data_1wr4_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 1wr4 _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 ' 5' ' ' LEU . . . . . 0.432 HD22 ' HD2' ' A' ' 21' ' ' TYR . 5.2 mp . . . . . 0 N--CA 1.453 -0.32 0 CA-C-O 120.626 0.25 . . . . 0.0 110.768 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.851 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 82.9 Cg_exo -53.43 160.88 4.5 Favored 'Trans proline' 0 N--CA 1.477 0.543 0 C-N-CA 123.833 3.022 . . . . 0.0 113.578 177.024 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 m -63.58 103.77 0.57 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.449 176.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 128.61 -22.08 5.27 Favored Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 111.253 -0.739 . . . . 0.0 111.253 -176.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.851 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 71.0 m95 -86.43 141.51 29.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.921 0.391 . . . . 0.0 110.264 178.638 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -136.52 150.16 48.51 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 176.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.49 145.5 31.73 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 177.034 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -145.26 -175.13 4.58 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.998 0.427 . . . . 0.0 109.997 176.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.5 mttt -139.21 152.99 47.8 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.873 -178.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.492 ' OD1' ' HB2' ' A' ' 18' ' ' ARG . 1.0 OUTLIER -91.49 19.93 5.76 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.289 0.566 . . . . 0.0 110.398 178.936 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 78.46 -27.96 0.16 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 114.626 -1.17 . . . . 0.0 111.599 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.54 42.06 1.14 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.824 0.821 . . . . 0.0 111.394 -176.269 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.93 -31.53 3.07 Favored Glycine 0 C--N 1.32 -0.351 0 CA-C-N 114.596 -1.184 . . . . 0.0 113.511 175.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.492 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 0.1 OUTLIER -62.94 122.76 16.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.111 0.482 . . . . 0.0 111.135 -174.591 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 25.5 m -103.83 116.85 33.05 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.41 -178.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.8 p90 -120.32 154.56 34.84 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.946 0.403 . . . . 0.0 109.929 178.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.432 ' HD2' HD22 ' A' ' 5' ' ' LEU . 79.7 m-85 -105.95 121.17 43.56 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.406 0.622 . . . . 0.0 110.34 -176.069 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 p -115.2 110.97 33.87 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 CA-C-O 121.787 0.803 . . . . 0.0 110.126 -176.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -89.88 122.48 32.97 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.319 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -89.99 -25.87 20.64 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.042 -175.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.46 -32.48 60.65 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.759 -177.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -110.81 -0.54 16.92 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.751 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 58.06 45.9 17.11 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.436 178.043 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -113.09 144.82 41.97 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.612 -176.006 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.64 100.84 7.69 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 173.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.402 ' HB ' ' HZ3' ' A' ' 9' ' ' TRP . 1.1 m -115.99 127.19 54.74 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.44 -168.111 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -95.08 59.56 2.28 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.565 0.698 . . . . 0.0 109.118 175.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -167.61 145.33 4.55 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.9 -172.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.31 117.55 53.48 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-O 120.966 0.412 . . . . 0.0 110.596 178.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_endo . . . . . 0 C--O 1.237 0.433 0 C-N-CA 123.153 2.569 . . . . 0.0 113.112 -177.99 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.563 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 18.0 mt . . . . . 0 C--O 1.235 0.292 0 N-CA-C 110.486 -0.191 . . . . 0.0 110.486 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.806 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 77.9 Cg_exo -56.63 152.78 39.34 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.809 2.34 . . . . 0.0 111.105 170.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.6 92.35 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.471 0.653 . . . . 0.0 110.308 177.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.43 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 141.25 -16.49 2.73 Favored Glycine 0 N--CA 1.443 -0.876 0 CA-C-N 115.683 -0.689 . . . . 0.0 112.359 -176.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.806 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 91.6 m95 -97.86 137.94 35.96 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 109.236 -0.654 . . . . 0.0 109.236 177.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -126.89 127.97 45.75 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -91.29 110.31 21.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.763 0.792 . . . . 0.0 110.408 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.922 ' HG3' HG11 ' A' ' 22' ' ' VAL . 1.8 mtt180 -100.73 168.2 9.83 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.431 -178.158 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.695 ' HB3' ' HA2' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -128.09 98.16 5.02 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.047 0.451 . . . . 0.0 110.046 -177.505 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.453 ' HB2' ' CE1' ' A' ' 20' ' ' TYR . 23.7 t70 -80.67 134.05 35.81 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.619 -174.325 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 62.72 -99.97 0.09 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.088 173.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.68 -6.81 59.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.968 0.413 . . . . 0.0 111.074 -176.091 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.695 ' HA2' ' HB3' ' A' ' 13' ' ' LYS . . . 118.71 25.47 2.83 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.533 -0.841 . . . . 0.0 111.902 -177.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.404 ' HB3' ' HZ3' ' A' ' 31' ' ' TRP . 11.9 mtm180 -72.21 112.64 8.47 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 176.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.611 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 2.7 m -76.19 124.66 27.81 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.137 0.494 . . . . 0.0 112.249 -174.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.453 ' CE1' ' HB2' ' A' ' 14' ' ' ASP . 43.5 p90 -132.59 158.84 41.18 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.266 173.482 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -108.58 121.31 44.72 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.265 0.555 . . . . 0.0 111.316 -174.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.922 HG11 ' HG3' ' A' ' 12' ' ' ARG . 2.5 p -116.34 109.32 27.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.026 -178.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.437 ' O ' ' HA ' ' A' ' 27' ' ' ARG . 17.7 t-20 -79.13 131.33 36.19 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 177.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 62.5 m-70 -94.24 -7.97 40.52 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -170.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -91.24 -54.87 3.75 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.35 0.595 . . . . 0.0 109.716 177.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 32.2 t-20 -89.53 -6.12 56.66 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.457 -179.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.459 ' HD2' ' HA ' ' A' ' 27' ' ' ARG . 0.5 OUTLIER 58.77 32.25 22.02 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.495 178.074 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.72 124.35 32.89 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.16 0.505 . . . . 0.0 110.818 178.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.3 98.44 7.98 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.77 178.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.414 HG22 ' CZ3' ' A' ' 9' ' ' TRP . 3.6 t -117.55 143.75 45.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.278 0.561 . . . . 0.0 111.743 -172.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.404 ' HZ3' ' HB3' ' A' ' 18' ' ' ARG . 80.6 m95 -101.48 42.24 1.14 Allowed 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 172.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -140.57 151.07 44.42 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.736 -1.12 . . . . 0.0 109.283 -174.132 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.486 ' HA ' ' HD2' ' A' ' 33' ' ' ARG . 1.1 mmm180 -75.77 117.43 63.6 Favored Pre-proline 0 C--N 1.322 -0.616 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 177.065 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo . . . . . 0 C--O 1.235 0.326 0 C-N-CA 123.086 2.524 . . . . 0.0 111.956 -178.815 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.678 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 19.9 mt . . . . . 0 N--CA 1.453 -0.279 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.884 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 79.8 Cg_exo -54.66 160.47 7.25 Favored 'Trans proline' 0 C--O 1.237 0.437 0 C-N-CA 122.827 2.352 . . . . 0.0 111.736 173.725 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.55 88.54 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.746 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 137.3 -8.93 3.79 Favored Glycine 0 N--CA 1.442 -0.907 0 C-N-CA 120.33 -0.938 . . . . 0.0 113.304 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.884 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 88.0 m95 -95.63 140.58 30.24 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 117.869 0.834 . . . . 0.0 109.936 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -131.65 140.58 49.4 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -179.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -93.24 138.03 32.01 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.026 0.441 . . . . 0.0 110.96 -177.385 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.481 ' HG3' HG11 ' A' ' 22' ' ' VAL . 3.8 mtt180 -132.26 175.83 8.92 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.224 174.145 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 7.7 mptt -130.09 160.89 32.37 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 121.188 0.518 . . . . 0.0 111.128 -175.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -91.22 8.28 36.61 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.683 178.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 72.53 7.78 5.62 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.937 178.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.1 mttp -116.82 -32.89 4.97 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.124 0.488 . . . . 0.0 110.128 175.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 145.19 8.34 0.36 Allowed Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.009 177.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.03 126.78 44.82 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.9 0.35 . . . . 0.0 110.212 177.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.406 HG22 ' O ' ' A' ' 12' ' ' ARG . 0.2 OUTLIER -102.86 120.91 41.44 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.384 -176.898 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 29.8 p90 -115.89 164.48 14.35 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 175.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -110.3 126.26 54.01 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.062 0.458 . . . . 0.0 111.063 -175.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.481 HG11 ' HG3' ' A' ' 12' ' ' ARG . 2.6 p -118.93 115.16 47.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-O 121.647 0.736 . . . . 0.0 110.263 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 41.1 t-20 -91.3 107.98 19.57 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.33 -0.85 . . . . 0.0 108.981 178.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -78.64 -5.4 52.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.762 0.315 . . . . 0.0 111.306 -173.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -100.26 -29.41 12.46 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.868 0.366 . . . . 0.0 110.536 -177.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -107.69 -3.9 18.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.773 178.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 27' ' ' ARG . 0.0 OUTLIER 57.7 54.19 6.51 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.197 -179.357 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.22 130.22 49.25 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.984 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.432 HG22 ' HB ' ' A' ' 22' ' ' VAL . 0.0 OUTLIER -117.9 101.0 7.94 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 176.638 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.404 HG23 ' O ' ' A' ' 32' ' ' THR . 10.7 t -116.09 148.4 40.29 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.221 0.534 . . . . 0.0 111.848 -173.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.3 m95 -99.52 14.88 28.37 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.374 -0.83 . . . . 0.0 108.782 172.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.404 ' O ' HG23 ' A' ' 30' ' ' THR . 0.4 OUTLIER -105.66 153.62 21.57 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 114.868 -1.06 . . . . 0.0 109.796 -179.664 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.9 116.73 66.85 Favored Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo . . . . . 0 N--CA 1.462 -0.371 0 C-N-CA 122.844 2.362 . . . . 0.0 112.274 -179.625 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.713 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 30.1 mt . . . . . 0 N--CA 1.451 -0.41 0 N-CA-C 111.294 0.109 . . . . 0.0 111.294 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.78 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 81.2 Cg_exo -59.78 35.7 0.05 OUTLIER 'Trans proline' 0 N--CA 1.486 1.088 0 C-N-CA 124.444 3.429 . . . . 0.0 115.417 175.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.441 ' H ' ' C ' ' A' ' 5' ' ' LEU . 70.8 m 68.14 -54.27 0.52 Allowed 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 123.629 0.771 . . . . 0.0 112.54 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -80.06 -2.16 88.51 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 121.099 -0.572 . . . . 0.0 112.374 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.78 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 83.5 m95 -102.29 138.42 39.25 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -129.52 139.08 51.65 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.898 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -87.67 137.79 32.03 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.888 0.375 . . . . 0.0 110.092 178.219 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 12' ' ' ARG . 1.4 mtp85 -135.87 -177.21 4.59 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.302 176.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.64 142.63 51.3 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.679 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.07 -172.71 2.9 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.688 -178.431 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.24 -36.17 75.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.493 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 19.5 mttm -73.91 -54.39 8.05 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 134.13 20.81 0.81 Allowed Glycine 0 N--CA 1.444 -0.767 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.366 178.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.94 147.47 27.46 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 110.34 -0.245 . . . . 0.0 110.34 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -82.29 105.41 13.34 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.818 0.342 . . . . 0.0 111.022 178.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 42.0 p90 -109.24 152.96 24.5 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 172.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -107.56 123.69 48.82 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.289 0.566 . . . . 0.0 110.478 -174.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.4 p -117.02 114.91 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.612 -177.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.405 ' HB2' ' CD2' ' A' ' 9' ' ' TRP . 26.5 t-20 -82.43 122.24 27.77 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.982 -1.008 . . . . 0.0 108.334 174.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -83.96 -42.95 15.72 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -168.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.28 -42.12 72.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.785 0.326 . . . . 0.0 110.996 -176.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -87.77 -10.76 50.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.568 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 56.62 54.75 7.04 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.996 -179.048 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -116.46 134.19 55.15 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.496 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.63 111.57 17.81 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.424 -179.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.497 HG21 ' CZ3' ' A' ' 9' ' ' TRP . 6.5 t -127.27 153.33 46.27 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.568 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 44.9 m95 -104.33 14.96 29.25 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.359 0.599 . . . . 0.0 109.611 178.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -117.89 165.15 14.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.237 178.608 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 12.6 mtp85 -86.83 113.56 53.81 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-O 120.734 0.302 . . . . 0.0 110.798 179.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo . . . . . 0 N--CA 1.464 -0.238 0 C-N-CA 122.807 2.338 . . . . 0.0 112.419 178.903 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.696 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 19.8 mt . . . . . 0 N--CA 1.447 -0.609 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.888 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 87.3 Cg_exo -53.58 150.9 26.26 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 122.733 2.289 . . . . 0.0 111.104 171.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 m -59.97 93.89 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.156 0.503 . . . . 0.0 110.847 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 139.67 -18.83 2.99 Favored Glycine 0 N--CA 1.44 -1.056 0 C-N-CA 120.917 -0.658 . . . . 0.0 112.307 -177.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.888 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 93.9 m95 -93.26 139.16 30.93 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 179.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -128.51 130.83 48.05 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.72 179.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.12 126.22 32.89 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 178.107 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.403 ' O ' ' HA ' ' A' ' 19' ' ' THR . 59.7 mtp85 -138.57 173.79 11.22 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.389 -178.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.476 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -136.03 116.11 13.35 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.408 -174.415 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.475 ' HB2' ' CE1' ' A' ' 20' ' ' TYR . 6.5 t0 -99.65 152.46 20.04 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.496 -177.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 60.02 -100.0 0.1 Allowed 'General case' 0 N--CA 1.463 0.22 0 O-C-N 123.619 0.575 . . . . 0.0 112.072 176.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.55 53.17 0.94 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.0 0.428 . . . . 0.0 110.823 -175.575 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.64 23.0 57.27 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.863 175.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.476 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 18.6 mmm-85 -76.73 110.86 11.67 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.403 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 1.4 m -81.44 124.61 29.58 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.562 -173.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.475 ' CE1' ' HB2' ' A' ' 14' ' ' ASP . 34.2 p90 -137.0 167.2 21.96 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.181 175.227 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -113.6 121.0 42.86 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-O 121.26 0.552 . . . . 0.0 110.097 -179.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.4 p -111.83 117.56 55.45 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.263 -177.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.403 ' HB2' ' CD2' ' A' ' 9' ' ' TRP . 24.9 t-20 -90.99 126.43 36.08 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.504 -178.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -94.92 -8.76 36.16 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -173.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -83.53 -54.34 5.02 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 175.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -91.65 -8.63 46.62 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.065 -176.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 58.38 59.48 2.98 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.34 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.01 142.55 51.2 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.272 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.59 100.93 10.49 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.884 177.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.704 HG23 HG23 ' A' ' 32' ' ' THR . 0.5 OUTLIER -111.78 138.78 47.9 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.05 0.453 . . . . 0.0 111.029 -172.842 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 59.3 m95 -109.89 32.31 5.18 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.502 0.668 . . . . 0.0 109.737 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.704 HG23 HG23 ' A' ' 30' ' ' THR . 1.3 t -137.47 163.94 29.9 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.418 -177.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.448 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 14.4 mmm180 -75.57 115.28 44.29 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-O 121.111 0.482 . . . . 0.0 110.831 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 6.7 Cg_exo . . . . . 0 N--CA 1.461 -0.386 0 C-N-CA 123.427 2.752 . . . . 0.0 112.821 -177.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.499 ' HA ' HD22 ' A' ' 5' ' ' LEU . 6.1 mt . . . . . 0 C--O 1.233 0.23 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.647 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 51.3 Cg_exo -60.05 164.05 13.01 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.627 2.218 . . . . 0.0 111.204 171.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -50.76 -37.45 42.21 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -175.349 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -102.37 5.86 52.52 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.635 -0.793 . . . . 0.0 114.166 -174.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.647 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 89.5 m95 -104.44 144.43 31.68 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 118.227 1.014 . . . . 0.0 109.964 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -137.31 129.05 28.74 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.962 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.14 116.65 24.47 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 175.637 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.72 -170.36 2.11 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.342 0.592 . . . . 0.0 110.892 -177.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -122.22 126.78 48.97 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.38 -178.052 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.48 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -58.76 -53.14 61.7 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.373 -177.853 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 170.99 -47.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 O-C-N 124.098 0.874 . . . . 0.0 109.038 -178.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.32 37.41 1.18 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.629 -177.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.1 -11.52 42.4 Favored Glycine 0 CA--C 1.517 0.205 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.897 177.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.48 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 14.1 mtt180 -61.27 138.25 58.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.937 0.399 . . . . 0.0 111.145 -177.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -97.16 122.25 39.96 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.892 -177.389 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.5 p90 -133.39 153.25 51.76 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 175.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.532 ' OH ' ' HD3' ' A' ' 33' ' ' ARG . 50.7 m-85 -109.41 119.37 39.25 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.481 0.658 . . . . 0.0 110.391 -176.028 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.2 p -114.84 115.28 49.02 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.188 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.404 -177.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -85.62 111.23 19.87 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.617 175.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -81.28 -10.38 59.59 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.787 -170.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -89.75 -54.83 3.88 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.131 0.491 . . . . 0.0 110.092 -178.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 19.8 t30 -83.96 -4.45 58.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.545 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.4 mtm180 57.41 52.52 8.53 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.013 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.09 134.83 54.76 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.06 0.457 . . . . 0.0 111.304 -178.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.13 104.03 13.9 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.97 179.135 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.484 ' HB ' ' CZ3' ' A' ' 9' ' ' TRP . 0.9 OUTLIER -116.93 129.07 55.82 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.56 -173.626 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.3 m95 -100.31 39.89 1.31 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.356 0.598 . . . . 0.0 110.131 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.411 HG23 ' CG2' ' A' ' 30' ' ' THR . 