C-N-CA 127.252 2.221 . . . . 7.62 115.682 179.431 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.421 ' H ' ' C ' ' A' ' 43' ' ' ALA . 41.2 m 70.47 -101.07 0.04 OUTLIER 'General case' 0 N--CA 1.413 -2.295 0 N-CA-C 114.91 1.448 . . . . 3.91 114.91 176.112 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.469 ' O ' ' HA ' ' A' ' 54' ' ' THR . 66.3 mt -133.52 148.45 30.77 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 N-CA-C 110.169 -0.308 . . . . 3.76 110.169 -172.749 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.592 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 46.3 tt0 -110.6 143.69 40.62 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 123.417 0.687 . . . . 6.79 109.993 177.6 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.546 ' SG ' HG22 ' A' ' 50' ' ' VAL . 49.0 t -82.55 129.92 35.02 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 122.986 0.514 . . . . 5.43 111.214 178.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.404 ' O ' ' HE2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -52.5 -35.19 52.47 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 127.791 2.436 . . . . 5.91 110.617 -178.943 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.546 HG22 ' SG ' ' A' ' 48' ' ' CYS . 9.6 m -58.32 -23.46 22.24 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 N-CA-C 112.798 0.666 . . . . 7.94 112.798 -174.376 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.8 t -172.11 -86.27 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.846 0 O-C-N 123.473 0.483 . . . . 9.28 110.532 179.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.461 ' HA ' ' CG ' ' A' ' 47' ' ' GLN . 50.0 ttp -164.68 40.51 0.08 Allowed 'General case' 0 C--O 1.239 0.544 0 CA-C-O 122.67 1.224 . . . . 9.44 110.207 -178.062 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.592 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 19.1 mm-40 -86.97 -167.77 2.0 Favored 'General case' 0 C--O 1.205 -1.25 0 N-CA-C 108.22 -1.029 . . . . 9.11 108.22 -177.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 12.9 t -144.42 154.57 43.1 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 117.536 -1.665 . . . . 5.93 112.955 -176.271 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 98.4 m-85 -130.46 162.79 28.4 Favored 'General case' 0 C--N 1.305 -1.337 0 N-CA-C 106.116 -1.809 . . . . 5.27 106.116 176.07 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.569 HD13 ' H ' ' A' ' 57' ' ' CYS . 0.3 OUTLIER -88.96 148.53 4.47 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 N-CA-C 108.083 -1.08 . . . . 5.23 108.083 -177.264 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.569 ' H ' HD13 ' A' ' 56' ' ' ILE . 20.7 p -76.69 77.36 3.34 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 121.45 0.643 . . . . 4.21 111.485 179.088 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 31.7 p -60.28 -26.89 66.84 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.675 -1.148 . . . . 6.01 111.18 174.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.523 ' HB ' ' SG ' ' A' ' 64' ' ' CYS . 16.3 m -143.38 173.04 11.97 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 107.178 -1.415 . . . . 6.19 107.178 -177.327 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . 0.455 ' H ' HG22 ' A' ' 59' ' ' THR . 5.4 m -76.47 18.52 0.31 Allowed 'General case' 0 CA--C 1.556 1.191 0 N-CA-C 112.875 0.695 . . . . 6.47 112.875 -174.25 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 64.04 -62.16 0.17 Allowed 'General case' 0 N--CA 1.503 2.221 0 C-N-CA 125.375 1.47 . . . . 4.86 111.24 -176.048 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.671 ' O ' ' HG2' ' A' ' 66' ' ' GLU . 92.9 t -57.01 -36.42 50.75 Favored 'Isoleucine or valine' 0 C--O 1.182 -2.477 0 C-N-CA 123.966 0.906 . . . . 7.23 111.575 -178.026 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.475 ' HA ' ' CG ' ' A' ' 66' ' ' GLU . 4.5 mptp? -68.28 -25.93 65.4 Favored 'General case' 0 C--O 1.244 0.815 0 CA-C-O 122.076 0.941 . . . . 9.36 112.296 177.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . 0.523 ' SG ' ' HB ' ' A' ' 59' ' ' THR . 57.3 m -77.41 -38.78 49.01 Favored 'General case' 0 C--N 1.272 -2.765 0 N-CA-C 107.029 -1.471 . . . . 5.9 107.029 175.089 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.487 ' HD3' ' HA ' ' A' ' 62' ' ' VAL . 57.5 mtp180 -63.53 -38.39 90.96 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 114.234 -1.348 . . . . 7.69 111.763 178.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.671 ' HG2' ' O ' ' A' ' 62' ' ' VAL . 5.0 mm-40 -52.6 -55.17 24.26 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 107.471 -1.307 . . . . 9.78 107.471 176.423 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.49 ' CD2' ' HA ' ' A' ' 86' ' ' LYS . 48.8 t60 -76.14 -17.06 59.74 Favored 'General case' 0 N--CA 1.437 -1.09 0 CA-C-N 114.327 -1.306 . . . . 8.97 111.396 -176.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -77.92 -40.4 39.78 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 122.038 -0.414 . . . . 