0.6 OUTLIER -144.79 151.59 39.04 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.849 -176.88 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.532 ' HD3' ' OH ' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -69.14 114.09 21.13 Favored Pre-proline 0 C--N 1.32 -0.705 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 175.178 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 11.4 Cg_exo . . . . . 0 C--N 1.344 0.299 0 C-N-CA 123.529 2.819 . . . . 0.0 113.593 -176.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.6 mp . . . . . 0 N--CA 1.447 -0.592 0 CA-C-O 121.059 0.457 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.805 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 89.1 Cg_exo -53.16 163.93 2.03 Favored 'Trans proline' 0 N--CA 1.474 0.343 0 C-N-CA 124.084 3.189 . . . . 0.0 113.05 176.066 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.05 120.07 10.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.353 -0.385 . . . . 0.0 109.967 175.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 108.51 -28.75 10.99 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 111.449 -0.66 . . . . 0.0 111.449 -174.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.805 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 64.4 m95 -83.49 117.17 22.91 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 178.015 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -120.64 136.28 54.87 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 175.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.42 140.21 29.83 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 178.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.417 ' HD2' ' OH ' ' A' ' 20' ' ' TYR . 2.8 mtm180 -139.06 -168.38 2.42 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.243 0.544 . . . . 0.0 110.41 -178.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.4 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.3 OUTLIER -140.08 151.2 45.17 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.063 -179.862 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -78.84 -165.93 0.81 Allowed 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 110.313 -0.255 . . . . 0.0 110.313 179.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.61 -15.16 63.25 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.027 0.381 . . . . 0.0 112.027 -176.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.413 ' HG3' ' NH2' ' A' ' 18' ' ' ARG . 0.3 OUTLIER -108.08 -44.05 4.26 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.762 0.315 . . . . 0.0 110.807 -178.539 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 140.35 23.11 0.29 Allowed Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.254 -0.974 . . . . 0.0 113.126 178.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.413 ' NH2' ' HG3' ' A' ' 16' ' ' LYS . 12.7 mtm-85 -85.99 144.61 27.51 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 177.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.2 117.95 23.28 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -172.26 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.417 ' OH ' ' HD2' ' A' ' 12' ' ' ARG . 13.9 p90 -129.62 149.48 51.36 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.013 171.278 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -110.21 128.15 55.34 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 120.998 0.427 . . . . 0.0 110.217 -176.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 p -117.11 110.1 30.09 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.879 0.847 . . . . 0.0 110.687 -177.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.497 ' HB2' ' CD2' ' A' ' 9' ' ' TRP . 43.2 t-20 -90.07 112.91 24.52 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.139 178.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -71.95 -29.25 64.08 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.642 -174.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -75.36 -57.34 3.95 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.892 0.377 . . . . 0.0 111.132 -174.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -85.82 -5.99 59.16 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.162 -177.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.4 ttm180 62.21 57.63 1.96 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-O 121.241 0.544 . . . . 0.0 111.406 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.23 131.04 53.99 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.889 178.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.53 76.79 1.22 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.461 0.648 . . . . 0.0 109.677 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.6 t -99.27 148.17 24.42 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.835 -170.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.5 m95 -100.23 46.35 0.96 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.575 0.702 . . . . 0.0 109.129 175.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -152.22 157.27 41.22 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.362 -177.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.437 ' HA ' ' HD2' ' A' ' 34' ' ' PRO . 0.2 OUTLIER -65.23 125.13 88.75 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-O 120.58 0.228 . . . . 0.0 111.001 178.923 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.437 ' HD2' ' HA ' ' A' ' 33' ' ' ARG . 9.7 Cg_endo . . . . . 0 CA--C 1.53 0.283 0 C-N-CA 123.711 2.941 . . . . 0.0 113.242 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.716 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 67.3 mt . . . . . 0 N--CA 1.456 -0.155 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.808 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 81.2 Cg_exo -55.68 167.67 2.03 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 124.249 3.299 . . . . 0.0 112.855 172.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.66 95.71 0.11 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.62 178.008 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 134.42 -22.97 3.67 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.614 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.808 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 88.2 m95 -86.08 129.83 34.72 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 -177.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -122.75 130.41 52.9 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.434 -177.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -87.29 119.63 27.75 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.941 0.401 . . . . 0.0 110.064 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.438 HH11 ' HD3' ' A' ' 12' ' ' ARG . 44.3 mtt180 -126.04 -179.35 4.66 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.991 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.8 mtmp? -140.7 150.69 43.78 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.772 -179.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -93.05 -175.49 3.88 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.006 176.349 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.71 -26.13 68.52 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -177.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.7 mtmp? -87.69 -8.81 55.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.084 0.469 . . . . 0.0 110.432 178.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 90.35 20.95 39.66 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.811 175.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -81.39 123.27 28.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.832 0.316 . . . . 0.0 110.242 177.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -72.75 123.54 23.52 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.409 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.466 ' HB3' ' CE3' ' A' ' 31' ' ' TRP . 37.2 p90 -129.89 155.05 46.67 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 174.23 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -105.93 117.74 34.8 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.38 -176.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 p -109.94 107.07 21.98 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.203 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.465 ' HB2' ' CD2' ' A' ' 9' ' ' TRP . 55.8 t-20 -84.89 112.56 20.67 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.756 178.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -83.91 -16.49 44.08 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.213 0.53 . . . . 0.0 109.911 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -73.57 -54.2 8.75 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.382 178.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.448 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 4.4 t30 -107.44 28.16 8.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.16 -177.609 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.448 ' HG2' ' O ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER 37.41 51.7 1.19 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.151 0.981 . . . . 0.0 113.047 178.227 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.64 132.34 54.61 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.017 0.437 . . . . 0.0 111.219 -176.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -119.6 104.4 10.25 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 178.544 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.455 HG21 ' O ' ' A' ' 32' ' ' THR . 3.9 t -126.11 148.01 49.47 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.084 0.469 . . . . 0.0 111.252 -174.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.466 ' CE3' ' HB3' ' A' ' 20' ' ' TYR . 33.9 m95 -99.87 -5.58 28.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.637 177.161 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.455 ' O ' HG21 ' A' ' 30' ' ' THR . 2.4 t -95.5 165.81 12.17 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.711 177.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.64 130.21 87.52 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 177.333 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo . . . . . 0 C--O 1.236 0.384 0 C-N-CA 123.128 2.552 . . . . 0.0 112.648 177.798 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.844 HD11 ' HG2' ' A' ' 11' ' ' GLU . 22.7 mt . . . . . 0 CA--C 1.514 -0.432 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.901 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 72.2 Cg_exo -55.83 155.56 22.19 Favored 'Trans proline' 0 C--O 1.236 0.391 0 C-N-CA 122.526 2.151 . . . . 0.0 111.141 171.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.82 99.72 0.17 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.959 0.409 . . . . 0.0 110.16 -179.47 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 132.97 -19.01 4.44 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.472 -177.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.901 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 90.9 m95 -91.51 135.84 33.56 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -126.95 132.23 50.89 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.756 -177.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.844 ' HG2' HD11 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -90.14 114.62 26.61 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.167 0.508 . . . . 0.0 110.365 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 48.6 mtt180 -109.31 -178.85 3.67 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.647 178.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -136.55 144.02 43.98 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.433 -179.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -96.96 171.46 8.48 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.45 176.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.11 -26.28 68.2 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -176.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.409 ' HA ' ' HD2' ' A' ' 16' ' ' LYS . 22.9 mmmt -84.66 -4.34 58.96 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.851 0.358 . . . . 0.0 110.686 -179.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.23 12.66 55.96 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.346 177.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -81.0 144.83 31.51 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 179.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.7 m -98.9 120.5 39.44 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.438 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.0 p90 -124.58 148.31 47.92 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 176.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -105.33 122.08 45.21 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.633 0.73 . . . . 0.0 110.683 -174.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 p -115.92 113.86 44.5 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.099 -177.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 37.7 t-20 -89.48 117.35 28.33 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.147 178.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 78.9 m-70 -83.93 -20.79 32.35 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.362 -174.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -84.67 -41.78 15.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.081 0.467 . . . . 0.0 110.434 -179.037 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -95.75 -1.21 50.29 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.96 -178.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 56.21 40.77 29.93 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.701 177.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.67 141.82 47.7 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.858 0.361 . . . . 0.0 111.352 -176.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.42 109.75 14.26 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.255 178.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.48 HG22 ' CZ3' ' A' ' 9' ' ' TRP . 2.6 t -127.62 151.46 48.9 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.017 0.437 . . . . 0.0 110.987 -177.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 47.2 m95 -103.19 12.93 35.08 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -109.24 158.76 17.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.576 -178.127 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.432 HH11 ' HD3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -85.21 116.69 66.54 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-O 120.769 0.318 . . . . 0.0 111.161 178.209 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo . . . . . 0 N--CA 1.455 -0.791 0 C-N-CA 122.639 2.226 . . . . 0.0 111.55 175.971 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.554 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 20.6 mt . . . . . 0 N--CA 1.451 -0.405 0 CA-C-O 120.749 0.309 . . . . 0.0 111.102 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.799 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 74.2 Cg_exo -56.8 162.65 8.4 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.922 2.415 . . . . 0.0 111.274 169.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -14.61 9.69 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -176.002 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -108.48 -1.98 32.94 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.424 -0.894 . . . . 0.0 113.406 -177.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.799 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 80.0 m95 -104.34 138.61 40.51 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 117.932 0.866 . . . . 0.0 110.676 -176.402 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -121.48 133.94 55.05 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.43 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.06 120.15 32.42 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.159 0.504 . . . . 0.0 110.374 -179.139 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.497 ' HG3' ' CG1' ' A' ' 22' ' ' VAL . 0.8 OUTLIER -115.61 165.63 12.82 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.691 177.203 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -114.28 135.76 53.72 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.861 -177.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.446 ' O ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -66.91 -57.71 6.41 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.952 178.9 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.446 ' HB2' ' O ' ' A' ' 14' ' ' ASP . . . 168.07 -48.64 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.296 0 O-C-N 123.958 0.786 . . . . 0.0 109.583 -178.432 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.59 45.9 1.0 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.686 0.755 . . . . 0.0 110.901 -175.176 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.26 -17.46 18.29 Favored Glycine 0 C--N 1.317 -0.5 0 CA-C-N 114.816 -1.084 . . . . 0.0 113.227 176.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -65.02 118.14 8.68 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.931 0.396 . . . . 0.0 110.664 -178.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.421 HG22 ' O ' ' A' ' 12' ' ' ARG . 0.9 OUTLIER -102.89 130.61 49.99 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.496 -179.521 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 37.6 p90 -124.13 161.73 25.04 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.129 0.49 . . . . 0.0 110.322 176.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -108.47 117.52 34.38 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.43 -174.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.497 ' CG1' ' HG3' ' A' ' 12' ' ' ARG . 3.7 p -115.53 115.65 50.01 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 CA-C-O 121.822 0.82 . . . . 0.0 109.695 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.652 ' HB3' HG23 ' A' ' 28' ' ' THR . 29.3 t-20 -90.22 108.45 19.76 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.771 -177.152 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -88.25 38.68 0.87 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.179 0.514 . . . . 0.0 111.042 -176.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -137.3 -47.76 0.58 Allowed 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 178.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -92.54 -8.35 44.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.115 174.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.93 56.8 2.75 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.678 177.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.652 HG23 ' HB3' ' A' ' 23' ' ' ASN . 0.6 OUTLIER -127.61 155.35 44.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.168 0.509 . . . . 0.0 111.192 177.998 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.44 102.94 8.58 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.151 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.663 ' HB ' ' HZ3' ' A' ' 9' ' ' TRP . 0.9 OUTLIER -120.17 136.88 54.47 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.198 -169.519 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 58.0 m95 -101.99 -19.32 15.26 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.052 0.453 . . . . 0.0 110.238 178.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.4 t -79.63 163.0 24.94 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.731 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.426 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 8.2 mpt_? -78.06 120.92 83.07 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 176.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 16.1 Cg_exo . . . . . 0 C--N 1.343 0.283 0 C-N-CA 122.769 2.313 . . . . 0.0 111.773 179.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.674 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 7.4 mt . . . . . 0 C--O 1.234 0.27 0 CA-C-O 120.816 0.341 . . . . 0.0 110.859 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.893 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 50.9 Cg_exo -61.02 -161.47 0.03 OUTLIER 'Trans proline' 0 N--CA 1.474 0.33 0 C-N-CA 124.034 3.156 . . . . 0.0 114.016 -179.791 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.9 94.2 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.945 -1.025 . . . . 0.0 112.55 -174.703 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 77.66 18.43 77.47 Favored Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 121.003 -0.618 . . . . 0.0 113.727 173.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.893 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 74.6 m95 -82.63 129.19 34.9 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 176.549 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -132.38 136.76 47.03 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 121.174 -0.21 . . . . 0.0 110.659 -179.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -90.34 117.27 28.93 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.456 0.646 . . . . 0.0 109.602 174.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.497 ' O ' ' HA ' ' A' ' 19' ' ' THR . 0.0 OUTLIER -110.17 -174.84 2.58 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.543 -179.614 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.33 130.19 26.22 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.618 -178.16 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.661 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . 35.0 t70 -81.47 55.01 2.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.221 177.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 67.77 -58.19 0.44 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.845 0.858 . . . . 0.0 112.656 178.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.63 30.01 0.66 Allowed 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 122.611 0.365 . . . . 0.0 111.708 -174.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 77.17 7.89 86.87 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 120.959 -0.639 . . . . 0.0 113.079 177.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.661 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 0.1 OUTLIER -74.06 99.06 3.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.668 0.271 . . . . 0.0 110.315 178.613 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.497 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 30.3 m -72.86 121.68 20.37 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.329 0.585 . . . . 0.0 112.168 -177.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.47 ' HB3' ' CE3' ' A' ' 31' ' ' TRP . 28.3 p90 -126.85 142.76 51.46 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.39 -0.823 . . . . 0.0 108.796 171.125 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.452 ' CE1' ' HG3' ' A' ' 33' ' ' ARG . 74.2 m-85 -98.39 120.59 39.08 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.695 0.76 . . . . 0.0 110.21 -176.659 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.4 HG11 ' HG3' ' A' ' 12' ' ' ARG . 2.3 p -111.98 117.0 54.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.276 -177.423 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -89.04 120.03 30.09 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.472 -0.785 . . . . 0.0 108.963 177.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -82.32 -22.24 35.69 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.78 -173.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -76.88 -47.82 20.1 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.251 -174.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -107.59 7.49 28.7 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.928 0.394 . . . . 0.0 110.726 178.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 54.03 45.2 28.08 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.399 178.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.88 135.0 35.66 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.305 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.77 108.7 12.8 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.629 -179.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 12.4 t -127.51 149.61 50.05 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.126 0.488 . . . . 0.0 110.701 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.47 ' CE3' ' HB3' ' A' ' 20' ' ' TYR . 49.1 m95 -102.77 21.51 15.36 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.569 0.7 . . . . 0.0 109.203 177.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -118.9 160.71 21.44 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 114.911 -1.041 . . . . 0.0 109.367 175.247 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.452 ' HG3' ' CE1' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -78.43 120.97 83.05 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-O 120.681 0.277 . . . . 0.0 110.288 179.101 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo . . . . . 0 N--CA 1.461 -0.391 0 C-N-CA 122.65 2.233 . . . . 0.0 112.332 -178.061 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.562 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 17.9 mt . . . . . 0 CA--C 1.516 -0.341 0 CA-C-O 120.723 0.297 . . . . 0.0 110.856 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.785 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 83.6 Cg_exo -53.7 144.34 54.05 Favored 'Trans proline' 0 CA--C 1.52 -0.198 0 C-N-CA 122.901 2.401 . . . . 0.0 110.774 170.744 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.0 m -58.12 92.38 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.29 0.567 . . . . 0.0 110.214 178.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.454 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 145.75 -29.21 1.72 Allowed Glycine 0 N--CA 1.438 -1.204 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.515 -173.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.785 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 93.2 m95 -90.64 131.07 36.55 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 176.639 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -124.04 117.44 24.73 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -179.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -81.8 103.55 11.56 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 121.66 0.743 . . . . 0.0 110.098 176.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.2 mtt-85 -107.94 174.88 5.68 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.638 -1.164 . . . . 0.0 109.105 -178.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.91 128.77 54.73 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 120.937 0.398 . . . . 0.0 110.467 -176.073 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -99.46 -2.97 34.66 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.609 0.719 . . . . 0.0 109.416 -179.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.438 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . . . -159.76 -156.41 0.5 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.909 -1.041 . . . . 0.0 109.915 -179.18 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.57 32.58 0.65 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.239 0.543 . . . . 0.0 111.188 -174.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 149.63 -6.81 0.78 Allowed Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.23 -177.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.438 ' HB2' ' HB3' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -79.16 101.44 7.93 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 175.533 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.53 134.87 36.61 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.124 -176.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 28.1 p90 -134.36 155.92 49.42 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.412 176.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -106.45 113.71 27.39 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.352 0.596 . . . . 0.0 110.622 -175.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 p -108.55 111.17 34.83 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.208 -179.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.454 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 23.8 t-20 -82.21 121.77 27.06 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 178.1 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 59.8 m-70 -84.19 -17.86 38.54 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -169.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.7 p30 -95.34 -37.69 10.85 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.269 -0.572 . . . . 0.0 110.874 -179.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 19.5 t30 -93.75 -2.81 53.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.537 -0.302 . . . . 0.0 110.625 178.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 26.4 mtm180 55.58 45.89 23.97 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.461 176.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.04 131.61 56.31 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.108 0.48 . . . . 0.0 111.22 -178.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -111.35 96.34 6.06 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.955 -178.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.592 HG23 ' CZ3' ' A' ' 9' ' ' TRP . 1.8 t -116.46 145.38 43.33 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.238 0.542 . . . . 0.0 111.434 -175.22 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 31.8 m95 -99.85 7.9 44.58 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 171.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.528 ' O ' HG21 ' A' ' 30' ' ' THR . 0.8 OUTLIER -97.2 144.57 26.89 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.522 -177.626 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.446 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 8.9 mmm180 -67.99 119.54 67.75 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-O 120.74 0.305 . . . . 0.0 111.213 177.776 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 6.7 Cg_exo . . . . . 0 C--N 1.342 0.214 0 C-N-CA 123.428 2.752 . . . . 0.0 112.518 178.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.747 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 28.3 mt . . . . . 0 N--CA 1.448 -0.535 0 CA-C-O 119.544 -0.265 . . . . 0.0 110.364 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.754 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 87.3 Cg_exo -58.41 42.16 0.05 OUTLIER 'Trans proline' 0 N--CA 1.489 1.229 0 C-N-CA 124.627 3.552 . . . . 0.0 115.749 176.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.8 m 66.43 -59.45 0.34 Allowed 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.993 0.917 . . . . 0.0 112.752 177.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -73.46 -19.59 79.7 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 121.194 -0.527 . . . . 0.0 112.163 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.754 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 93.6 m95 -87.58 137.81 32.02 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 179.699 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -128.23 122.4 31.7 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.926 179.012 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -82.66 117.9 22.94 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.135 0.493 . . . . 0.0 110.021 178.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.498 ' O ' ' HA ' ' A' ' 19' ' ' THR . 39.0 mtt180 -122.77 -176.47 3.4 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.887 -178.51 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -133.48 137.84 45.86 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.065 -179.024 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -77.85 -175.9 4.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.667 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.07 -28.53 69.67 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.726 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.8 mmtt -82.28 -27.37 32.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.874 0.369 . . . . 0.0 110.665 177.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 113.14 13.5 10.81 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.686 -0.769 . . . . 0.0 113.136 176.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.484 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.3 OUTLIER -84.95 142.04 29.93 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.848 0.356 . . . . 0.0 110.492 179.258 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.498 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 0.7 OUTLIER -79.11 125.09 28.96 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.339 -178.909 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -127.75 161.3 29.28 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 172.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.451 ' OH ' ' HD2' ' A' ' 33' ' ' ARG . 50.6 m-85 -112.89 111.28 21.92 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.535 0.683 . . . . 0.0 110.712 -173.313 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.0 p -108.51 107.64 23.32 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.035 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.455 -178.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.463 ' HB3' ' OG1' ' A' ' 28' ' ' THR . 54.3 t-20 -82.1 112.8 19.47 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.037 178.139 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -82.15 -17.31 46.79 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.068 0.461 . . . . 0.0 110.368 -176.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -81.44 -41.13 22.29 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.279 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 57.7 m-20 -97.99 -3.25 38.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.042 -178.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 57.76 52.31 8.27 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.982 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' THR . . . . . 0.463 ' OG1' ' HB3' ' A' ' 23' ' ' ASN . 33.8 p -124.25 132.15 53.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.995 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.67 78.87 1.61 Allowed 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 173.333 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.562 ' HB ' ' HZ3' ' A' ' 9' ' ' TRP . 0.9 OUTLIER -91.72 128.98 37.76 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.449 -169.043 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 39.5 m95 -101.61 58.97 0.86 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.27 0.557 . . . . 0.0 109.72 177.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -167.26 146.88 5.25 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.327 -176.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.451 ' HD2' ' OH ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -67.18 114.61 19.38 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-O 120.64 0.257 . . . . 0.0 110.659 177.562 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo . . . . . 0 N--CA 1.463 -0.277 0 C-N-CA 122.853 2.368 . . . . 0.0 112.688 -177.195 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.77 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 10.5 mt . . . . . 0 N--CA 1.45 -0.454 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.873 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 75.8 Cg_exo -54.35 163.74 3.34 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.855 2.37 . . . . 0.0 112.29 174.421 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.64 94.73 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.361 -177.321 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.401 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 128.38 -17.61 5.86 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.208 178.168 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.873 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 96.5 m95 -87.55 134.47 33.62 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 117.794 0.797 . . . . 0.0 110.165 -177.063 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -125.8 132.66 52.23 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.753 177.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.42 117.74 27.57 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.274 0.559 . . . . 0.0 110.893 -178.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.437 ' O ' HG22 ' A' ' 19' ' ' THR . 6.6 ttp85 -121.68 -177.95 3.69 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.523 0.678 . . . . 0.0 110.32 177.744 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.45 129.3 23.2 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.445 -177.103 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -81.7 176.01 9.99 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 120.788 -0.365 . . . . 0.0 110.467 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.16 -19.89 63.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.902 0.382 . . . . 0.0 111.269 -178.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.5 mttp -71.89 -28.15 63.32 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.548 176.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 112.07 -23.29 16.83 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.454 -178.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.77 144.3 52.74 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.975 0.417 . . . . 0.0 111.929 -176.15 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.437 HG22 ' O ' ' A' ' 12' ' ' ARG . 0.7 OUTLIER -85.19 138.48 32.34 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.632 179.915 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 49.0 p90 -141.1 162.75 34.75 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 172.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -111.93 120.24 41.25 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.134 0.492 . . . . 0.0 110.839 -174.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 p -109.22 114.4 46.81 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.01 179.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.418 ' HB2' ' CE3' ' A' ' 9' ' ' TRP . 57.5 t-20 -88.74 113.67 24.55 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.92 -179.535 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -80.72 -16.14 54.69 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.769 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -85.88 -32.96 21.38 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.486 -179.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -104.13 -11.0 17.55 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.2 -178.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 65.1 37.47 6.66 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.0 -179.131 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.64 141.23 51.96 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.953 0.406 . . . . 0.0 111.382 -178.455 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.93 93.47 4.33 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.856 178.471 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.6 146.48 25.25 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.289 0.566 . . . . 0.0 111.335 -173.418 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 55.9 m95 -106.93 8.4 30.54 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.834 177.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.7 t -110.28 161.52 15.53 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.81 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.467 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 0.0 OUTLIER -77.03 121.71 85.16 Favored Pre-proline 0 C--N 1.321 -0.64 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 176.447 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 17.6 Cg_exo . . . . . 0 C--N 1.345 0.377 0 C-N-CA 122.883 2.389 . . . . 0.0 112.44 -177.036 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.619 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 27.8 mt . . . . . 0 N--CA 1.454 -0.258 0 CA-C-O 120.803 0.335 . . . . 0.0 111.583 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.671 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 86.4 Cg_exo -54.95 167.15 1.72 Allowed 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 123.426 2.751 . . . . 0.0 111.815 170.493 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.97 -8.28 15.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.837 0.351 . . . . 0.0 111.655 -177.562 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -113.94 -0.56 24.16 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.615 -179.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.671 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 84.2 m95 -109.35 131.18 55.31 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 117.793 0.796 . . . . 0.0 110.001 -178.519 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -114.21 133.17 55.8 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.563 ' HG2' HD11 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -87.19 118.47 26.62 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 178.85 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 12' ' ' ARG . 6.2 mtp180 -114.28 175.54 5.43 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.144 0.497 . . . . 0.0 110.133 179.591 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.4 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -140.3 132.3 27.81 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.933 -178.269 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.405 ' C ' ' H ' ' A' ' 16' ' ' LYS . 23.0 t70 -87.09 27.88 0.98 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.055 -179.153 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 73.01 -34.63 0.3 Allowed 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 123.546 0.738 . . . . 0.0 112.635 176.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.405 ' H ' ' C ' ' A' ' 14' ' ' ASP . 9.5 mttt -90.02 35.27 0.85 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.062 0.458 . . . . 0.0 111.027 -178.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 72.8 5.49 64.7 Favored Glycine 0 C--N 1.328 0.102 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.119 178.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.4 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -83.56 101.76 11.68 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 -177.001 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 4.7 m -90.36 122.25 33.08 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.075 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 37.5 p90 -129.24 158.43 39.07 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.054 0.454 . . . . 0.0 109.999 178.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.416 ' HD1' HD13 ' A' ' 5' ' ' LEU . 46.2 m-85 -105.7 117.7 34.69 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.385 -174.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.7 p -110.98 114.77 48.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.847 0 CA-C-O 121.626 0.726 . . . . 0.0 110.092 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -84.41 126.21 33.04 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.43 -179.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 -84.89 -12.53 53.26 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -171.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -83.32 -59.17 2.55 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.141 0.496 . . . . 0.0 110.042 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -87.89 -15.62 36.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.872 -176.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 69.46 34.73 2.74 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.271 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.5 134.47 33.67 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.702 178.017 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.5 91.66 4.14 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 176.356 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.528 ' HB ' ' HZ3' ' A' ' 9' ' ' TRP . 0.9 OUTLIER -105.85 122.38 45.99 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.354 -168.038 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 67.2 m95 -97.36 40.03 1.17 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.551 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.483 HG21 HG23 ' A' ' 30' ' ' THR . 6.6 t -156.89 172.14 19.18 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.461 -0.79 . . . . 0.0 108.884 -177.44 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.531 ' HA ' ' HD2' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -74.13 134.38 77.47 Favored Pre-proline 0 C--N 1.318 -0.77 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.569 177.911 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo . . . . . 0 C--N 1.349 0.573 0 C-N-CA 123.422 2.748 . . . . 0.0 112.948 174.539 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.602 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 14.8 mt . . . . . 0 N--CA 1.454 -0.244 0 CA-C-O 120.31 0.1 . . . . 0.0 110.823 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.776 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 75.6 Cg_exo -59.32 -167.14 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.363 2.709 . . . . 0.0 113.458 174.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.18 -49.44 75.95 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.233 -0.894 . . . . 0.0 112.713 -174.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.539 ' HA3' ' OD1' ' A' ' 25' ' ' ASN . . . -116.34 19.59 13.01 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 119.968 -1.11 . . . . 0.0 114.309 -172.529 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.776 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 92.5 m95 -100.28 140.25 34.8 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 117.819 0.809 . . . . 0.0 110.125 -179.09 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.511 ' OE1' ' HD2' ' A' ' 12' ' ' ARG . 21.4 tt0 -133.51 125.13 28.25 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 177.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -85.2 119.55 25.7 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.941 0.4 . . . . 0.0 110.322 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.511 ' HD2' ' OE1' ' A' ' 10' ' ' GLU . 0.3 OUTLIER -116.6 -166.5 1.16 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.956 178.98 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.492 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.4 OUTLIER -135.1 149.1 49.99 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.634 -174.511 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -78.48 -164.99 0.63 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.261 177.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.46 -20.41 63.1 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -178.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.408 ' HD3' ' HA ' ' A' ' 16' ' ' LYS . 61.5 mmtt -107.47 -50.6 3.05 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.757 0.313 . . . . 0.0 111.217 -178.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 152.97 21.48 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.592 -0.813 . . . . 0.0 113.071 -179.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.492 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -77.63 128.82 34.74 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 177.397 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.435 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 0.2 OUTLIER -80.59 113.02 18.49 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.031 0.443 . . . . 0.0 111.753 -176.468 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.8 p90 -120.97 156.86 31.18 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 173.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -106.4 122.18 45.75 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.23 0.538 . . . . 0.0 110.929 -172.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 p -119.16 111.16 32.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.787 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.229 179.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 31.8 t-20 -77.71 128.17 33.62 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 177.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 65.7 m-70 -95.19 -15.07 23.55 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -168.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.539 ' OD1' ' HA3' ' A' ' 8' ' ' GLY . 10.6 p-10 -103.52 -20.21 14.11 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.95 179.621 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -105.71 -16.06 14.79 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.087 0.47 . . . . 0.0 110.198 175.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.12 50.0 2.55 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.426 177.626 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -112.65 128.35 56.36 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.991 178.609 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.17 103.51 12.72 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.731 176.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.443 HG23 ' CZ3' ' A' ' 9' ' ' TRP . 1.4 t -125.12 147.92 48.79 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.422 0.63 . . . . 0.0 111.667 -174.181 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 57.1 m95 -106.63 39.99 1.72 Allowed 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 174.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.408 ' O ' ' HD3' ' A' ' 34' ' ' PRO . 0.5 OUTLIER -136.32 154.67 50.79 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.47 -178.102 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -75.88 112.39 19.81 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-O 120.743 0.306 . . . . 0.0 110.8 -179.187 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.408 ' HD3' ' O ' ' A' ' 32' ' ' THR . 31.6 Cg_exo . . . . . 0 C--N 1.345 0.349 0 C-N-CA 123.26 2.64 . . . . 0.0 112.607 -179.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.715 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 39.1 mt . . . . . 0 N--CA 1.448 -0.546 0 CA-C-O 120.607 0.242 . . . . 0.0 110.642 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.718 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 75.6 Cg_exo -56.67 164.13 6.21 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 122.452 2.101 . . . . 0.0 110.839 166.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -66.69 -8.8 30.3 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.94 0.4 . . . . 0.0 111.374 -177.13 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -99.87 -21.47 13.98 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 121.013 -0.613 . . . . 0.0 113.231 177.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.718 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 74.3 m95 -96.35 143.67 27.2 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 117.442 0.621 . . . . 0.0 110.097 -173.599 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -136.38 131.66 34.51 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.111 178.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -83.24 125.51 31.65 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.127 0.489 . . . . 0.0 110.095 178.261 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 2.6 ttt180 -121.69 -166.15 1.34 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.912 179.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.614 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 28.6 mtpt -135.85 149.22 48.96 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.186 -179.758 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.412 ' OD1' ' HB2' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -95.06 177.17 5.97 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.426 175.55 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.42 -28.02 67.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.821 0.343 . . . . 0.0 111.778 -177.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.4 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 2.6 mtmp? -88.1 -9.48 53.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.238 -178.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 100.67 11.99 39.18 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.752 -0.737 . . . . 0.0 113.158 176.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.614 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -77.04 161.2 28.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 117.082 0.441 . . . . 0.0 110.302 178.606 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.53 116.85 32.75 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.952 -178.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.8 p90 -125.12 157.94 35.12 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 175.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -106.29 118.8 37.58 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.397 0.618 . . . . 0.0 110.804 -175.332 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.1 p -108.83 110.94 33.91 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.089 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.417 ' HB2' ' CD2' ' A' ' 9' ' ' TRP . 23.2 t30 -84.31 121.47 27.56 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.457 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -82.05 -21.49 36.89 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.45 -174.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.96 -57.92 3.7 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.415 -177.184 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -101.2 1.81 39.38 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.343 -177.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.1 29.21 17.53 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 123.577 0.548 . . . . 0.0 111.64 -179.031 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.6 129.71 34.99 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.967 0.413 . . . . 0.0 110.353 177.213 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -118.96 107.28 13.35 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.203 -178.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.588 HG23 ' O ' ' A' ' 32' ' ' THR . 6.5 t -127.56 149.24 50.24 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.208 0.528 . . . . 0.0 111.697 -175.588 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.406 ' HZ3' ' HB3' ' A' ' 18' ' ' ARG . 16.4 m95 -97.92 7.95 45.52 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 172.507 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.588 ' O ' HG23 ' A' ' 30' ' ' THR . 0.8 OUTLIER -103.92 150.79 23.86 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 114.26 -1.336 . . . . 0.0 110.352 -176.87 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.511 ' HA ' ' HD2' ' A' ' 33' ' ' ARG . 11.0 mmm180 -72.68 121.32 84.64 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-O 120.762 0.315 . . . . 0.0 110.91 177.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 21.9 Cg_exo . . . . . 0 C--O 1.236 0.415 0 C-N-CA 122.906 2.404 . . . . 0.0 112.058 179.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.563 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 36.4 mt . . . . . 0 N--CA 1.454 -0.275 0 CA-C-O 120.718 0.294 . . . . 0.0 110.624 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.825 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 77.7 Cg_exo -57.27 156.08 26.98 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 122.841 2.361 . . . . 0.0 111.23 170.561 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.42 90.06 0.07 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.104 0.478 . . . . 0.0 110.654 179.6 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 142.08 -15.72 2.57 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.417 -178.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.825 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 86.6 m95 -93.46 143.86 25.89 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 117.152 0.476 . . . . 0.0 109.841 179.654 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.435 ' CD ' ' HE2' ' A' ' 24' ' ' HIS . 31.3 tt0 -137.62 136.12 37.22 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.364 -177.774 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.83 124.79 34.0 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.778 0.323 . . . . 0.0 110.237 178.456 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 73.5 mtt180 -131.91 172.5 12.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.851 0.358 . . . . 0.0 110.33 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.445 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -117.88 161.39 19.83 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.107 -174.365 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -111.55 -171.93 1.94 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.908 176.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.11 -13.19 60.21 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -178.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.18 -35.15 16.39 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 118.94 20.92 3.97 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 121.07 -0.586 . . . . 0.0 112.121 179.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.445 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -95.89 153.92 17.5 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.634 0.254 . . . . 0.0 110.488 -179.837 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.6 m -106.53 116.41 31.89 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.269 179.032 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -114.99 163.67 15.26 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 175.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.413 ' HD1' HD13 ' A' ' 5' ' ' LEU . 