6.53 109.949 179.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -68.83 -16.97 63.93 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.76 0.79 . . . . 8.5 109.748 177.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 67' ' ' HIS . . . -75.08 -18.24 60.32 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 114.568 -1.196 . . . . 9.41 112.058 175.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -141.04 -83.67 0.21 Allowed 'General case' 0 N--CA 1.48 1.04 0 N-CA-C 111.987 0.366 . . . . 10.32 111.987 -178.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . 0.535 ' N ' ' HD3' ' A' ' 73' ' ' PRO . 27.1 p80 44.48 43.43 1.2 Allowed Pre-proline 0 N--CA 1.507 2.383 0 C-N-CA 125.732 1.613 . . . . 7.47 114.682 -179.523 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.535 ' HD3' ' N ' ' A' ' 72' ' ' HIS . 7.5 Cg_exo -71.88 -52.33 0.2 Allowed 'Trans proline' 0 C--N 1.368 1.57 0 C-N-CA 121.48 1.453 . . . . 6.81 111.818 -176.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -154.84 122.09 5.61 Favored 'General case' 0 N--CA 1.404 -2.743 0 N-CA-C 107.751 -1.203 . . . . 7.32 107.751 -178.716 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.06 120.78 30.77 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 107.88 -1.156 . . . . 4.52 107.88 171.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -96.95 -90.55 0.25 Allowed 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.31 0.576 . . . . 6.82 111.678 -172.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.2 m -86.66 -12.01 11.0 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.438 0 CA-C-O 122.259 1.028 . . . . 8.15 108.595 176.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.485 HG21 ' HA ' ' A' ' 85' ' ' LYS . 27.6 m -96.6 12.2 4.55 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 CA-C-N 113.954 -1.475 . . . . 5.65 108.94 176.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.94 -3.42 3.44 Favored 'General case' 0 N--CA 1.482 1.148 0 CA-C-O 121.46 0.648 . . . . 4.24 110.951 177.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 17.8 p -71.11 -28.45 64.32 Favored 'General case' 0 N--CA 1.426 -1.643 0 CA-C-N 115.039 -0.982 . . . . 5.6 109.717 175.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 18.8 t80 -155.94 92.38 2.63 Favored Pre-proline 0 N--CA 1.44 -0.951 0 N-CA-C 107.195 -1.409 . . . . 5.13 107.195 171.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -63.49 8.4 0.15 Allowed 'Trans proline' 0 N--CA 1.5 1.904 0 C-N-CA 124.462 3.441 . . . . 3.27 114.603 -173.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -101.25 7.45 42.94 Favored 'General case' 0 C--N 1.287 -2.109 0 C-N-CA 120.469 -0.492 . . . . 4.25 110.022 176.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 37.6 mt -117.58 9.32 13.12 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 116.422 -0.353 . . . . 5.47 111.267 -178.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.485 ' HA ' HG21 ' A' ' 78' ' ' VAL . 19.8 tptm -52.89 -46.54 68.0 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 115.314 1.598 . . . . 8.04 115.314 -178.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.49 ' HA ' ' CD2' ' A' ' 67' ' ' HIS . 59.8 tttm . . . . . 0 C--N 1.353 0.728 0 O-C-N 123.381 0.426 . . . . 11.1 112.032 179.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.024 0 N-CA-C 112.351 -0.3 . . . . 19.14 112.351 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 13.6 t60 69.94 -52.27 0.63 Allowed 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 125.448 1.499 . . . . 19.74 111.118 -178.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -91.76 145.39 24.61 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.023 -1.103 . . . . 17.67 108.023 173.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 90.7 m-70 -126.11 -32.85 2.71 Favored 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 120.18 -0.608 . . . . 14.74 112.6 178.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 54.4 m80 -139.59 168.61 19.43 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 109.355 -0.609 . . . . 14.24 109.355 179.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.8 t-80 -87.56 -14.08 41.19 Favored 'General case' 0 C--N 1.321 -0.645 0 O-C-N 123.698 0.624 . . . . 13.67 109.38 177.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.8 p-80 -103.89 143.28 33.05 Favored 'General case' 0 C--O 1.21 -0.986 0 N-CA-C 109.17 -0.678 . . . . 10.3 109.17 178.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 5.0 tt 69.8 -72.61 0.1 Allowed 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.712 1.205 . . . . 10.1 111.414 176.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -58.46 -19.05 33.53 Favored 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 112.758 0.651 . . . . 11.87 112.758 -177.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -132.09 37.3 2.07 Favored Glycine 0 N--CA 1.443 -0.895 0 N-CA-C 111.191 -0.764 . . . . 