75.0 m-85 -110.28 122.84 48.62 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.504 0.668 . . . . 0.0 110.827 -177.518 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.4 p -115.31 118.37 58.58 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.032 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -82.64 132.51 35.18 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 176.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.435 ' HE2' ' CD ' ' A' ' 10' ' ' GLU . 34.0 m-70 -87.59 -31.96 19.58 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -169.582 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -87.06 -35.03 18.96 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.107 0.479 . . . . 0.0 110.543 -179.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -85.46 -28.72 24.84 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.475 178.167 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 64.63 46.56 3.13 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.955 -177.287 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.92 132.91 53.61 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.331 177.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -111.92 101.48 9.79 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.09 0.471 . . . . 0.0 109.952 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.5 t -120.55 150.1 41.39 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.152 0.501 . . . . 0.0 110.815 -175.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -99.39 46.28 0.98 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.293 0.568 . . . . 0.0 109.646 179.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.9 t -153.98 141.49 19.79 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.227 -0.897 . . . . 0.0 108.793 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.457 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 0.0 OUTLIER -88.08 112.81 51.73 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-O 121.623 0.725 . . . . 0.0 109.665 178.948 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.482 ' HG2' ' CE2' ' A' ' 9' ' ' TRP . 3.6 Cg_exo . . . . . 0 N--CA 1.458 -0.595 0 C-N-CA 123.553 2.836 . . . . 0.0 112.628 -173.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.691 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 19.6 mt . . . . . 0 N--CA 1.453 -0.295 0 CA-C-O 120.689 0.281 . . . . 0.0 110.928 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.904 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 52.2 Cg_exo -61.0 -179.47 0.3 Allowed 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.352 2.701 . . . . 0.0 112.776 175.856 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.12 104.35 0.24 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.024 -177.28 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.493 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 95.73 5.38 60.02 Favored Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 120.998 -0.62 . . . . 0.0 113.744 173.905 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.904 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 82.1 m95 -91.67 130.8 37.4 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 117.804 0.802 . . . . 0.0 109.832 -179.49 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -132.14 145.85 51.65 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 178.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.95 137.54 37.35 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.319 0.581 . . . . 0.0 110.241 179.258 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.42 ' HG3' HG11 ' A' ' 22' ' ' VAL . 5.9 mtm180 -130.81 177.45 7.4 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.839 177.145 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.433 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -135.98 135.65 39.7 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.408 0.623 . . . . 0.0 111.356 -177.346 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.59 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . 12.3 t70 -67.81 159.99 29.19 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.151 -0.932 . . . . 0.0 108.8 172.011 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.1 -29.2 63.32 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.743 0.306 . . . . 0.0 111.811 -178.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.7 mttp -85.74 4.43 36.78 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.163 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 86.33 34.37 12.39 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.628 177.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.59 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 1.9 mtp180 -95.72 128.52 42.67 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 179.187 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 32.9 m -90.94 125.18 35.7 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.988 0.423 . . . . 0.0 111.361 -175.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -139.94 162.7 34.56 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 176.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -113.72 125.86 54.59 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.154 0.502 . . . . 0.0 110.803 -175.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.526 ' HB ' HG22 ' A' ' 29' ' ' THR . 2.8 p -116.23 110.38 31.38 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.174 -178.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.493 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 33.5 t-20 -81.91 117.86 22.49 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 176.141 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -78.07 -22.78 48.53 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.867 0.365 . . . . 0.0 110.95 -174.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -81.74 -43.66 18.11 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.522 -178.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.407 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 43.4 t30 -100.54 6.21 44.19 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.733 -178.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.407 ' HG2' ' O ' ' A' ' 26' ' ' ASN . 7.9 ptp180 45.54 35.84 2.23 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.295 1.038 . . . . 0.0 112.638 -179.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.76 122.34 43.76 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 121.073 0.463 . . . . 0.0 111.24 -178.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.526 HG22 ' HB ' ' A' ' 22' ' ' VAL . 0.1 OUTLIER -104.47 86.46 2.52 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.164 178.326 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.3 t -98.9 153.0 19.15 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.072 -174.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 57.2 m95 -107.42 24.34 13.02 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.471 0.653 . . . . 0.0 109.482 178.048 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -123.74 159.26 29.83 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.252 -177.439 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.94 114.36 43.44 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 175.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo . . . . . 0 C--O 1.233 0.259 0 C-N-CA 122.946 2.431 . . . . 0.0 112.82 -179.428 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.673 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 59.3 mt . . . . . 0 N--CA 1.448 -0.55 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.705 ' HD2' ' HB2' ' A' ' 9' ' ' TRP . 72.9 Cg_exo -58.64 171.92 1.75 Allowed 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.964 2.442 . . . . 0.0 112.159 171.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.79 7.37 1.15 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.18 -0.464 . . . . 0.0 112.129 -175.477 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -137.73 6.65 3.53 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.999 178.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' TRP . . . . . 0.705 ' HB2' ' HD2' ' A' ' 6' ' ' PRO . 79.6 m95 -111.47 134.39 53.08 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 117.268 0.534 . . . . 0.0 109.577 -178.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . 0.608 ' OE1' ' HD2' ' A' ' 12' ' ' ARG . 43.3 tt0 -120.08 121.51 39.02 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.044 -178.793 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -85.03 117.7 24.15 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.024 0.44 . . . . 0.0 109.839 177.211 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.608 ' HD2' ' OE1' ' A' ' 10' ' ' GLU . 2.3 mtp180 -115.18 -170.0 1.67 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.36 -178.254 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.06 134.04 30.8 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.167 -175.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -76.82 164.82 25.48 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.523 173.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.76 -22.77 67.07 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.071 0.462 . . . . 0.0 111.261 -177.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.461 ' HG3' ' HG2' ' A' ' 18' ' ' ARG . 13.5 pttm -96.24 14.88 22.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.344 178.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 72.13 45.65 39.41 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.499 178.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.461 ' HG2' ' HG3' ' A' ' 16' ' ' LYS . 6.6 mmt-85 -106.21 143.4 34.4 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 178.612 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.1 m -100.33 115.17 29.33 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.613 -175.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.1 p90 -133.84 161.67 34.11 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.998 -0.547 . . . . 0.0 109.828 175.171 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -116.62 125.07 51.27 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.243 0.544 . . . . 0.0 110.673 -175.064 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 p -118.8 108.85 25.09 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 121.815 0.817 . . . . 0.0 110.574 -178.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -80.85 116.32 20.78 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.143 -0.935 . . . . 0.0 108.779 178.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -86.4 -16.15 38.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.802 0.334 . . . . 0.0 111.375 -174.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -76.55 -36.07 57.86 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.936 0.398 . . . . 0.0 110.425 -179.193 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -113.12 -2.82 14.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.057 -179.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 57.74 52.76 7.78 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.045 -178.657 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.6 130.21 56.75 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.904 179.35 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.55 105.44 15.08 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.798 177.774 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -127.81 152.59 47.6 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 120.765 0.317 . . . . 0.0 110.926 -176.279 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 46.6 m95 -101.15 -3.18 29.63 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.917 0.865 . . . . 0.0 108.718 173.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.452 ' O ' ' HD3' ' A' ' 34' ' ' PRO . 1.8 m -74.52 136.91 42.18 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.334 -1.303 . . . . 0.0 110.339 177.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.08 110.86 11.18 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.637 0.256 . . . . 0.0 110.7 177.696 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.452 ' HD3' ' O ' ' A' ' 32' ' ' THR . 73.4 Cg_endo . . . . . 0 N--CA 1.456 -0.699 0 C-N-CA 122.642 2.228 . . . . 0.0 112.642 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.586 0 N-CA-C 111.702 -0.559 . . . . 0.0 111.702 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -114.46 114.75 45.0 Favored Pre-proline 0 C--N 1.323 -0.556 0 CA-C-O 120.815 0.34 . . . . 0.0 111.195 -178.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -68.2 142.0 54.1 Favored 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 122.843 2.362 . . . . 0.0 111.176 174.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.27 -27.4 4.78 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.921 -0.657 . . . . 0.0 111.668 179.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.432 HD22 ' HD2' ' A' ' 21' ' ' TYR . 5.2 mp -76.39 127.11 85.4 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-O 120.626 0.25 . . . . 0.0 110.768 178.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.851 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 82.9 Cg_exo -53.43 160.88 4.5 Favored 'Trans proline' 0 N--CA 1.477 0.543 0 C-N-CA 123.833 3.022 . . . . 0.0 113.578 177.024 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 m -63.58 103.77 0.57 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.449 176.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 128.61 -22.08 5.27 Favored Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 111.253 -0.739 . . . . 0.0 111.253 -176.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.851 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 71.0 m95 -86.43 141.51 29.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.921 0.391 . . . . 0.0 110.264 178.638 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -136.52 150.16 48.51 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 176.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.49 145.5 31.73 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 177.034 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -145.26 -175.13 4.58 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.998 0.427 . . . . 0.0 109.997 176.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.5 mttt -139.21 152.99 47.8 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.873 -178.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.492 ' OD1' ' HB2' ' A' ' 18' ' ' ARG . 1.0 OUTLIER -91.49 19.93 5.76 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.289 0.566 . . . . 0.0 110.398 178.936 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 78.46 -27.96 0.16 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 114.626 -1.17 . . . . 0.0 111.599 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.54 42.06 1.14 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.824 0.821 . . . . 0.0 111.394 -176.269 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.93 -31.53 3.07 Favored Glycine 0 C--N 1.32 -0.351 0 CA-C-N 114.596 -1.184 . . . . 0.0 113.511 175.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.492 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 0.1 OUTLIER -62.94 122.76 16.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.111 0.482 . . . . 0.0 111.135 -174.591 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 25.5 m -103.83 116.85 33.05 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.41 -178.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.8 p90 -120.32 154.56 34.84 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.946 0.403 . . . . 0.0 109.929 178.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.432 ' HD2' HD22 ' A' ' 5' ' ' LEU . 79.7 m-85 -105.95 121.17 43.56 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.406 0.622 . . . . 0.0 110.34 -176.069 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 p -115.2 110.97 33.87 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 CA-C-O 121.787 0.803 . . . . 0.0 110.126 -176.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -89.88 122.48 32.97 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.319 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -89.99 -25.87 20.64 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.042 -175.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.46 -32.48 60.65 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.759 -177.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -110.81 -0.54 16.92 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.751 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 58.06 45.9 17.11 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.436 178.043 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -113.09 144.82 41.97 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.612 -176.006 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.64 100.84 7.69 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 173.847 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.402 ' HB ' ' HZ3' ' A' ' 9' ' ' TRP . 1.1 m -115.99 127.19 54.74 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.44 -168.111 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -95.08 59.56 2.28 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.565 0.698 . . . . 0.0 109.118 175.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -167.61 145.33 4.55 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.9 -172.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.31 117.55 53.48 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-O 120.966 0.412 . . . . 0.0 110.596 178.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_endo -62.33 134.62 49.48 Favored 'Trans proline' 0 C--O 1.237 0.433 0 C-N-CA 123.153 2.569 . . . . 0.0 113.112 -177.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -103.1 -12.82 8.83 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.469 0 CA-C-O 121.67 0.748 . . . . 0.0 110.151 178.005 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.311 -1.069 0 CA-C-N 114.005 -1.452 . . . . 0.0 109.207 179.244 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.723 0 N-CA-C 112.073 -0.411 . . . . 0.0 112.073 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -62.17 -49.16 85.91 Favored Pre-proline 0 CA--C 1.538 0.491 0 N-CA-C 111.432 0.16 . . . . 0.0 111.432 178.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -76.95 -135.03 0.02 OUTLIER 'Trans proline' 0 C--N 1.357 0.977 0 C-N-CA 122.273 1.982 . . . . 0.0 111.397 174.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -70.0 -63.52 3.27 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.686 -0.768 . . . . 0.0 111.634 176.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.563 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 18.0 mt -127.03 155.8 75.32 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 110.486 -0.191 . . . . 0.0 110.486 177.206 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.806 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 77.9 Cg_exo -56.63 152.78 39.34 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.809 2.34 . . . . 0.0 111.105 170.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.6 92.35 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.471 0.653 . . . . 0.0 110.308 177.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.43 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 141.25 -16.49 2.73 Favored Glycine 0 N--CA 1.443 -0.876 0 CA-C-N 115.683 -0.689 . . . . 0.0 112.359 -176.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.806 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 91.6 m95 -97.86 137.94 35.96 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 109.236 -0.654 . . . . 0.0 109.236 177.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -126.89 127.97 45.75 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -91.29 110.31 21.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.763 0.792 . . . . 0.0 110.408 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.922 ' HG3' HG11 ' A' ' 22' ' ' VAL . 1.8 mtt180 -100.73 168.2 9.83 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.431 -178.158 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.695 ' HB3' ' HA2' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -128.09 98.16 5.02 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.047 0.451 . . . . 0.0 110.046 -177.505 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.453 ' HB2' ' CE1' ' A' ' 20' ' ' TYR . 23.7 t70 -80.67 134.05 35.81 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.619 -174.325 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 62.72 -99.97 0.09 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.088 173.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.68 -6.81 59.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.968 0.413 . . . . 0.0 111.074 -176.091 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.695 ' HA2' ' HB3' ' A' ' 13' ' ' LYS . . . 118.71 25.47 2.83 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.533 -0.841 . . . . 0.0 111.902 -177.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.404 ' HB3' ' HZ3' ' A' ' 31' ' ' TRP . 11.9 mtm180 -72.21 112.64 8.47 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 176.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.611 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 2.7 m -76.19 124.66 27.81 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.137 0.494 . . . . 0.0 112.249 -174.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.453 ' CE1' ' HB2' ' A' ' 14' ' ' ASP . 43.5 p90 -132.59 158.84 41.18 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.266 173.482 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -108.58 121.31 44.72 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.265 0.555 . . . . 0.0 111.316 -174.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.922 HG11 ' HG3' ' A' ' 12' ' ' ARG . 2.5 p -116.34 109.32 27.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.026 -178.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.437 ' O ' ' HA ' ' A' ' 27' ' ' ARG . 17.7 t-20 -79.13 131.33 36.19 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 177.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 62.5 m-70 -94.24 -7.97 40.52 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -170.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -91.24 -54.87 3.75 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.35 0.595 . . . . 0.0 109.716 177.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 32.2 t-20 -89.53 -6.12 56.66 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.457 -179.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.459 ' HD2' ' HA ' ' A' ' 27' ' ' ARG . 0.5 OUTLIER 58.77 32.25 22.02 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.495 178.074 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.72 124.35 32.89 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.16 0.505 . . . . 0.0 110.818 178.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.3 98.44 7.98 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.77 178.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.414 HG22 ' CZ3' ' A' ' 9' ' ' TRP . 3.6 t -117.55 143.75 45.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.278 0.561 . . . . 0.0 111.743 -172.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.404 ' HZ3' ' HB3' ' A' ' 18' ' ' ARG . 80.6 m95 -101.48 42.24 1.14 Allowed 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 172.72 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -140.57 151.07 44.42 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.736 -1.12 . . . . 0.0 109.283 -174.132 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.486 ' HA ' ' HD2' ' A' ' 33' ' ' ARG . 1.1 mmm180 -75.77 117.43 63.6 Favored Pre-proline 0 C--N 1.322 -0.616 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 177.065 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -54.12 122.26 11.12 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 123.086 2.524 . . . . 0.0 111.956 -178.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -88.77 41.01 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 121.737 0.779 . . . . 0.0 110.876 -176.007 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.308 -1.197 0 CA-C-N 114.429 -1.259 . . . . 0.0 108.806 -178.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.584 0 N-CA-C 111.859 -0.496 . . . . 0.0 111.859 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.472 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.1 OUTLIER -80.24 124.57 82.55 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-O 120.754 0.311 . . . . 0.0 110.787 -178.94 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.472 ' HD3' ' HA ' ' A' ' 2' ' ' SER . 0.9 OUTLIER -83.0 -141.34 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.811 0 C-N-CA 122.943 2.429 . . . . 0.0 112.272 -179.774 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.456 ' H ' ' HB2' ' A' ' 3' ' ' PRO . . . 117.15 -31.54 5.8 Favored Glycine 0 N--CA 1.449 -0.451 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 -177.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.678 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 19.9 mt -84.26 152.69 61.79 Favored Pre-proline 0 C--N 1.324 -0.514 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 176.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.884 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 79.8 Cg_exo -54.66 160.47 7.25 Favored 'Trans proline' 0 C--O 1.237 0.437 0 C-N-CA 122.827 2.352 . . . . 0.0 111.736 173.725 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.55 88.54 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.746 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 137.3 -8.93 3.79 Favored Glycine 0 N--CA 1.442 -0.907 0 C-N-CA 120.33 -0.938 . . . . 0.0 113.304 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.884 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 88.0 m95 -95.63 140.58 30.24 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 117.869 0.834 . . . . 0.0 109.936 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -131.65 140.58 49.4 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -179.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -93.24 138.03 32.01 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.026 0.441 . . . . 0.0 110.96 -177.385 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.481 ' HG3' HG11 ' A' ' 22' ' ' VAL . 3.8 mtt180 -132.26 175.83 8.92 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.224 174.145 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 7.7 mptt -130.09 160.89 32.37 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 121.188 0.518 . . . . 0.0 111.128 -175.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -91.22 8.28 36.61 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.683 178.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 72.53 7.78 5.62 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.937 178.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.1 mttp -116.82 -32.89 4.97 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.124 0.488 . . . . 0.0 110.128 175.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 145.19 8.34 0.36 Allowed Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.009 177.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.03 126.78 44.82 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.9 0.35 . . . . 0.0 110.212 177.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.406 HG22 ' O ' ' A' ' 12' ' ' ARG . 0.2 OUTLIER -102.86 120.91 41.44 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.384 -176.898 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 29.8 p90 -115.89 164.48 14.35 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 175.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -110.3 126.26 54.01 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.062 0.458 . . . . 0.0 111.063 -175.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.481 HG11 ' HG3' ' A' ' 12' ' ' ARG . 2.6 p -118.93 115.16 47.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-O 121.647 0.736 . . . . 0.0 110.263 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 41.1 t-20 -91.3 107.98 19.57 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.33 -0.85 . . . . 0.0 108.981 178.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -78.64 -5.4 52.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.762 0.315 . . . . 0.0 111.306 -173.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -100.26 -29.41 12.46 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.868 0.366 . . . . 0.0 110.536 -177.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -107.69 -3.9 18.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.773 178.741 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.424 HH11 ' HD2' ' A' ' 27' ' ' ARG . 0.0 OUTLIER 57.7 54.19 6.51 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.197 -179.357 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.22 130.22 49.25 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.984 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.432 HG22 ' HB ' ' A' ' 22' ' ' VAL . 