9.6 111.191 177.45 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -109.45 -9.91 24.5 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 120.709 -0.757 . . . . 8.45 113.924 -177.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.3 -38.21 1.33 Allowed Glycine 0 CA--C 1.484 -1.883 0 N-CA-C 108.716 -1.753 . . . . 9.24 108.716 -178.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 65.72 -76.74 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.657 0 C-N-CA 125.02 1.328 . . . . 9.68 113.201 173.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 58.53 176.34 0.07 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.637 1.175 . . . . 11.12 112.624 -177.145 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -139.32 11.41 2.56 Favored 'General case' 0 CA--C 1.508 -0.671 0 C-N-CA 120.051 -0.66 . . . . 15.18 111.557 178.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.7 mppt? -88.73 5.56 42.77 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 119.566 -0.854 . . . . 15.42 110.583 174.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 51.5 m 67.47 -41.61 0.43 Allowed 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 125.434 1.494 . . . . 11.21 114.525 177.212 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -56.33 -62.67 1.56 Allowed 'General case' 0 C--N 1.306 -1.299 0 C-N-CA 123.855 0.862 . . . . 13.14 112.485 -175.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . 0.416 ' HA ' ' HB3' ' A' ' 22' ' ' ALA . 96.0 mmm -80.63 -9.88 59.76 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 116.307 -0.406 . . . . 14.08 111.801 -178.708 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.17 -46.97 81.68 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.491 0.663 . . . . 9.77 110.016 -178.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 14.8 ptm180 -96.5 11.18 35.97 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-N 115.665 -0.698 . . . . 10.29 111.235 -179.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.416 ' HB3' ' HA ' ' A' ' 19' ' ' MET . . . -110.27 -53.12 2.72 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 116.238 -0.437 . . . . 9.15 111.817 -178.071 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 50.0 tttp -83.48 -7.77 59.48 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.866 0.365 . . . . 11.12 110.342 -175.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.87 163.38 9.62 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.656 -0.702 . . . . 6.46 111.624 -178.409 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 82.1 mt -88.95 114.46 25.6 Favored 'General case' 0 C--N 1.307 -1.261 0 C-N-CA 120.237 -0.585 . . . . 6.81 111.324 -177.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -62.13 146.73 49.7 Favored 'General case' 0 C--N 1.291 -1.937 0 CA-C-N 113.823 -1.535 . . . . 7.7 110.461 177.025 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.32 4.44 6.32 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.778 0.658 . . . . 8.86 112.778 -176.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -152.57 153.85 34.23 Favored 'General case' 0 C--N 1.302 -1.47 0 N-CA-C 108.304 -0.999 . . . . 6.48 108.304 -179.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -112.7 -23.0 10.44 Favored 'General case' 0 C--N 1.316 -0.872 0 C-N-CA 120.853 -0.339 . . . . 10.01 111.421 -179.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . 57.02 -152.34 0.4 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.647 0.779 . . . . 7.43 111.847 177.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -123.4 173.16 8.17 Favored 'General case' 0 N--CA 1.438 -1.05 0 N-CA-C 108.109 -1.071 . . . . 8.16 108.109 177.883 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 148.04 -14.4 1.31 Allowed Glycine 0 C--N 1.316 -0.556 0 C-N-CA 119.165 -1.493 . . . . 7.69 112.815 -178.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -78.17 -28.31 48.21 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.525 -0.546 . . . . 8.86 109.525 177.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 167.03 170.21 31.61 Favored Glycine 0 N--CA 1.431 -1.671 0 N-CA-C 108.843 -1.703 . . . . 8.28 108.843 179.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 20.7 m -89.7 -79.49 0.33 Allowed 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 117.67 0.735 . . . . 9.53 111.026 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 92.7 mt-30 -134.74 -64.1 0.68 Allowed 'General case' 0 C--O 1.219 -0.521 0 CA-C-O 120.648 0.261 . . . . 11.91 110.83 178.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -75.67 -40.58 55.78 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.927 0.394 . . . . 10.08 110.709 179.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -49.11 -53.78 19.1 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 114.662 -1.154 . . . . 7.86 112.156 -175.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -127.4 72.25 1.37 Allowed 'General case' 0 N--CA 1.418 -2.04 0 C-N-CA 119.548 -0.861 . . . . 5.92 112.483 -178.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -114.02 128.22 56.29 Favored 'General case' 0 C--N 1.283 -2.299 0 N-CA-C 106.336 -1.727 . . . . 6.88 106.336 174.264 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 48.8 mmtm -137.07 -56.55 0.72 Allowed 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 109.695 -0.483 . . . . 7.95 109.695 178.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt 68.91 -47.3 0.57 Allowed 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 125.241 1.416 . . . . 8.17 113.109 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -80.54 -10.13 59.75 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 112.563 0.579 . . . . 5.93 112.563 -178.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 25.2 mmt 57.24 87.68 0.06 Allowed 'General case' 0 N--CA 1.472 0.633 0 O-C-N 123.916 0.76 . . . . 7.62 110.704 -173.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.549 ' HB2' ' O ' ' A' ' 55' ' ' PHE . 53.1 m -75.48 -84.35 0.05 Allowed 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 114.677 1.362 . . . . 3.91 114.677 -176.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.435 ' O ' ' HA ' ' A' ' 54' ' ' THR . 31.9 mt -139.95 159.29 26.68 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 N-CA-C 107.812 -1.181 . . . . 3.76 107.812 -174.258 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.607 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 32.4 tt0 -112.09 149.34 32.25 Favored 'General case' 0 CA--C 1.552 1.029 0 N-CA-C 109.335 -0.617 . . . . 6.79 109.335 -176.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.456 ' SG ' HG22 ' A' ' 50' ' ' VAL . 41.6 t -85.99 145.25 27.19 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 112.408 0.521 . . . . 5.43 112.408 -177.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.457 ' O ' ' HD2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -66.39 -23.15 66.28 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 125.392 1.477 . . . . 5.91 110.371 -175.235 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.456 HG22 ' SG ' ' A' ' 48' ' ' CYS . 20.4 m -62.11 -30.06 47.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 CA-C-N 115.169 -0.923 . . . . 7.94 112.431 -175.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 41.9 t -176.96 -110.57 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.494 0 N-CA-C 107.3 -1.37 . . . . 9.28 107.3 -175.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 4.8 mpp? -136.44 64.28 1.56 Allowed 'General case' 0 N--CA 1.427 -1.614 0 CA-C-O 121.044 0.45 . . . . 9.44 111.6 177.095 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.607 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 23.0 mm-40 -106.25 -165.05 1.06 Allowed 'General case' 0 C--O 1.19 -2.062 0 N-CA-C 108.672 -0.862 . . . . 9.11 108.672 -178.068 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.435 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 15.0 t -144.13 151.8 40.06 Favored 'General case' 0 N--CA 1.437 -1.12 0 C-N-CA 117.991 -1.484 . . . . 5.93 112.954 -178.317 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.549 ' O ' ' HB2' ' A' ' 45' ' ' SER . 89.1 m-85 -123.29 174.55 7.24 Favored 'General case' 0 C--N 1.313 -0.989 0 N-CA-C 107.105 -1.443 . . . . 5.27 107.105 175.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 10.2 tp -100.41 142.46 15.53 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.21 0 N-CA-C 110.057 -0.349 . . . . 5.23 110.057 -178.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 49.7 t -86.37 78.35 9.29 Favored 'General case' 0 N--CA 1.415 -2.198 0 CA-C-O 121.565 0.697 . . . . 4.21 109.244 178.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 9.4 t -73.31 -12.81 60.97 Favored 'General case' 0 C--N 1.311 -1.104 0 CA-C-N 114.993 -1.003 . . . . 6.01 111.097 175.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . . . . . . . . . 28.6 m -143.79 -89.57 0.12 Allowed 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 109.767 -0.457 . . . . 6.19 109.767 178.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 65.2 p -173.06 5.03 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 112.851 0.686 . . . . 6.47 112.851 176.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.495 ' O ' ' HG3' ' A' ' 65' ' ' ARG . 36.9 tt0 67.75 -45.58 0.49 Allowed 'General case' 0 N--CA 1.498 1.937 0 C-N-CA 123.839 0.855 . . . . 4.86 111.187 -172.113 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . 0.441 ' O ' ' HG3' ' A' ' 66' ' ' GLU . 94.8 t -56.84 -40.18 69.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.888 0 O-C-N 121.627 -0.671 . . . . 7.23 112.468 -178.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.461 ' O ' ' HD3' ' A' ' 63' ' ' LYS . 8.0 tmtt? -61.91 -37.74 85.78 Favored 'General case' 0 CA--C 1.561 1.392 0 CA-C-O 122.293 1.044 . . . . 9.36 109.008 179.294 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . 0.403 ' SG ' ' HA ' ' A' ' 61' ' ' GLU . 29.7 p -81.49 -19.41 42.33 Favored 'General case' 0 C--O 1.204 -1.293 0 CA-C-N 115.791 -0.641 . . . . 5.9 110.152 179.