0.0 OUTLIER -117.9 101.0 7.94 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 176.638 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.404 HG23 ' O ' ' A' ' 32' ' ' THR . 10.7 t -116.09 148.4 40.29 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.221 0.534 . . . . 0.0 111.848 -173.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.3 m95 -99.52 14.88 28.37 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.374 -0.83 . . . . 0.0 108.782 172.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.404 ' O ' HG23 ' A' ' 30' ' ' THR . 0.4 OUTLIER -105.66 153.62 21.57 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 114.868 -1.06 . . . . 0.0 109.796 -179.664 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.9 116.73 66.85 Favored Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -69.7 87.61 0.54 Allowed 'Trans proline' 0 N--CA 1.462 -0.371 0 C-N-CA 122.844 2.362 . . . . 0.0 112.274 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -83.77 6.93 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.982 0.896 . . . . 0.0 109.944 177.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 2.3 ttm . . . . . 0 C--N 1.311 -1.069 0 CA-C-N 113.969 -1.469 . . . . 0.0 108.848 178.164 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.798 0 N-CA-C 112.037 -0.425 . . . . 0.0 112.037 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.1 m 58.02 71.94 0.96 Allowed Pre-proline 0 N--CA 1.466 0.33 0 C-N-CA 122.874 0.47 . . . . 0.0 111.187 -178.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -64.17 -39.67 29.79 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.877 2.385 . . . . 0.0 112.341 -178.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.13 111.45 1.7 Allowed Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 111.07 -0.812 . . . . 0.0 111.07 -177.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.713 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 30.1 mt -132.54 164.8 40.97 Favored Pre-proline 0 C--N 1.323 -0.586 0 O-C-N 122.881 -0.187 . . . . 0.0 111.294 -174.166 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.78 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 81.2 Cg_exo -59.78 35.7 0.05 OUTLIER 'Trans proline' 0 N--CA 1.486 1.088 0 C-N-CA 124.444 3.429 . . . . 0.0 115.417 175.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.441 ' H ' ' C ' ' A' ' 5' ' ' LEU . 70.8 m 68.14 -54.27 0.52 Allowed 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 123.629 0.771 . . . . 0.0 112.54 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -80.06 -2.16 88.51 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 121.099 -0.572 . . . . 0.0 112.374 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.78 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 83.5 m95 -102.29 138.42 39.25 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -129.52 139.08 51.65 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.898 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -87.67 137.79 32.03 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.888 0.375 . . . . 0.0 110.092 178.219 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 12' ' ' ARG . 1.4 mtp85 -135.87 -177.21 4.59 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.302 176.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.64 142.63 51.3 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.679 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.07 -172.71 2.9 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.688 -178.431 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.24 -36.17 75.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.493 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 19.5 mttm -73.91 -54.39 8.05 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 134.13 20.81 0.81 Allowed Glycine 0 N--CA 1.444 -0.767 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.366 178.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -83.94 147.47 27.46 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 110.34 -0.245 . . . . 0.0 110.34 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -82.29 105.41 13.34 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.818 0.342 . . . . 0.0 111.022 178.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 42.0 p90 -109.24 152.96 24.5 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 172.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -107.56 123.69 48.82 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.289 0.566 . . . . 0.0 110.478 -174.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.4 p -117.02 114.91 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.612 -177.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.405 ' HB2' ' CD2' ' A' ' 9' ' ' TRP . 26.5 t-20 -82.43 122.24 27.77 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.982 -1.008 . . . . 0.0 108.334 174.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -83.96 -42.95 15.72 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -168.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.28 -42.12 72.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.785 0.326 . . . . 0.0 110.996 -176.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -87.77 -10.76 50.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.568 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 56.62 54.75 7.04 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.996 -179.048 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -116.46 134.19 55.15 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.496 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.63 111.57 17.81 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.424 -179.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.497 HG21 ' CZ3' ' A' ' 9' ' ' TRP . 6.5 t -127.27 153.33 46.27 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.568 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 44.9 m95 -104.33 14.96 29.25 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.359 0.599 . . . . 0.0 109.611 178.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -117.89 165.15 14.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.237 178.608 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 12.6 mtp85 -86.83 113.56 53.81 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-O 120.734 0.302 . . . . 0.0 110.798 179.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -73.35 136.12 23.57 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 C-N-CA 122.807 2.338 . . . . 0.0 112.419 178.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -116.4 8.71 7.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.579 0.704 . . . . 0.0 110.712 -179.046 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.077 0 CA-C-N 114.557 -1.201 . . . . 0.0 109.651 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.817 0 N-CA-C 111.851 -0.5 . . . . 0.0 111.851 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -105.13 105.04 50.22 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 176.426 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -71.88 -175.33 1.62 Allowed 'Trans proline' 0 C--O 1.235 0.344 0 C-N-CA 122.818 2.345 . . . . 0.0 112.131 -178.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -78.53 54.41 4.04 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.881 -0.676 . . . . 0.0 111.68 177.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.696 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 19.8 mt -133.1 152.95 80.56 Favored Pre-proline 0 N--CA 1.447 -0.609 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 -176.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.888 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 87.3 Cg_exo -53.58 150.9 26.26 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 122.733 2.289 . . . . 0.0 111.104 171.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 m -59.97 93.89 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.156 0.503 . . . . 0.0 110.847 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 139.67 -18.83 2.99 Favored Glycine 0 N--CA 1.44 -1.056 0 C-N-CA 120.917 -0.658 . . . . 0.0 112.307 -177.045 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.888 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 93.9 m95 -93.26 139.16 30.93 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 179.534 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -128.51 130.83 48.05 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.72 179.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.12 126.22 32.89 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 178.107 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.403 ' O ' ' HA ' ' A' ' 19' ' ' THR . 59.7 mtp85 -138.57 173.79 11.22 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.389 -178.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.476 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -136.03 116.11 13.35 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.408 -174.415 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.475 ' HB2' ' CE1' ' A' ' 20' ' ' TYR . 6.5 t0 -99.65 152.46 20.04 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.496 -177.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 60.02 -100.0 0.1 Allowed 'General case' 0 N--CA 1.463 0.22 0 O-C-N 123.619 0.575 . . . . 0.0 112.072 176.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.55 53.17 0.94 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.0 0.428 . . . . 0.0 110.823 -175.575 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.64 23.0 57.27 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.863 175.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.476 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 18.6 mmm-85 -76.73 110.86 11.67 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.403 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 1.4 m -81.44 124.61 29.58 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.562 -173.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.475 ' CE1' ' HB2' ' A' ' 14' ' ' ASP . 34.2 p90 -137.0 167.2 21.96 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.181 175.227 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -113.6 121.0 42.86 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-O 121.26 0.552 . . . . 0.0 110.097 -179.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.4 p -111.83 117.56 55.45 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.263 -177.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.403 ' HB2' ' CD2' ' A' ' 9' ' ' TRP . 24.9 t-20 -90.99 126.43 36.08 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.504 -178.932 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -94.92 -8.76 36.16 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -173.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -83.53 -54.34 5.02 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 175.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -91.65 -8.63 46.62 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.065 -176.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 58.38 59.48 2.98 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.34 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.01 142.55 51.2 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.272 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.59 100.93 10.49 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.884 177.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.704 HG23 HG23 ' A' ' 32' ' ' THR . 0.5 OUTLIER -111.78 138.78 47.9 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.05 0.453 . . . . 0.0 111.029 -172.842 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 59.3 m95 -109.89 32.31 5.18 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.502 0.668 . . . . 0.0 109.737 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.704 HG23 HG23 ' A' ' 30' ' ' THR . 1.3 t -137.47 163.94 29.9 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.418 -177.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.448 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 14.4 mmm180 -75.57 115.28 44.29 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-O 121.111 0.482 . . . . 0.0 110.831 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.448 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 6.7 Cg_exo -74.55 127.36 10.94 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 123.427 2.752 . . . . 0.0 112.821 -177.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.1 pt -106.38 10.43 9.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.759 0.79 . . . . 0.0 110.799 176.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.311 -1.094 0 CA-C-N 114.876 -1.056 . . . . 0.0 110.208 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.714 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -85.76 135.81 37.52 Favored Pre-proline 0 C--N 1.322 -0.621 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 176.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -68.16 75.29 0.71 Allowed 'Trans proline' 0 C--O 1.234 0.284 0 C-N-CA 123.189 2.592 . . . . 0.0 112.602 -178.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -107.39 45.08 1.35 Allowed Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.909 178.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.499 ' HA ' HD22 ' A' ' 5' ' ' LEU . 6.1 mt -107.33 172.94 3.39 Favored Pre-proline 0 C--N 1.327 -0.407 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 179.434 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.647 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 51.3 Cg_exo -60.05 164.05 13.01 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.627 2.218 . . . . 0.0 111.204 171.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -50.76 -37.45 42.21 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -175.349 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -102.37 5.86 52.52 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.635 -0.793 . . . . 0.0 114.166 -174.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.647 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 89.5 m95 -104.44 144.43 31.68 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 118.227 1.014 . . . . 0.0 109.964 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -137.31 129.05 28.74 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.962 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.14 116.65 24.47 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 175.637 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.72 -170.36 2.11 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.342 0.592 . . . . 0.0 110.892 -177.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -122.22 126.78 48.97 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.38 -178.052 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.48 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -58.76 -53.14 61.7 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.373 -177.853 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 170.99 -47.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 O-C-N 124.098 0.874 . . . . 0.0 109.038 -178.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.32 37.41 1.18 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.629 -177.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.1 -11.52 42.4 Favored Glycine 0 CA--C 1.517 0.205 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.897 177.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.48 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 14.1 mtt180 -61.27 138.25 58.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.937 0.399 . . . . 0.0 111.145 -177.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -97.16 122.25 39.96 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.892 -177.389 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.5 p90 -133.39 153.25 51.76 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 175.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.532 ' OH ' ' HD3' ' A' ' 33' ' ' ARG . 50.7 m-85 -109.41 119.37 39.25 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.481 0.658 . . . . 0.0 110.391 -176.028 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.2 p -114.84 115.28 49.02 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.188 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.404 -177.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 28.4 t-20 -85.62 111.23 19.87 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.617 175.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -81.28 -10.38 59.59 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.787 -170.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -89.75 -54.83 3.88 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.131 0.491 . . . . 0.0 110.092 -178.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 19.8 t30 -83.96 -4.45 58.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.545 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.4 mtm180 57.41 52.52 8.53 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.013 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.09 134.83 54.76 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.06 0.457 . . . . 0.0 111.304 -178.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.13 104.03 13.9 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.97 179.135 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.484 ' HB ' ' CZ3' ' A' ' 9' ' ' TRP . 0.9 OUTLIER -116.93 129.07 55.82 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.56 -173.626 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.3 m95 -100.31 39.89 1.31 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.356 0.598 . . . . 0.0 110.131 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.411 HG23 ' CG2' ' A' ' 30' ' ' THR . 0.6 OUTLIER -144.79 151.59 39.04 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.849 -176.88 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.532 ' HD3' ' OH ' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -69.14 114.09 21.13 Favored Pre-proline 0 C--N 1.32 -0.705 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 175.178 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 11.4 Cg_exo -70.86 62.06 2.37 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 123.529 2.819 . . . . 0.0 113.593 -176.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 4.1 mm -104.37 62.85 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.766 178.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.313 -0.999 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.546 177.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.734 0 N-CA-C 111.978 -0.449 . . . . 0.0 111.978 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.83 118.5 45.93 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 120.735 0.303 . . . . 0.0 110.582 178.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -79.99 -14.37 12.33 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.764 2.309 . . . . 0.0 112.896 -177.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 65.7 -140.02 39.93 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -173.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 3.6 mp -97.84 118.79 63.53 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 117.232 0.516 . . . . 0.0 111.095 174.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.805 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 89.1 Cg_exo -53.16 163.93 2.03 Favored 'Trans proline' 0 N--CA 1.474 0.343 0 C-N-CA 124.084 3.189 . . . . 0.0 113.05 176.066 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.05 120.07 10.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.353 -0.385 . . . . 0.0 109.967 175.57 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 108.51 -28.75 10.99 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 111.449 -0.66 . . . . 0.0 111.449 -174.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.805 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 64.4 m95 -83.49 117.17 22.91 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 178.015 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -120.64 136.28 54.87 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 175.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.42 140.21 29.83 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 178.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.417 ' HD2' ' OH ' ' A' ' 20' ' ' TYR . 2.8 mtm180 -139.06 -168.38 2.42 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.243 0.544 . . . . 0.0 110.41 -178.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.4 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.3 OUTLIER -140.08 151.2 45.17 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.063 -179.862 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -78.84 -165.93 0.81 Allowed 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 110.313 -0.255 . . . . 0.0 110.313 179.301 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.61 -15.16 63.25 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.027 0.381 . . . . 0.0 112.027 -176.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.413 ' HG3' ' NH2' ' A' ' 18' ' ' ARG . 0.3 OUTLIER -108.08 -44.05 4.26 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.762 0.315 . . . . 0.0 110.807 -178.539 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 140.35 23.11 0.29 Allowed Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.254 -0.974 . . . . 0.0 113.126 178.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.413 ' NH2' ' HG3' ' A' ' 16' ' ' LYS . 12.7 mtm-85 -85.99 144.61 27.51 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 177.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.2 117.95 23.28 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -172.26 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.417 ' OH ' ' HD2' ' A' ' 12' ' ' ARG . 13.9 p90 -129.62 149.48 51.36 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.013 171.278 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -110.21 128.15 55.34 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 120.998 0.427 . . . . 0.0 110.217 -176.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 p -117.11 110.1 30.09 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.879 0.847 . . . . 0.0 110.687 -177.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.497 ' HB2' ' CD2' ' A' ' 9' ' ' TRP . 43.2 t-20 -90.07 112.91 24.52 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.139 178.525 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -71.95 -29.25 64.08 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.642 -174.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -75.36 -57.34 3.95 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.892 0.377 . . . . 0.0 111.132 -174.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -85.82 -5.99 59.16 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.162 -177.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.4 ttm180 62.21 57.63 1.96 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-O 121.241 0.544 . . . . 0.0 111.406 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.23 131.04 53.99 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.889 178.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.53 76.79 1.22 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.461 0.648 . . . . 0.0 109.677 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.6 t -99.27 148.17 24.42 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.835 -170.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.5 m95 -100.23 46.35 0.96 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.575 0.702 . . . . 0.0 109.129 175.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -152.22 157.27 41.22 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.362 -177.196 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.437 ' HA ' ' HD2' ' A' ' 34' ' ' PRO . 0.2 OUTLIER -65.23 125.13 88.75 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-O 120.58 0.228 . . . . 0.0 111.001 178.923 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.437 ' HD2' ' HA ' ' A' ' 33' ' ' ARG . 9.7 Cg_endo -52.0 111.16 0.54 Allowed 'Trans proline' 0 CA--C 1.53 0.283 0 C-N-CA 123.711 2.941 . . . . 0.0 113.242 178.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -116.63 1.77 7.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.765 0.793 . . . . 0.0 110.287 177.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.7 ttm . . . . . 0 C--O 1.251 1.16 0 CA-C-N 114.269 -1.332 . . . . 0.0 109.958 179.945 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.599 0 N-CA-C 111.733 -0.547 . . . . 0.0 111.733 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -49.99 90.54 Favored Pre-proline 0 CA--C 1.54 0.595 0 N-CA-C 112.257 0.465 . . . . 0.0 112.257 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -74.39 62.55 5.32 Favored 'Trans proline' 0 C--N 1.357 0.991 0 C-N-CA 122.3 2.0 . . . . 0.0 112.096 176.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 167.79 97.8 0.12 Allowed Glycine 0 N--CA 1.448 -0.56 0 N-CA-C 110.908 -0.877 . . . . 0.0 110.908 179.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.716 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 67.3 mt -59.02 138.26 87.75 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -170.513 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.808 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 81.2 Cg_exo -55.68 167.67 2.03 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 124.249 3.299 . . . . 0.0 112.855 172.76 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.66 95.71 0.11 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.62 178.008 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 134.42 -22.97 3.67 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.614 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.808 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 88.2 m95 -86.08 129.83 34.72 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 -177.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -122.75 130.41 52.9 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.434 -177.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -87.29 119.63 27.75 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.941 0.401 . . . . 0.0 110.064 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.438 HH11 ' HD3' ' A' ' 12' ' ' ARG . 44.3 mtt180 -126.04 -179.35 4.66 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.991 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.8 mtmp? -140.7 150.69 43.78 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.772 -179.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -93.05 -175.49 3.88 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.006 176.349 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.71 -26.13 68.52 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -177.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.7 mtmp? -87.69 -8.81 55.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.084 0.469 . . . . 0.0 110.432 178.566 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 90.35 20.95 39.66 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.811 175.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -81.39 123.27 28.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.832 0.316 . . . . 0.0 110.242 177.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -72.75 123.54 23.52 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.409 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.466 ' HB3' ' CE3' ' A' ' 31' ' ' TRP . 37.2 p90 -129.89 155.05 46.67 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 174.23 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -105.93 117.74 34.8 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.38 -176.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 p -109.94 107.07 21.98 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.203 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.465 ' HB2' ' CD2' ' A' ' 9' ' ' TRP . 55.8 t-20 -84.89 112.56 20.67 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.756 178.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -83.91 -16.49 44.08 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.213 0.53 . . . . 0.0 109.911 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -73.57 -54.2 8.75 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.382 178.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.448 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 4.4 t30 -107.44 28.16 8.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.16 -177.609 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.448 ' HG2' ' O ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER 37.41 51.7 1.19 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.151 0.981 . . . . 0.0 113.047 178.227 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.64 132.34 54.61 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.017 0.437 . . . . 0.0 111.219 -176.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -119.6 104.4 10.25 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 178.544 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.455 HG21 ' O ' ' A' ' 32' ' ' THR . 