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.495 ' HG3' ' O ' ' A' ' 61' ' ' GLU . 97.5 mtt180 -64.68 -39.8 94.3 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 108.736 -0.838 . . . . 7.69 108.736 175.198 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 62' ' ' VAL . 24.5 mt-10 -60.13 -47.8 84.4 Favored 'General case' 0 C--O 1.245 0.867 0 CA-C-N 115.232 -0.894 . . . . 9.78 108.822 179.599 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.484 ' O ' ' HB3' ' A' ' 70' ' ' ALA . 41.8 t60 -74.44 -22.31 59.19 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-N 115.072 -0.967 . . . . 8.97 111.29 -178.088 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -74.67 -42.26 58.79 Favored 'General case' 0 CA--C 1.492 -1.265 0 C-N-CA 119.957 -0.697 . . . . 6.53 109.231 178.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -65.76 -13.89 60.26 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.824 0.821 . . . . 8.5 110.67 176.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' A' ' 67' ' ' HIS . . . -76.23 -19.17 58.6 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 115.099 -0.955 . . . . 9.41 110.911 174.681 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -146.0 -82.89 0.14 Allowed 'General case' 0 C--O 1.211 -0.939 0 CA-C-O 121.042 0.449 . . . . 10.32 111.861 -177.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.372 4.6 p80 36.45 67.24 1.72 Allowed Pre-proline 0 N--CA 1.488 1.431 0 C-N-CA 126.58 1.952 . . . . 7.47 116.052 -173.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.491 ' HD2' ' HG2' ' A' ' 85' ' ' LYS . 13.9 Cg_exo -70.02 -61.63 0.06 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 121.39 1.393 . . . . 6.81 111.214 174.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -158.56 120.05 3.47 Favored 'General case' 0 N--CA 1.418 -2.045 0 CA-C-N 115.558 -0.747 . . . . 7.32 108.986 178.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.481 ' O ' ' HB2' ' A' ' 79' ' ' ALA . . . -77.18 115.79 17.27 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 107.769 -1.197 . . . . 4.52 107.769 173.5 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -95.53 -87.1 0.29 Allowed 'General case' 0 C--O 1.201 -1.475 0 CA-C-O 121.012 0.434 . . . . 6.82 111.389 -173.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 26.8 m -84.6 -14.85 11.19 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.663 0 CA-C-O 122.128 0.966 . . . . 8.15 108.774 176.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.409 HG21 ' HA ' ' A' ' 85' ' ' LYS . 34.1 m -94.97 11.66 4.07 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.524 0 CA-C-N 114.681 -1.145 . . . . 5.65 109.223 177.131 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.481 ' HB2' ' O ' ' A' ' 75' ' ' ALA . . . -65.39 -6.82 11.22 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-O 121.767 0.794 . . . . 4.24 111.646 177.322 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 18.9 p -76.53 -17.67 59.13 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 115.144 -0.934 . . . . 5.6 109.701 175.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.542 ' CD1' ' HG ' ' A' ' 84' ' ' LEU . 1.6 t80 -161.93 80.13 1.95 Allowed Pre-proline 0 CA--C 1.555 1.14 0 N-CA-C 106.506 -1.665 . . . . 5.13 106.506 178.018 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_exo -62.93 -3.85 5.25 Favored 'Trans proline' 0 N--CA 1.495 1.608 0 C-N-CA 124.265 3.31 . . . . 3.27 115.696 -171.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -84.77 -6.15 59.35 Favored 'General case' 0 C--N 1.294 -1.834 0 N-CA-C 109.268 -0.641 . . . . 4.25 109.268 -179.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.542 ' HG ' ' CD1' ' A' ' 81' ' ' PHE . 42.6 mt -106.41 11.87 30.37 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.217 -0.447 . . . . 5.47 112.188 -174.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.491 ' HG2' ' HD2' ' A' ' 73' ' ' PRO . 56.9 tptt -50.38 -47.67 56.19 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 111.852 0.316 . . . . 8.04 111.852 176.507 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.435 ' HA ' ' CD2' ' A' ' 67' ' ' HIS . 40.4 ttmt . . . . . 0 C--O 1.266 1.961 0 CA-C-O 117.661 -1.162 . . . . 11.1 113.164 173.326 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.464 0.527 0 N-CA-C 111.694 -0.562 . . . . 19.14 111.694 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 4.4 p80 -74.33 86.29 1.97 Allowed 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 113.035 0.754 . . . . 19.74 113.035 179.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 55.3 m-70 -142.92 18.36 1.96 Allowed 'General case' 0 N--CA 1.488 1.434 0 CA-C-N 115.264 -0.88 . . . . 17.67 110.523 175.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 83.5 m-70 -128.79 99.8 5.46 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 109.044 -0.724 . . . . 14.74 109.044 178.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 41.9 t60 -83.23 115.41 21.94 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 115.844 -0.616 . . . . 