3.9 t -126.11 148.01 49.47 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.084 0.469 . . . . 0.0 111.252 -174.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.466 ' CE3' ' HB3' ' A' ' 20' ' ' TYR . 33.9 m95 -99.87 -5.58 28.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.637 177.161 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.455 ' O ' HG21 ' A' ' 30' ' ' THR . 2.4 t -95.5 165.81 12.17 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.711 177.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.64 130.21 87.52 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 177.333 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -51.01 149.45 15.04 Favored 'Trans proline' 0 C--O 1.236 0.384 0 C-N-CA 123.128 2.552 . . . . 0.0 112.648 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 5.4 mm -82.13 71.95 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.685 0.755 . . . . 0.0 110.559 -176.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.309 -1.154 0 CA-C-N 115.021 -0.99 . . . . 0.0 109.531 176.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.74 0 N-CA-C 111.984 -0.446 . . . . 0.0 111.984 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.73 105.64 28.14 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 178.562 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -84.2 54.21 4.21 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.807 2.338 . . . . 0.0 112.506 -177.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 89.32 -21.94 25.99 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.153 -178.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.844 HD11 ' HG2' ' A' ' 11' ' ' GLU . 22.7 mt -118.46 151.26 49.39 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 177.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.901 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 72.2 Cg_exo -55.83 155.56 22.19 Favored 'Trans proline' 0 C--O 1.236 0.391 0 C-N-CA 122.526 2.151 . . . . 0.0 111.141 171.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.82 99.72 0.17 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.959 0.409 . . . . 0.0 110.16 -179.47 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 132.97 -19.01 4.44 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.472 -177.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.901 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 90.9 m95 -91.51 135.84 33.56 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -126.95 132.23 50.89 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.756 -177.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.844 ' HG2' HD11 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -90.14 114.62 26.61 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.167 0.508 . . . . 0.0 110.365 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 48.6 mtt180 -109.31 -178.85 3.67 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.647 178.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -136.55 144.02 43.98 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.433 -179.348 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -96.96 171.46 8.48 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.45 176.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.11 -26.28 68.2 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -176.434 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.409 ' HA ' ' HD2' ' A' ' 16' ' ' LYS . 22.9 mmmt -84.66 -4.34 58.96 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.851 0.358 . . . . 0.0 110.686 -179.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.23 12.66 55.96 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.346 177.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 4.0 mmp_? -81.0 144.83 31.51 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 179.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.7 m -98.9 120.5 39.44 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.438 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.0 p90 -124.58 148.31 47.92 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 176.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 58.0 m-85 -105.33 122.08 45.21 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.633 0.73 . . . . 0.0 110.683 -174.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 p -115.92 113.86 44.5 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.099 -177.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 37.7 t-20 -89.48 117.35 28.33 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.147 178.477 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 78.9 m-70 -83.93 -20.79 32.35 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.362 -174.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -84.67 -41.78 15.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.081 0.467 . . . . 0.0 110.434 -179.037 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -95.75 -1.21 50.29 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.96 -178.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 56.21 40.77 29.93 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.701 177.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.67 141.82 47.7 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.858 0.361 . . . . 0.0 111.352 -176.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.42 109.75 14.26 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.255 178.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.48 HG22 ' CZ3' ' A' ' 9' ' ' TRP . 2.6 t -127.62 151.46 48.9 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.017 0.437 . . . . 0.0 110.987 -177.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 47.2 m95 -103.19 12.93 35.08 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.312 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -109.24 158.76 17.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.576 -178.127 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.432 HH11 ' HD3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -85.21 116.69 66.54 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-O 120.769 0.318 . . . . 0.0 111.161 178.209 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -82.5 132.27 6.75 Favored 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 122.639 2.226 . . . . 0.0 111.55 175.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.456 HD12 HG23 ' A' ' 35' ' ' ILE . 0.0 OUTLIER -117.37 15.35 7.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 121.79 0.805 . . . . 0.0 110.551 -177.414 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.308 -1.211 0 CA-C-N 114.462 -1.245 . . . . 0.0 109.296 178.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.652 0 N-CA-C 111.865 -0.494 . . . . 0.0 111.865 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.1 m -115.45 91.7 29.89 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-O 121.027 0.441 . . . . 0.0 110.53 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -68.95 104.66 1.22 Allowed 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 122.857 2.371 . . . . 0.0 112.104 -177.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 71.89 26.47 72.58 Favored Glycine 0 N--CA 1.447 -0.609 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.44 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.554 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 20.6 mt -138.65 155.13 73.6 Favored Pre-proline 0 N--CA 1.451 -0.405 0 CA-C-O 120.749 0.309 . . . . 0.0 111.102 -179.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.799 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 74.2 Cg_exo -56.8 162.65 8.4 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.922 2.415 . . . . 0.0 111.274 169.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -14.61 9.69 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -176.002 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -108.48 -1.98 32.94 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.424 -0.894 . . . . 0.0 113.406 -177.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.799 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 80.0 m95 -104.34 138.61 40.51 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 117.932 0.866 . . . . 0.0 110.676 -176.402 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -121.48 133.94 55.05 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.43 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.06 120.15 32.42 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.159 0.504 . . . . 0.0 110.374 -179.139 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.497 ' HG3' ' CG1' ' A' ' 22' ' ' VAL . 0.8 OUTLIER -115.61 165.63 12.82 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.691 177.203 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -114.28 135.76 53.72 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.861 -177.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.446 ' O ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -66.91 -57.71 6.41 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.952 178.9 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.446 ' HB2' ' O ' ' A' ' 14' ' ' ASP . . . 168.07 -48.64 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.296 0 O-C-N 123.958 0.786 . . . . 0.0 109.583 -178.432 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.59 45.9 1.0 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.686 0.755 . . . . 0.0 110.901 -175.176 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.26 -17.46 18.29 Favored Glycine 0 C--N 1.317 -0.5 0 CA-C-N 114.816 -1.084 . . . . 0.0 113.227 176.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -65.02 118.14 8.68 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.931 0.396 . . . . 0.0 110.664 -178.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.421 HG22 ' O ' ' A' ' 12' ' ' ARG . 0.9 OUTLIER -102.89 130.61 49.99 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.496 -179.521 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 37.6 p90 -124.13 161.73 25.04 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.129 0.49 . . . . 0.0 110.322 176.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 33.6 m-85 -108.47 117.52 34.38 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.43 -174.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.497 ' CG1' ' HG3' ' A' ' 12' ' ' ARG . 3.7 p -115.53 115.65 50.01 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 CA-C-O 121.822 0.82 . . . . 0.0 109.695 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.652 ' HB3' HG23 ' A' ' 28' ' ' THR . 29.3 t-20 -90.22 108.45 19.76 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.771 -177.152 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -88.25 38.68 0.87 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.179 0.514 . . . . 0.0 111.042 -176.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -137.3 -47.76 0.58 Allowed 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 178.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -92.54 -8.35 44.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.115 174.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.93 56.8 2.75 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.678 177.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.652 HG23 ' HB3' ' A' ' 23' ' ' ASN . 0.6 OUTLIER -127.61 155.35 44.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.168 0.509 . . . . 0.0 111.192 177.998 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.44 102.94 8.58 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.151 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.663 ' HB ' ' HZ3' ' A' ' 9' ' ' TRP . 0.9 OUTLIER -120.17 136.88 54.47 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.198 -169.519 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 58.0 m95 -101.99 -19.32 15.26 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.052 0.453 . . . . 0.0 110.238 178.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.4 t -79.63 163.0 24.94 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.731 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.426 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 8.2 mpt_? -78.06 120.92 83.07 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 176.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.426 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 16.1 Cg_exo -67.01 126.47 15.25 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.769 2.313 . . . . 0.0 111.773 179.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 3.5 mm -84.69 68.16 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.8 0.81 . . . . 0.0 110.44 -178.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.432 ' HG2' ' HB3' ' A' ' 6' ' ' PRO . 0.7 OUTLIER . . . . . 0 C--N 1.31 -1.138 0 CA-C-N 114.92 -1.036 . . . . 0.0 109.291 178.267 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.703 0 N-CA-C 111.952 -0.459 . . . . 0.0 111.952 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.453 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.3 OUTLIER -69.44 133.28 89.15 Favored Pre-proline 0 C--N 1.328 -0.366 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 177.859 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 2' ' ' SER . 2.7 Cg_exo -75.65 62.93 6.48 Favored 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 123.13 2.553 . . . . 0.0 112.116 179.271 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.71 127.7 8.12 Favored Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 176.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.674 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 7.4 mt -63.98 148.16 95.45 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-O 120.816 0.341 . . . . 0.0 110.859 -176.537 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.893 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 50.9 Cg_exo -61.02 -161.47 0.03 OUTLIER 'Trans proline' 0 N--CA 1.474 0.33 0 C-N-CA 124.034 3.156 . . . . 0.0 114.016 -179.791 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.9 94.2 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.945 -1.025 . . . . 0.0 112.55 -174.703 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 77.66 18.43 77.47 Favored Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 121.003 -0.618 . . . . 0.0 113.727 173.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.893 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 74.6 m95 -82.63 129.19 34.9 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 176.549 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -132.38 136.76 47.03 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 121.174 -0.21 . . . . 0.0 110.659 -179.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -90.34 117.27 28.93 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.456 0.646 . . . . 0.0 109.602 174.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.497 ' O ' ' HA ' ' A' ' 19' ' ' THR . 0.0 OUTLIER -110.17 -174.84 2.58 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.543 -179.614 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.33 130.19 26.22 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.618 -178.16 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.661 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . 35.0 t70 -81.47 55.01 2.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.221 177.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 67.77 -58.19 0.44 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.845 0.858 . . . . 0.0 112.656 178.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.63 30.01 0.66 Allowed 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 122.611 0.365 . . . . 0.0 111.708 -174.666 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 77.17 7.89 86.87 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 120.959 -0.639 . . . . 0.0 113.079 177.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.661 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 0.1 OUTLIER -74.06 99.06 3.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.668 0.271 . . . . 0.0 110.315 178.613 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.497 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 30.3 m -72.86 121.68 20.37 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.329 0.585 . . . . 0.0 112.168 -177.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.47 ' HB3' ' CE3' ' A' ' 31' ' ' TRP . 28.3 p90 -126.85 142.76 51.46 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.39 -0.823 . . . . 0.0 108.796 171.125 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.452 ' CE1' ' HG3' ' A' ' 33' ' ' ARG . 74.2 m-85 -98.39 120.59 39.08 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.695 0.76 . . . . 0.0 110.21 -176.659 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.4 HG11 ' HG3' ' A' ' 12' ' ' ARG . 2.3 p -111.98 117.0 54.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.276 -177.423 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -89.04 120.03 30.09 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.472 -0.785 . . . . 0.0 108.963 177.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -82.32 -22.24 35.69 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.78 -173.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -76.88 -47.82 20.1 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.251 -174.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -107.59 7.49 28.7 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.928 0.394 . . . . 0.0 110.726 178.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 54.03 45.2 28.08 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.399 178.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.88 135.0 35.66 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.305 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.77 108.7 12.8 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.629 -179.464 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 12.4 t -127.51 149.61 50.05 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.126 0.488 . . . . 0.0 110.701 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.47 ' CE3' ' HB3' ' A' ' 20' ' ' TYR . 49.1 m95 -102.77 21.51 15.36 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.569 0.7 . . . . 0.0 109.203 177.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -118.9 160.71 21.44 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 114.911 -1.041 . . . . 0.0 109.367 175.247 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.452 ' HG3' ' CE1' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -78.43 120.97 83.05 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-O 120.681 0.277 . . . . 0.0 110.288 179.101 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -66.67 120.22 7.31 Favored 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.65 2.233 . . . . 0.0 112.332 -178.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -106.1 33.06 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 122.063 0.935 . . . . 0.0 109.184 174.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.418 ' O ' ' HG2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.121 0 CA-C-N 113.703 -1.589 . . . . 0.0 108.1 -178.134 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.45 ' H1 ' ' CD ' ' A' ' 11' ' ' GLU . . . . . . . . 0 N--CA 1.482 1.744 0 N-CA-C 111.375 -0.69 . . . . 0.0 111.375 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.447 ' CB ' ' HD3' ' A' ' 3' ' ' PRO . 0.1 OUTLIER -71.31 -52.44 8.96 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 174.116 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.447 ' HD3' ' CB ' ' A' ' 2' ' ' SER . 4.2 Cg_exo -78.71 161.26 27.7 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 122.098 1.866 . . . . 0.0 110.731 169.256 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -112.53 168.1 12.56 Favored Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.567 -0.825 . . . . 0.0 111.924 -178.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.562 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 17.9 mt -114.75 151.42 45.37 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-O 120.723 0.297 . . . . 0.0 110.856 179.71 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.785 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 83.6 Cg_exo -53.7 144.34 54.05 Favored 'Trans proline' 0 CA--C 1.52 -0.198 0 C-N-CA 122.901 2.401 . . . . 0.0 110.774 170.744 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.0 m -58.12 92.38 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.29 0.567 . . . . 0.0 110.214 178.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.454 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 145.75 -29.21 1.72 Allowed Glycine 0 N--CA 1.438 -1.204 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.515 -173.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.785 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 93.2 m95 -90.64 131.07 36.55 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 176.639 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -124.04 117.44 24.73 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -179.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.45 ' CD ' ' H1 ' ' A' ' 1' ' ' GLY . 2.4 pt-20 -81.8 103.55 11.56 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 121.66 0.743 . . . . 0.0 110.098 176.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.2 mtt-85 -107.94 174.88 5.68 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.638 -1.164 . . . . 0.0 109.105 -178.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.91 128.77 54.73 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 120.937 0.398 . . . . 0.0 110.467 -176.073 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -99.46 -2.97 34.66 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.609 0.719 . . . . 0.0 109.416 -179.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.438 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . . . -159.76 -156.41 0.5 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.909 -1.041 . . . . 0.0 109.915 -179.18 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.57 32.58 0.65 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.239 0.543 . . . . 0.0 111.188 -174.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 149.63 -6.81 0.78 Allowed Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.23 -177.624 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.438 ' HB2' ' HB3' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -79.16 101.44 7.93 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 175.533 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.53 134.87 36.61 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.124 -176.904 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 28.1 p90 -134.36 155.92 49.42 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.412 176.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -106.45 113.71 27.39 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.352 0.596 . . . . 0.0 110.622 -175.497 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 p -108.55 111.17 34.83 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.208 -179.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.454 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 23.8 t-20 -82.21 121.77 27.06 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 178.1 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 59.8 m-70 -84.19 -17.86 38.54 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -169.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.7 p30 -95.34 -37.69 10.85 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.269 -0.572 . . . . 0.0 110.874 -179.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 19.5 t30 -93.75 -2.81 53.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.537 -0.302 . . . . 0.0 110.625 178.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 26.4 mtm180 55.58 45.89 23.97 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.461 176.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.04 131.61 56.31 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.108 0.48 . . . . 0.0 111.22 -178.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -111.35 96.34 6.06 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.955 -178.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.592 HG23 ' CZ3' ' A' ' 9' ' ' TRP . 1.8 t -116.46 145.38 43.33 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.238 0.542 . . . . 0.0 111.434 -175.22 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 31.8 m95 -99.85 7.9 44.58 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 171.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.528 ' O ' HG21 ' A' ' 30' ' ' THR . 0.8 OUTLIER -97.2 144.57 26.89 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.522 -177.626 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.446 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 8.9 mmm180 -67.99 119.54 67.75 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-O 120.74 0.305 . . . . 0.0 111.213 177.776 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.446 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 6.7 Cg_exo -72.82 66.83 3.95 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 123.428 2.752 . . . . 0.0 112.518 178.068 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 11.4 mt 72.66 -60.92 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.707 -179.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 4.6 ttm . . . . . 0 C--N 1.305 -1.351 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.668 -177.583 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.819 0 N-CA-C 111.595 -0.602 . . . . 0.0 111.595 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.57 -54.94 51.05 Favored Pre-proline 0 CA--C 1.537 0.474 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -177.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -65.25 -19.56 62.29 Favored 'Trans proline' 0 C--N 1.359 1.123 0 C-N-CA 121.72 1.613 . . . . 0.0 112.273 178.299 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 81.14 -64.19 4.19 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.201 -178.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.747 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 28.3 mt -140.48 173.83 4.58 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-O 119.544 -0.265 . . . . 0.0 110.364 -176.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.754 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 87.3 Cg_exo -58.41 42.16 0.05 OUTLIER 'Trans proline' 0 N--CA 1.489 1.229 0 C-N-CA 124.627 3.552 . . . . 0.0 115.749 176.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.8 m 66.43 -59.45 0.34 Allowed 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.993 0.917 . . . . 0.0 112.752 177.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -73.46 -19.59 79.7 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 121.194 -0.527 . . . . 0.0 112.163 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.754 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 93.6 m95 -87.58 137.81 32.02 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 179.699 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -128.23 122.4 31.7 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.926 179.012 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -82.66 117.9 22.94 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.135 0.493 . . . . 0.0 110.021 178.462 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.498 ' O ' ' HA ' ' A' ' 19' ' ' THR . 39.0 mtt180 -122.77 -176.47 3.4 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.887 -178.51 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -133.48 137.84 45.86 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.065 -179.024 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -77.85 -175.9 4.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.667 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.07 -28.53 69.67 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.726 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.8 mmtt -82.28 -27.37 32.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.874 0.369 . . . . 0.0 110.665 177.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 113.14 13.5 10.81 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.686 -0.769 . . . . 0.0 113.136 176.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.484 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.3 OUTLIER -84.95 142.04 29.93 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.848 0.356 . . . . 0.0 110.492 179.258 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.498 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 0.7 OUTLIER -79.11 125.09 28.96 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.339 -178.909 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -127.75 161.3 29.28 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 172.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.451 ' OH ' ' HD2' ' A' ' 33' ' ' ARG . 50.6 m-85 -112.89 111.28 21.92 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.535 0.683 . . . . 0.0 110.712 -173.313 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.0 p -108.51 107.64 23.32 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.035 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.455 -178.