14.24 110.642 -176.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 38.1 t60 73.63 101.16 0.07 Allowed 'General case' 0 N--CA 1.487 1.422 0 O-C-N 123.799 0.687 . . . . 13.67 111.844 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 31.2 t-80 -121.92 17.22 10.95 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 108.486 -0.931 . . . . 10.3 108.486 177.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 64.1 tp -61.35 110.04 1.31 Allowed 'General case' 0 C--O 1.241 0.632 0 CA-C-N 114.877 -1.056 . . . . 10.1 109.978 176.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -162.61 -61.26 0.04 OUTLIER 'General case' 0 C--N 1.313 -1.008 0 CA-C-N 115.164 -0.925 . . . . 11.87 109.156 -175.106 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -146.5 -47.0 0.03 OUTLIER Glycine 0 N--CA 1.443 -0.848 0 CA-C-N 115.401 -0.818 . . . . 9.6 111.868 179.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 168.31 -135.99 3.88 Favored Glycine 0 N--CA 1.435 -1.375 0 N-CA-C 110.659 -0.976 . . . . 8.45 110.659 -179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 80.8 66.27 1.64 Allowed Glycine 0 N--CA 1.436 -1.303 0 C-N-CA 120.899 -0.667 . . . . 9.24 112.218 178.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -108.42 129.76 55.25 Favored 'General case' 0 C--N 1.307 -1.241 0 C-N-CA 120.805 -0.358 . . . . 9.68 110.051 176.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -159.24 150.0 19.67 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 108.681 -0.859 . . . . 11.12 108.681 177.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 51.2 mt-30 62.8 97.5 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 124.922 1.289 . . . . 15.18 113.861 176.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 99.5 mttt 67.01 1.54 2.37 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 114.258 1.207 . . . . 15.42 114.258 176.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 23.2 p -85.01 22.87 1.31 Allowed 'General case' 0 C--N 1.297 -1.693 0 N-CA-C 112.575 0.583 . . . . 11.21 112.575 -178.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.21 -39.61 63.84 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.775 0.83 . . . . 13.14 111.844 -179.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' MET . . . . . . . . . . . . . 72.4 mtm -106.58 -15.38 14.79 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 120.071 -0.652 . . . . 14.08 111.105 176.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -72.77 -21.13 61.05 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.028 0.442 . . . . 9.77 110.64 179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 33.7 ptt180 -65.42 -21.84 66.71 Favored 'General case' 0 C--O 1.201 -1.483 0 CA-C-N 115.844 -0.616 . . . . 10.29 110.876 178.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -83.33 1.06 43.05 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 120.993 0.425 . . . . 9.15 110.979 -179.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.586 ' HE2' ' HA ' ' A' ' 23' ' ' LYS . 10.5 mmpt? -108.29 -31.21 7.96 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.923 -0.769 . . . . 11.12 108.923 177.371 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -92.75 -8.64 43.18 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.42 -0.809 . . . . 6.46 111.36 -177.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 92.8 mt -130.25 -169.37 2.12 Favored 'General case' 0 C--O 1.241 0.627 0 N-CA-C 108.292 -1.003 . . . . 6.81 108.292 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -108.93 -178.53 3.61 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.158 0.504 . . . . 7.7 112.297 -178.14 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -94.5 82.25 4.0 Favored 'General case' 0 N--CA 1.44 -0.937 0 CA-C-N 116.189 -0.459 . . . . 8.86 111.056 -177.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.49 154.77 37.63 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-O 121.029 0.443 . . . . 6.48 111.719 178.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.441 ' HD2' ' N ' ' A' ' 29' ' ' LYS . 3.2 mptp? -110.58 9.14 23.08 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 121.501 0.667 . . . . 10.01 110.037 -178.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.14 131.32 46.23 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.644 -0.707 . . . . 7.43 111.345 -178.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.91 -28.49 70.09 Favored 'General case' 0 C--O 1.253 1.288 0 CA-C-N 115.466 -0.788 . . . . 8.16 112.526 -178.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 87.15 -65.26 3.71 Favored Glycine 0 N--CA 1.443 -0.858 0 C-N-CA 121.146 -0.549 . . . . 7.69 112.976 177.294 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -68.14 109.22 3.44 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.988 -0.375 . . . . 8.86 109.988 -178.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.38 -10.2 57.85 Favored Glycine 0 CA--C 1.501 -0.827 0 N-CA-C 111.114 -0.794 . . . . 