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.463 ' HB3' ' OG1' ' A' ' 28' ' ' THR . 54.3 t-20 -82.1 112.8 19.47 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.037 178.139 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -82.15 -17.31 46.79 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.068 0.461 . . . . 0.0 110.368 -176.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -81.44 -41.13 22.29 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.279 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 57.7 m-20 -97.99 -3.25 38.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.042 -178.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 57.76 52.31 8.27 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.982 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' THR . . . . . 0.463 ' OG1' ' HB3' ' A' ' 23' ' ' ASN . 33.8 p -124.25 132.15 53.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.995 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.67 78.87 1.61 Allowed 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 173.333 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.562 ' HB ' ' HZ3' ' A' ' 9' ' ' TRP . 0.9 OUTLIER -91.72 128.98 37.76 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.449 -169.043 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 39.5 m95 -101.61 58.97 0.86 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.27 0.557 . . . . 0.0 109.72 177.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -167.26 146.88 5.25 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.327 -176.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.451 ' HD2' ' OH ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -67.18 114.61 19.38 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-O 120.64 0.257 . . . . 0.0 110.659 177.562 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -73.88 157.23 47.67 Favored 'Trans proline' 0 N--CA 1.463 -0.277 0 C-N-CA 122.853 2.368 . . . . 0.0 112.688 -177.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -96.81 -20.76 5.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.949 0.881 . . . . 0.0 109.538 176.094 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 3.7 tpt . . . . . 0 C--O 1.25 1.121 0 CA-C-N 113.505 -1.679 . . . . 0.0 109.157 179.139 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.656 0 N-CA-C 111.676 -0.57 . . . . 0.0 111.676 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.11 144.06 92.14 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 175.508 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.68 37.91 0.6 Allowed 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 122.846 2.364 . . . . 0.0 113.281 -176.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 79.05 -56.9 4.35 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 121.218 -0.515 . . . . 0.0 112.35 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.77 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 10.5 mt -140.53 156.87 69.19 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.873 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 75.8 Cg_exo -54.35 163.74 3.34 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.855 2.37 . . . . 0.0 112.29 174.421 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.64 94.73 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.361 -177.321 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.401 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 128.38 -17.61 5.86 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.208 178.168 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.873 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 96.5 m95 -87.55 134.47 33.62 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 117.794 0.797 . . . . 0.0 110.165 -177.063 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -125.8 132.66 52.23 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.753 177.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.42 117.74 27.57 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.274 0.559 . . . . 0.0 110.893 -178.998 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.437 ' O ' HG22 ' A' ' 19' ' ' THR . 6.6 ttp85 -121.68 -177.95 3.69 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.523 0.678 . . . . 0.0 110.32 177.744 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.45 129.3 23.2 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.445 -177.103 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -81.7 176.01 9.99 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 120.788 -0.365 . . . . 0.0 110.467 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.16 -19.89 63.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.902 0.382 . . . . 0.0 111.269 -178.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.5 mttp -71.89 -28.15 63.32 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.548 176.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 112.07 -23.29 16.83 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.454 -178.468 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.77 144.3 52.74 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.975 0.417 . . . . 0.0 111.929 -176.15 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.437 HG22 ' O ' ' A' ' 12' ' ' ARG . 0.7 OUTLIER -85.19 138.48 32.34 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.632 179.915 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 49.0 p90 -141.1 162.75 34.75 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 172.645 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -111.93 120.24 41.25 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.134 0.492 . . . . 0.0 110.839 -174.368 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 p -109.22 114.4 46.81 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.01 179.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.418 ' HB2' ' CE3' ' A' ' 9' ' ' TRP . 57.5 t-20 -88.74 113.67 24.55 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.92 -179.535 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -80.72 -16.14 54.69 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.769 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -85.88 -32.96 21.38 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.486 -179.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -104.13 -11.0 17.55 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.2 -178.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 65.1 37.47 6.66 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.0 -179.131 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.64 141.23 51.96 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.953 0.406 . . . . 0.0 111.382 -178.455 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -114.93 93.47 4.33 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.856 178.471 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.6 146.48 25.25 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.289 0.566 . . . . 0.0 111.335 -173.418 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 55.9 m95 -106.93 8.4 30.54 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.834 177.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.7 t -110.28 161.52 15.53 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.81 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.467 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 0.0 OUTLIER -77.03 121.71 85.16 Favored Pre-proline 0 C--N 1.321 -0.64 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 176.447 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 17.6 Cg_exo -65.44 170.7 10.5 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.883 2.389 . . . . 0.0 112.44 -177.036 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -80.87 67.98 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.487 0.661 . . . . 0.0 110.869 -178.421 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 2.2 ttp . . . . . 0 C--O 1.248 0.998 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.784 177.837 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.742 0 N-CA-C 111.77 -0.532 . . . . 0.0 111.77 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.441 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.2 OUTLIER -134.92 143.64 47.03 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-O 120.599 0.238 . . . . 0.0 110.724 -179.709 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.519 ' HB2' ' H ' ' A' ' 4' ' ' GLY . 5.0 Cg_exo -78.29 -117.84 0.01 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 123.194 2.596 . . . . 0.0 111.537 175.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . 0.519 ' H ' ' HB2' ' A' ' 3' ' ' PRO . . . 72.33 84.87 0.22 Allowed Glycine 0 C--N 1.329 0.174 0 C-N-CA 120.987 -0.625 . . . . 0.0 112.526 177.444 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.619 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 27.8 mt -100.93 157.44 33.67 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-O 120.803 0.335 . . . . 0.0 111.583 -177.439 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.671 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 86.4 Cg_exo -54.95 167.15 1.72 Allowed 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 123.426 2.751 . . . . 0.0 111.815 170.493 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.97 -8.28 15.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.837 0.351 . . . . 0.0 111.655 -177.562 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -113.94 -0.56 24.16 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.615 -179.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.671 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 84.2 m95 -109.35 131.18 55.31 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 117.793 0.796 . . . . 0.0 110.001 -178.519 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -114.21 133.17 55.8 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.563 ' HG2' HD11 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -87.19 118.47 26.62 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 178.85 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 12' ' ' ARG . 6.2 mtp180 -114.28 175.54 5.43 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.144 0.497 . . . . 0.0 110.133 179.591 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.4 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -140.3 132.3 27.81 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.933 -178.269 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.405 ' C ' ' H ' ' A' ' 16' ' ' LYS . 23.0 t70 -87.09 27.88 0.98 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.055 -179.153 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 73.01 -34.63 0.3 Allowed 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 123.546 0.738 . . . . 0.0 112.635 176.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.405 ' H ' ' C ' ' A' ' 14' ' ' ASP . 9.5 mttt -90.02 35.27 0.85 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.062 0.458 . . . . 0.0 111.027 -178.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 72.8 5.49 64.7 Favored Glycine 0 C--N 1.328 0.102 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.119 178.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.4 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -83.56 101.76 11.68 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 -177.001 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 4.7 m -90.36 122.25 33.08 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.075 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 37.5 p90 -129.24 158.43 39.07 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.054 0.454 . . . . 0.0 109.999 178.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.416 ' HD1' HD13 ' A' ' 5' ' ' LEU . 46.2 m-85 -105.7 117.7 34.69 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.385 -174.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.7 p -110.98 114.77 48.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.847 0 CA-C-O 121.626 0.726 . . . . 0.0 110.092 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -84.41 126.21 33.04 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.43 -179.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 -84.89 -12.53 53.26 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -171.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -83.32 -59.17 2.55 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.141 0.496 . . . . 0.0 110.042 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -87.89 -15.62 36.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.872 -176.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 69.46 34.73 2.74 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.271 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.5 134.47 33.67 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.702 178.017 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.5 91.66 4.14 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 176.356 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.528 ' HB ' ' HZ3' ' A' ' 9' ' ' TRP . 0.9 OUTLIER -105.85 122.38 45.99 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.354 -168.038 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 67.2 m95 -97.36 40.03 1.17 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.551 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.483 HG21 HG23 ' A' ' 30' ' ' THR . 6.6 t -156.89 172.14 19.18 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.461 -0.79 . . . . 0.0 108.884 -177.44 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.531 ' HA ' ' HD2' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -74.13 134.38 77.47 Favored Pre-proline 0 C--N 1.318 -0.77 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.569 177.911 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -51.64 -177.47 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 123.422 2.748 . . . . 0.0 112.948 174.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 7.1 mm 58.64 43.23 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.094 0 CA-C-O 122.364 1.078 . . . . 0.0 109.517 -167.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 30.4 ttm . . . . . 0 C--O 1.25 1.089 0 CA-C-N 114.159 -1.382 . . . . 0.0 108.808 178.252 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.785 0 N-CA-C 112.223 -0.351 . . . . 0.0 112.223 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.402 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 24.4 m -112.87 109.73 52.43 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-O 120.868 0.366 . . . . 0.0 110.861 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 2' ' ' SER . 10.8 Cg_exo -71.82 127.39 12.95 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 122.94 2.426 . . . . 0.0 111.83 177.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -139.56 -86.12 0.13 Allowed Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.181 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.602 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 14.8 mt -103.71 169.96 6.73 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.982 -0.109 . . . . 0.0 110.823 -178.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.776 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 75.6 Cg_exo -59.32 -167.14 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.363 2.709 . . . . 0.0 113.458 174.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.18 -49.44 75.95 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.233 -0.894 . . . . 0.0 112.713 -174.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.539 ' HA3' ' OD1' ' A' ' 25' ' ' ASN . . . -116.34 19.59 13.01 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 119.968 -1.11 . . . . 0.0 114.309 -172.529 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.776 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 92.5 m95 -100.28 140.25 34.8 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 117.819 0.809 . . . . 0.0 110.125 -179.09 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.511 ' OE1' ' HD2' ' A' ' 12' ' ' ARG . 21.4 tt0 -133.51 125.13 28.25 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 177.438 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -85.2 119.55 25.7 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.941 0.4 . . . . 0.0 110.322 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.511 ' HD2' ' OE1' ' A' ' 10' ' ' GLU . 0.3 OUTLIER -116.6 -166.5 1.16 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.956 178.98 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.492 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.4 OUTLIER -135.1 149.1 49.99 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.634 -174.511 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -78.48 -164.99 0.63 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.261 177.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.46 -20.41 63.1 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -178.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.408 ' HD3' ' HA ' ' A' ' 16' ' ' LYS . 61.5 mmtt -107.47 -50.6 3.05 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.757 0.313 . . . . 0.0 111.217 -178.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 152.97 21.48 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.592 -0.813 . . . . 0.0 113.071 -179.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.492 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -77.63 128.82 34.74 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 177.397 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.435 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 0.2 OUTLIER -80.59 113.02 18.49 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.031 0.443 . . . . 0.0 111.753 -176.468 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.8 p90 -120.97 156.86 31.18 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 173.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -106.4 122.18 45.75 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.23 0.538 . . . . 0.0 110.929 -172.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 p -119.16 111.16 32.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.787 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.229 179.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 31.8 t-20 -77.71 128.17 33.62 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 177.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 65.7 m-70 -95.19 -15.07 23.55 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -168.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.539 ' OD1' ' HA3' ' A' ' 8' ' ' GLY . 10.6 p-10 -103.52 -20.21 14.11 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.95 179.621 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -105.71 -16.06 14.79 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.087 0.47 . . . . 0.0 110.198 175.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.12 50.0 2.55 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.426 177.626 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -112.65 128.35 56.36 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.991 178.609 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.17 103.51 12.72 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.731 176.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.443 HG23 ' CZ3' ' A' ' 9' ' ' TRP . 1.4 t -125.12 147.92 48.79 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.422 0.63 . . . . 0.0 111.667 -174.181 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 57.1 m95 -106.63 39.99 1.72 Allowed 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 174.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.408 ' O ' ' HD3' ' A' ' 34' ' ' PRO . 0.5 OUTLIER -136.32 154.67 50.79 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.47 -178.102 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.413 HH11 ' HD3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -75.88 112.39 19.81 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-O 120.743 0.306 . . . . 0.0 110.8 -179.187 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.408 ' HD3' ' O ' ' A' ' 32' ' ' THR . 31.6 Cg_exo -62.19 150.78 85.56 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 123.26 2.64 . . . . 0.0 112.607 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -114.75 -4.45 11.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 121.478 0.656 . . . . 0.0 111.325 -178.396 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.8 ptt? . . . . . 0 C--N 1.311 -1.095 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.55 -177.277 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.667 0 N-CA-C 112.515 -0.234 . . . . 0.0 112.515 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.29 -51.54 0.65 Allowed Pre-proline 0 CA--C 1.54 0.56 0 CA-C-O 119.89 -0.1 . . . . 0.0 111.26 177.784 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -69.44 116.29 4.46 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 121.882 1.721 . . . . 0.0 111.913 177.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -83.11 -137.48 2.99 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.265 -179.281 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.715 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 39.1 mt -124.57 167.98 14.36 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-O 120.607 0.242 . . . . 0.0 110.642 -176.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.718 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 75.6 Cg_exo -56.67 164.13 6.21 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 122.452 2.101 . . . . 0.0 110.839 166.856 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -66.69 -8.8 30.3 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.94 0.4 . . . . 0.0 111.374 -177.13 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -99.87 -21.47 13.98 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 121.013 -0.613 . . . . 0.0 113.231 177.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.718 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 74.3 m95 -96.35 143.67 27.2 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 117.442 0.621 . . . . 0.0 110.097 -173.599 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -136.38 131.66 34.51 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.111 178.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -83.24 125.51 31.65 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.127 0.489 . . . . 0.0 110.095 178.261 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 2.6 ttt180 -121.69 -166.15 1.34 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.912 179.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.614 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 28.6 mtpt -135.85 149.22 48.96 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.186 -179.758 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.412 ' OD1' ' HB2' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -95.06 177.17 5.97 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.426 175.55 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.42 -28.02 67.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.821 0.343 . . . . 0.0 111.778 -177.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.4 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 2.6 mtmp? -88.1 -9.48 53.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.238 -178.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 100.67 11.99 39.18 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.752 -0.737 . . . . 0.0 113.158 176.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.614 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -77.04 161.2 28.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 117.082 0.441 . . . . 0.0 110.302 178.606 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.53 116.85 32.75 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.952 -178.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.8 p90 -125.12 157.94 35.12 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 175.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 31.5 m-85 -106.29 118.8 37.58 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.397 0.618 . . . . 0.0 110.804 -175.332 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.1 p -108.83 110.94 33.91 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.089 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.417 ' HB2' ' CD2' ' A' ' 9' ' ' TRP . 23.2 t30 -84.31 121.47 27.56 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.457 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -82.05 -21.49 36.89 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.45 -174.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.96 -57.92 3.7 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.415 -177.184 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -101.2 1.81 39.38 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.343 -177.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.1 29.21 17.53 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 123.577 0.548 . . . . 0.0 111.64 -179.031 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.6 129.71 34.99 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.967 0.413 . . . . 0.0 110.353 177.213 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -118.96 107.28 13.35 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.203 -178.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.588 HG23 ' O ' ' A' ' 32' ' ' THR . 6.5 t -127.56 149.24 50.24 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.208 0.528 . . . . 0.0 111.697 -175.588 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.406 ' HZ3' ' HB3' ' A' ' 18' ' ' ARG . 16.4 m95 -97.92 7.95 45.52 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 172.507 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.588 ' O ' HG23 ' A' ' 30' ' ' THR . 0.8 OUTLIER -103.92 150.79 23.86 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 114.26 -1.336 . . . . 0.0 110.352 -176.87 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.511 ' HA ' ' HD2' ' A' ' 33' ' ' ARG . 11.0 mmm180 -72.68 121.32 84.64 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-O 120.762 0.315 . . . . 0.0 110.91 177.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 21.9 Cg_exo -64.34 121.19 8.72 Favored 'Trans proline' 0 C--O 1.236 0.415 0 C-N-CA 122.906 2.404 . . . . 0.0 112.058 179.271 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.452 HD12 ' O ' ' A' ' 35' ' ' ILE . 1.4 pp -86.55 86.02 2.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 122.343 1.068 . . . . 0.0 110.823 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.092 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.145 178.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.668 0 N-CA-C 112.182 -0.367 . . . . 0.0 112.182 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.1 m -131.52 98.1 18.6 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-O 120.849 0.356 . . . . 0.0 110.575 -178.263 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -88.75 172.97 4.45 Favored 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.229 2.619 . . . . 0.0 111.837 176.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 84.65 -50.14 4.35 Favored Glycine 0 CA--C 1.517 0.214 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.577 177.346 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.563 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 36.4 mt -106.99 155.43 39.2 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-O 120.718 0.294 . . . . 0.0 110.624 179.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.825 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 77.7 Cg_exo -57.27 156.08 26.98 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 122.841 2.361 . . . . 0.0 111.23 170.561 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.42 90.06 0.07 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.104 0.478 . . . . 0.0 110.654 179.6 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 142.08 -15.72 2.57 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.417 -178.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.825 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 86.6 m95 -93.46 143.86 25.89 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 117.152 0.476 . . . . 0.0 109.841 179.654 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.435 ' CD ' ' HE2' ' A' ' 24' ' ' HIS . 31.3 tt0 -137.62 136.12 37.22 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.364 -177.774 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.83 124.79 34.0 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.778 0.323 . . . . 0.0 110.237 178.456 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 73.5 mtt180 -131.91 172.5 12.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.851 0.358 . . . . 0.0 110.33 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.445 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -117.88 161.39 19.83 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.107 -174.365 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -111.55 -171.93 1.94 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.908 176.