8.28 111.114 178.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.2 t -86.81 110.75 20.15 Favored 'General case' 0 N--CA 1.418 -2.049 0 N-CA-C 108.083 -1.081 . . . . 9.53 108.083 -179.207 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.21 -59.53 0.06 Allowed 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 107.112 -1.44 . . . . 11.91 107.112 179.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 97.1 mt -84.76 -35.38 22.47 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.226 -0.443 . . . . 10.08 111.124 177.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 70.73 -39.45 0.45 Allowed 'General case' 0 N--CA 1.498 1.928 0 C-N-CA 125.151 1.38 . . . . 7.86 114.15 175.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.9 -24.06 61.86 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 113.542 0.942 . . . . 5.92 113.542 -177.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -79.55 93.29 5.42 Favored 'General case' 0 C--O 1.218 -0.604 0 CA-C-O 120.931 0.396 . . . . 6.88 110.953 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.535 ' HE3' ' O ' ' A' ' 57' ' ' CYS . 71.4 mmtt 66.66 86.65 0.13 Allowed 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 124.855 1.262 . . . . 7.95 111.766 -176.305 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 22.5 pttp -63.91 -9.6 16.27 Favored 'General case' 0 C--O 1.213 -0.834 0 N-CA-C 113.569 0.952 . . . . 8.17 113.569 -174.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -94.07 4.11 54.36 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 116.483 -0.326 . . . . 5.93 110.859 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 64.2 mtm 69.35 8.91 7.05 Favored 'General case' 0 N--CA 1.497 1.883 0 C-N-CA 124.06 0.944 . . . . 7.62 111.417 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . 0.353 12.9 p 55.6 -108.2 0.42 Allowed 'General case' 0 N--CA 1.409 -2.49 0 N-CA-C 118.141 2.645 . . . . 3.91 118.141 177.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.584 ' O ' ' HA ' ' A' ' 54' ' ' THR . 68.7 mt -127.04 132.19 70.12 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.99 0 CA-C-N 116.604 -0.271 . . . . 3.76 110.395 -174.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.635 ' HA ' ' O ' ' A' ' 53' ' ' GLN . 9.2 tt0 -98.1 135.12 40.22 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.222 0.534 . . . . 6.79 110.397 -178.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.587 ' SG ' HG22 ' A' ' 50' ' ' VAL . 12.9 t -70.86 133.04 46.14 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-N 115.053 -0.976 . . . . 5.43 111.913 -178.224 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 17.6 ttpt -57.21 -30.42 64.56 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.78 1.632 . . . . 5.91 111.599 -179.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.587 HG22 ' SG ' ' A' ' 48' ' ' CYS . 16.3 m -60.24 -27.89 40.46 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.982 0 N-CA-C 112.944 0.72 . . . . 7.94 112.944 -175.099 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 54.1 t -174.27 -99.84 0.0 OUTLIER 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 109.076 -0.713 . . . . 9.28 109.076 -178.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.459 ' C ' HE21 ' A' ' 53' ' ' GLN . 2.2 mpt? -145.45 60.37 1.28 Allowed 'General case' 0 N--CA 1.426 -1.67 0 C-N-CA 122.543 0.337 . . . . 9.44 110.841 179.197 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.635 ' O ' ' HA ' ' A' ' 47' ' ' GLN . 20.9 mm-40 -107.2 -172.49 2.09 Favored 'General case' 0 CA--C 1.481 -1.677 0 N-CA-C 108.064 -1.087 . . . . 9.11 108.064 -178.83 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.584 ' HA ' ' O ' ' A' ' 46' ' ' ILE . 8.9 t -143.12 153.71 43.17 Favored 'General case' 0 N--CA 1.424 -1.773 0 C-N-CA 118.239 -1.384 . . . . 5.93 112.476 -177.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 99.7 m-85 -130.32 140.43 50.64 Favored 'General case' 0 C--N 1.298 -1.64 0 N-CA-C 105.489 -2.041 . . . . 5.27 105.489 176.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.514 HD11 ' HG2' ' A' ' 41' ' ' LYS . 8.9 tp -67.07 147.47 12.58 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 CA-C-O 121.225 0.536 . . . . 5.23 111.368 -173.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' CYS . . . . . 0.535 ' O ' ' HE3' ' A' ' 41' ' ' LYS . 43.6 t -78.34 73.13 4.9 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-O 121.52 0.676 . . . . 4.21 111.583 178.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.482 HG23 HG23 ' A' ' 56' ' ' ILE . 13.4 p -79.91 -22.27 42.95 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-O 121.483 0.658 . . . . 6.01 110.0 170.921 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' THR . . . . . 0.419 HG21 ' HB3' ' A' ' 64' ' ' CYS . 27.2 m -116.61 150.79 37.49 Favored 'General case' 0 N--CA 1.427 -1.595 0 N-CA-C 108.286 -1.005 . . . . 6.19 108.286 177.106 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 30.8 t -82.55 14.98 2.75 Favored 'General case' 0 CA--C 1.564 1.518 0 C-N-CA 122.7 0.4 . . . . 6.47 111.189 -176.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.652 ' HA ' ' SG ' ' A' ' 64' ' ' CYS . 5.5 tp10 64.96 -60.69 0.23 Allowed 'General case' 0 C--O 1.181 -2.509 0 C-N-CA 123.899 0.88 . . . . 4.86 111.858 -176.265 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 90.3 t -57.85 -29.07 34.61 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.329 0 O-C-N 121.577 -0.702 . . . . 7.23 111.956 -176.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.433 ' O ' ' HD2' ' A' ' 63' ' ' LYS . 3.2 tmmm? -77.79 -35.64 51.25 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 109.372 -0.603 . . . . 9.36 109.372 178.224 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . 0.652 ' SG ' ' HA ' ' A' ' 61' ' ' GLU . 23.1 p -76.54 -30.1 56.98 Favored 'General case' 0 C--O 1.197 -1.708 0 C-N-CA 119.514 -0.874 . . . . 5.9 109.47 177.111 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 65.0 ttt180 -56.61 -58.36 8.4 Favored 'General case' 0 N--CA 1.437 -1.118 0 C-N-CA 124.872 1.269 . . . . 7.69 112.103 177.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -62.26 -33.38 74.51 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 122.315 1.055 . . . . 9.78 109.728 -179.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.594 ' CD2' ' HD2' ' A' ' 85' ' ' LYS . 21.3 t60 -77.76 -13.38 59.91 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-N 113.933 -1.485 . . . . 8.97 110.75 -179.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -98.24 -47.72 5.35 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 109.617 -0.512 . . . . 6.53 109.617 178.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -54.57 -37.88 66.01 Favored 'General case' 0 N--CA 1.477 0.901 0 O-C-N 123.757 0.661 . . . . 8.5 111.647 -179.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -87.77 2.71 50.53 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 116.076 -0.511 . . . . 9.41 112.376 -178.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -137.67 -81.9 0.34 Allowed 'General case' 0 C--N 1.343 0.287 0 CA-C-O 120.703 0.287 . . . . 10.32 111.431 -178.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . 0.272 18.6 p80 41.99 62.88 7.18 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 125.381 1.473 . . . . 7.47 114.416 -176.262 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . 0.427 ' HD2' ' HB2' ' A' ' 85' ' ' LYS . 61.9 Cg_exo -45.91 -56.52 2.79 Favored 'Trans proline' 0 C--N 1.378 2.089 0 C-N-CA 124.001 3.134 . . . . 6.81 114.031 -179.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -177.39 -23.4 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 111.773 0.286 . . . . 7.32 111.773 -179.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.583 ' HB1' ' HA ' ' A' ' 79' ' ' ALA . . . 74.69 103.08 0.07 Allowed 'General case' 0 C--N 1.358 0.977 0 C-N-CA 124.222 1.009 . . . . 4.52 110.834 -179.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -100.18 -85.66 0.4 Allowed 'General case' 0 C--N 1.316 -0.889 0 CA-C-N 114.867 -1.06 . . . . 6.82 111.298 -176.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.3 m -81.85 -15.65 12.15 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.749 0 CA-C-O 121.889 0.852 . . . . 8.15 108.836 176.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.632 HG21 ' HA ' ' A' ' 85' ' ' LYS . 31.8 m -97.34 11.11 5.57 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.827 0 CA-C-N 114.707 -1.133 . . . . 5.65 109.25 177.348 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . 0.583 ' HA ' ' HB1' ' A' ' 75' ' ' ALA . . . -63.09 -11.26 18.6 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.514 0.673 . . . . 4.24 111.663 176.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.482 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 76.9 m -82.9 -8.28 59.59 Favored 'General case' 0 N--CA 1.439 -0.976 0 CA-C-N 115.369 -0.832 . . . . 5.6 110.778 177.1 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 23.9 t80 -165.86 83.57 1.03 Allowed Pre-proline 0 C--N 1.32 -0.717 0 N-CA-C 107.734 -1.21 . . . . 5.13 107.734 171.278 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -58.08 1.73 0.22 Allowed 'Trans proline' 0 N--CA 1.498 1.755 0 C-N-CA 123.785 2.99 . . . . 3.27 116.487 -173.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 67.1 m-70 -88.73 -7.42 56.32 Favored 'General case' 0 CA--C 1.499 -0.984 0 C-N-CA 120.217 -0.593 . . . . 4.25 112.12 178.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 45.6 mt -89.23 -33.36 17.02 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.749 -0.78 . . . . 5.47 109.265 -178.667 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.632 ' HA ' HG21 ' A' ' 78' ' ' VAL 0.399 0.0 OUTLIER 41.88 166.53 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 119.137 3.014 . . . . 8.04 119.137 -176.146 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 86.4 tttt . . . . . 0 C--O 1.248 1.005 0 N-CA-C 107.93 -1.137 . . . . 11.1 107.93 176.515 . . . . . . . . 0 0 . 1 stop_ save_