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.11 -13.19 60.21 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -178.203 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.18 -35.15 16.39 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 118.94 20.92 3.97 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 121.07 -0.586 . . . . 0.0 112.121 179.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.445 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -95.89 153.92 17.5 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.634 0.254 . . . . 0.0 110.488 -179.837 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.6 m -106.53 116.41 31.89 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.269 179.032 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -114.99 163.67 15.26 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 175.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.413 ' HD1' HD13 ' A' ' 5' ' ' LEU . 75.0 m-85 -110.28 122.84 48.62 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.504 0.668 . . . . 0.0 110.827 -177.518 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.4 p -115.31 118.37 58.58 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.032 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -82.64 132.51 35.18 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 176.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.435 ' HE2' ' CD ' ' A' ' 10' ' ' GLU . 34.0 m-70 -87.59 -31.96 19.58 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -169.582 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -87.06 -35.03 18.96 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.107 0.479 . . . . 0.0 110.543 -179.505 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -85.46 -28.72 24.84 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.475 178.167 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 64.63 46.56 3.13 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.955 -177.287 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.92 132.91 53.61 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.331 177.469 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -111.92 101.48 9.79 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.09 0.471 . . . . 0.0 109.952 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.5 t -120.55 150.1 41.39 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.152 0.501 . . . . 0.0 110.815 -175.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -99.39 46.28 0.98 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.293 0.568 . . . . 0.0 109.646 179.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.9 t -153.98 141.49 19.79 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.227 -0.897 . . . . 0.0 108.793 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.457 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 0.0 OUTLIER -88.08 112.81 51.73 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-O 121.623 0.725 . . . . 0.0 109.665 178.948 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.482 ' HG2' ' CE2' ' A' ' 9' ' ' TRP . 3.6 Cg_exo -74.44 127.56 11.2 Favored 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 123.553 2.836 . . . . 0.0 112.628 -173.092 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 5.4 mm -85.66 71.41 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 121.329 0.585 . . . . 0.0 109.444 174.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.984 0 CA-C-N 114.513 -1.221 . . . . 0.0 110.669 -178.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.601 0 N-CA-C 112.341 -0.304 . . . . 0.0 112.341 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.414 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.0 OUTLIER -71.88 140.6 83.69 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-O 120.641 0.258 . . . . 0.0 110.821 179.163 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 2' ' ' SER . 4.8 Cg_exo -78.3 44.93 1.71 Allowed 'Trans proline' 0 CA--C 1.529 0.256 0 C-N-CA 123.218 2.612 . . . . 0.0 112.202 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -166.03 152.29 21.38 Favored Glycine 0 N--CA 1.447 -0.573 0 N-CA-C 111.18 -0.768 . . . . 0.0 111.18 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.691 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 19.6 mt -97.76 158.88 32.22 Favored Pre-proline 0 C--N 1.319 -0.72 0 CA-C-N 117.018 0.409 . . . . 0.0 110.928 -177.456 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.904 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 52.2 Cg_exo -61.0 -179.47 0.3 Allowed 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.352 2.701 . . . . 0.0 112.776 175.856 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.12 104.35 0.24 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.024 -177.28 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.493 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 95.73 5.38 60.02 Favored Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 120.998 -0.62 . . . . 0.0 113.744 173.905 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.904 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 82.1 m95 -91.67 130.8 37.4 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 117.804 0.802 . . . . 0.0 109.832 -179.49 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -132.14 145.85 51.65 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 178.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.95 137.54 37.35 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.319 0.581 . . . . 0.0 110.241 179.258 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.42 ' HG3' HG11 ' A' ' 22' ' ' VAL . 5.9 mtm180 -130.81 177.45 7.4 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.839 177.145 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.433 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -135.98 135.65 39.7 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.408 0.623 . . . . 0.0 111.356 -177.346 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.59 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . 12.3 t70 -67.81 159.99 29.19 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.151 -0.932 . . . . 0.0 108.8 172.011 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.1 -29.2 63.32 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.743 0.306 . . . . 0.0 111.811 -178.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.7 mttp -85.74 4.43 36.78 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.163 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 86.33 34.37 12.39 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.628 177.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.59 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 1.9 mtp180 -95.72 128.52 42.67 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 179.187 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 32.9 m -90.94 125.18 35.7 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.988 0.423 . . . . 0.0 111.361 -175.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -139.94 162.7 34.56 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 176.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -113.72 125.86 54.59 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.154 0.502 . . . . 0.0 110.803 -175.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.526 ' HB ' HG22 ' A' ' 29' ' ' THR . 2.8 p -116.23 110.38 31.38 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.174 -178.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.493 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 33.5 t-20 -81.91 117.86 22.49 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 176.141 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -78.07 -22.78 48.53 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.867 0.365 . . . . 0.0 110.95 -174.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -81.74 -43.66 18.11 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.522 -178.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.407 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 43.4 t30 -100.54 6.21 44.19 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.733 -178.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.407 ' HG2' ' O ' ' A' ' 26' ' ' ASN . 7.9 ptp180 45.54 35.84 2.23 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.295 1.038 . . . . 0.0 112.638 -179.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.76 122.34 43.76 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 121.073 0.463 . . . . 0.0 111.24 -178.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.526 HG22 ' HB ' ' A' ' 22' ' ' VAL . 0.1 OUTLIER -104.47 86.46 2.52 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.164 178.326 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 1.3 t -98.9 153.0 19.15 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.072 -174.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 57.2 m95 -107.42 24.34 13.02 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.471 0.653 . . . . 0.0 109.482 178.048 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -123.74 159.26 29.83 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.252 -177.439 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.94 114.36 43.44 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 175.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -63.18 105.05 0.44 Allowed 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 122.946 2.431 . . . . 0.0 112.82 -179.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 3.3 mm -85.23 90.01 2.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.108 0.48 . . . . 0.0 109.989 176.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.679 ' SD ' ' HB3' ' A' ' 6' ' ' PRO . 13.1 ttt . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.532 -0.747 . . . . 0.0 110.166 179.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.675 0 N-CA-C 111.844 -0.502 . . . . 0.0 111.844 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.407 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.4 OUTLIER -64.31 146.49 97.77 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.527 0.164 . . . . 0.0 110.828 178.785 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 2' ' ' SER . 39.1 Cg_exo -61.59 -21.22 71.47 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.914 2.409 . . . . 0.0 112.512 -178.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 173.33 178.06 43.02 Favored Glycine 0 N--CA 1.442 -0.952 0 N-CA-C 110.665 -0.974 . . . . 0.0 110.665 178.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.673 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 59.3 mt 61.51 174.31 0.06 OUTLIER Pre-proline 0 N--CA 1.448 -0.55 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 178.105 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.705 ' HD2' ' HB2' ' A' ' 9' ' ' TRP . 72.9 Cg_exo -58.64 171.92 1.75 Allowed 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.964 2.442 . . . . 0.0 112.159 171.474 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.79 7.37 1.15 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.18 -0.464 . . . . 0.0 112.129 -175.477 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -137.73 6.65 3.53 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.999 178.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' TRP . . . . . 0.705 ' HB2' ' HD2' ' A' ' 6' ' ' PRO . 79.6 m95 -111.47 134.39 53.08 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 117.268 0.534 . . . . 0.0 109.577 -178.864 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.608 ' OE1' ' HD2' ' A' ' 12' ' ' ARG . 43.3 tt0 -120.08 121.51 39.02 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.044 -178.793 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -85.03 117.7 24.15 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.024 0.44 . . . . 0.0 109.839 177.211 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.608 ' HD2' ' OE1' ' A' ' 10' ' ' GLU . 2.3 mtp180 -115.18 -170.0 1.67 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.36 -178.254 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.06 134.04 30.8 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.167 -175.764 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -76.82 164.82 25.48 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.523 173.784 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.76 -22.77 67.07 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.071 0.462 . . . . 0.0 111.261 -177.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.461 ' HG3' ' HG2' ' A' ' 18' ' ' ARG . 13.5 pttm -96.24 14.88 22.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.344 178.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 72.13 45.65 39.41 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.499 178.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.461 ' HG2' ' HG3' ' A' ' 16' ' ' LYS . 6.6 mmt-85 -106.21 143.4 34.4 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 178.612 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.1 m -100.33 115.17 29.33 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.613 -175.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.1 p90 -133.84 161.67 34.11 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.998 -0.547 . . . . 0.0 109.828 175.171 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -116.62 125.07 51.27 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.243 0.544 . . . . 0.0 110.673 -175.064 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.5 p -118.8 108.85 25.09 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 121.815 0.817 . . . . 0.0 110.574 -178.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -80.85 116.32 20.78 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.143 -0.935 . . . . 0.0 108.779 178.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -86.4 -16.15 38.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.802 0.334 . . . . 0.0 111.375 -174.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -76.55 -36.07 57.86 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.936 0.398 . . . . 0.0 110.425 -179.193 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -113.12 -2.82 14.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.057 -179.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 57.74 52.76 7.78 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.045 -178.657 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.6 130.21 56.75 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.904 179.35 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.55 105.44 15.08 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.798 177.774 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -127.81 152.59 47.6 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 120.765 0.317 . . . . 0.0 110.926 -176.279 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 46.6 m95 -101.15 -3.18 29.63 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.917 0.865 . . . . 0.0 108.718 173.123 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.452 ' O ' ' HD3' ' A' ' 34' ' ' PRO . 1.8 m -74.52 136.91 42.18 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.334 -1.303 . . . . 0.0 110.339 177.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.08 110.86 11.18 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.637 0.256 . . . . 0.0 110.7 177.696 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.452 ' HD3' ' O ' ' A' ' 32' ' ' THR . 73.4 Cg_endo -84.51 99.17 0.74 Allowed 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.642 2.228 . . . . 0.0 112.642 -179.49 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 9.6 mm -105.04 -1.35 9.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 122.059 0.933 . . . . 0.0 110.1 178.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 10.8 ttp . . . . . 0 C--O 1.251 1.148 0 CA-C-N 114.389 -1.278 . . . . 0.0 109.444 -178.918 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.817 HD21 ' HD2' ' A' ' 21' ' ' TYR . 5.2 mp . . . . . 0 N--CA 1.453 -0.32 0 CA-C-O 120.626 0.25 . . . . 0.0 110.768 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.833 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 82.9 Cg_exo -53.43 160.88 4.5 Favored 'Trans proline' 0 N--CA 1.477 0.543 0 C-N-CA 123.833 3.022 . . . . 0.0 113.578 177.024 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 m -63.58 103.77 0.57 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.449 176.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 128.61 -22.08 5.27 Favored Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 111.253 -0.739 . . . . 0.0 111.253 -176.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.833 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 71.0 m95 -86.43 141.51 29.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.921 0.391 . . . . 0.0 110.264 178.638 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -136.52 150.16 48.51 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 176.154 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.49 145.5 31.73 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 177.034 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -145.26 -175.13 4.58 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.998 0.427 . . . . 0.0 109.997 176.897 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.428 ' HE3' HG23 ' A' ' 19' ' ' THR . 3.5 mttt -139.21 152.99 47.8 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.873 -178.379 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.502 ' OD1' ' HB2' ' A' ' 18' ' ' ARG . 1.0 OUTLIER -91.49 19.93 5.76 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.289 0.566 . . . . 0.0 110.398 178.936 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.401 ' HB3' ' O ' ' A' ' 14' ' ' ASP . . . 78.46 -27.96 0.16 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 114.626 -1.17 . . . . 0.0 111.599 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.54 42.06 1.14 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.824 0.821 . . . . 0.0 111.394 -176.269 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.93 -31.53 3.07 Favored Glycine 0 C--N 1.32 -0.351 0 CA-C-N 114.596 -1.184 . . . . 0.0 113.511 175.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.502 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 0.1 OUTLIER -62.94 122.76 16.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.111 0.482 . . . . 0.0 111.135 -174.591 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.428 HG23 ' HE3' ' A' ' 13' ' ' LYS . 25.5 m -103.83 116.85 33.05 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.41 -178.037 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.8 p90 -120.32 154.56 34.84 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.946 0.403 . . . . 0.0 109.929 178.414 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.817 ' HD2' HD21 ' A' ' 5' ' ' LEU . 79.7 m-85 -105.95 121.17 43.56 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.406 0.622 . . . . 0.0 110.34 -176.069 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 p -115.2 110.97 33.87 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 CA-C-O 121.787 0.803 . . . . 0.0 110.126 -176.548 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -89.88 122.48 32.97 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.319 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -89.99 -25.87 20.64 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.042 -175.108 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.46 -32.48 60.65 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.759 -177.901 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -110.81 -0.54 16.92 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.751 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER 58.06 45.9 17.11 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.436 178.043 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -113.09 144.82 41.97 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.612 -176.006 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.64 100.84 7.69 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 173.847 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.413 ' HB ' ' HZ3' ' A' ' 9' ' ' TRP . 1.1 m -115.99 127.19 54.74 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.44 -168.111 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -95.08 59.56 2.28 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.565 0.698 . . . . 0.0 109.118 175.337 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -167.61 145.33 4.55 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.9 -172.192 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.414 ' HA ' ' HD2' ' A' ' 34' ' ' PRO . 0.1 OUTLIER -69.31 117.55 53.48 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-O 120.966 0.412 . . . . 0.0 110.596 178.211 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.414 ' HD2' ' HA ' ' A' ' 33' ' ' ARG . 24.9 Cg_endo . . . . . 0 C--O 1.237 0.433 0 C-N-CA 123.153 2.569 . . . . 0.0 113.112 -177.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.605 HD11 ' HD1' ' A' ' 21' ' ' TYR . 18.0 mt . . . . . 0 C--O 1.235 0.292 0 N-CA-C 110.486 -0.191 . . . . 0.0 110.486 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.793 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 77.9 Cg_exo -56.63 152.78 39.34 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.809 2.34 . . . . 0.0 111.105 170.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.6 92.35 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.471 0.653 . . . . 0.0 110.308 177.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.456 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 141.25 -16.49 2.73 Favored Glycine 0 N--CA 1.443 -0.876 0 CA-C-N 115.683 -0.689 . . . . 0.0 112.359 -176.463 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.793 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 91.6 m95 -97.86 137.94 35.96 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 109.236 -0.654 . . . . 0.0 109.236 177.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.435 ' HB3' HG13 ' A' ' 22' ' ' VAL . 23.8 tt0 -126.89 127.97 45.75 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -91.29 110.31 21.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.763 0.792 . . . . 0.0 110.408 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.616 ' O ' ' HA ' ' A' ' 19' ' ' THR . 1.8 mtt180 -100.73 168.2 9.83 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.431 -178.158 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.709 ' HB3' ' HA2' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -128.09 98.16 5.02 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.047 0.451 . . . . 0.0 110.046 -177.505 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.463 ' HB2' ' CE1' ' A' ' 20' ' ' TYR . 23.7 t70 -80.67 134.05 35.81 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.619 -174.325 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 62.72 -99.97 0.09 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.088 173.538 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.68 -6.81 59.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.968 0.413 . . . . 0.0 111.074 -176.091 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.709 ' HA2' ' HB3' ' A' ' 13' ' ' LYS . . . 118.71 25.47 2.83 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.533 -0.841 . . . . 0.0 111.902 -177.605 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.412 ' HB3' ' HZ3' ' A' ' 31' ' ' TRP . 11.9 mtm180 -72.21 112.64 8.47 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 176.804 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.616 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 2.7 m -76.19 124.66 27.81 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.137 0.494 . . . . 0.0 112.249 -174.198 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.463 ' CE1' ' HB2' ' A' ' 14' ' ' ASP . 43.5 p90 -132.59 158.84 41.18 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.266 173.482 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.605 ' HD1' HD11 ' A' ' 5' ' ' LEU . 36.4 m-85 -108.58 121.31 44.72 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.265 0.555 . . . . 0.0 111.316 -174.164 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.57 ' CG1' ' HG3' ' A' ' 12' ' ' ARG . 2.5 p -116.34 109.32 27.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.026 -178.654 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.456 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 17.7 t-20 -79.13 131.33 36.19 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 177.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 62.5 m-70 -94.24 -7.97 40.52 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -170.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -91.24 -54.87 3.75 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.35 0.595 . . . . 0.0 109.716 177.365 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 32.2 t-20 -89.53 -6.12 56.66 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.457 -179.236 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.448 ' HA ' ' HD2' ' A' ' 27' ' ' ARG . 0.5 OUTLIER 58.77 32.25 22.02 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.495 178.074 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.72 124.35 32.89 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.16 0.505 . . . . 0.0 110.818 178.902 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.3 98.44 7.98 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.77 178.584 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.6 t -117.55 143.75 45.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.278 0.561 . . . . 0.0 111.743 -172.623 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.412 ' HZ3' ' HB3' ' A' ' 18' ' ' ARG . 80.6 m95 -101.48 42.24 1.14 Allowed 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 172.72 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -140.57 151.07 44.42 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.736 -1.12 . . . . 0.0 109.283 -174.132 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.509 ' HD2' ' HA ' ' A' ' 33' ' ' ARG . 1.1 mmm180 -75.77 117.43 63.6 Favored Pre-proline 0 C--N 1.322 -0.616 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 177.065 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo . . . . . 0 C--O 1.235 0.326 0 C-N-CA 123.086 2.524 . . . . 0.0 111.956 -178.815 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.71 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 19.9 mt . . . . . 0 N--CA 1.453 -0.279 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.878 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 79.8 Cg_exo -54.66 160.47 7.25 Favored 'Trans proline' 0 C--O 1.237 0.437 0 C-N-CA 122.827 2.352 . . . . 0.0 111.736 173.725 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.55 88.54 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.746 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 137.3 -8.93 3.79 Favored Glycine 0 N--CA 1.442 -0.907 0 C-N-CA 120.33 -0.938 . . . . 0.0 113.304 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.878 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 88.0 m95 -95.63 140.58 30.24 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 117.869 0.834 . . . . 0.0 109.936 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -131.65 140.58 49.4 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -179.099 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -93.24 138.03 32.01 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.026 0.441 . . . . 0.0 110.96 -177.385 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.422 ' HG3' HG11 ' A' ' 22' ' ' VAL . 3.8 mtt180 -132.26 175.83 8.92 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.224 174.145 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 7.7 mptt -130.09 160.89 32.37 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 121.188 0.518 . . . . 0.0 111.128 -175.251 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -91.22 8.28 36.61 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.683 178.504 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 72.53 7.78 5.62 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.937 178.463 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.1 mttp -116.82 -32.89 4.97 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.124 0.488 . . . . 0.0 110.128 175.227 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 145.19 8.34 0.36 Allowed Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.009 177.27 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.03 126.78 44.82 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.9 0.35 . . . . 0.0 110.212 177.359 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.86 120.91 41.44 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.384 -176.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 29.8 p90 -115.89 164.48 14.35 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 175.317 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -110.3 126.26 54.01 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.062 0.458 . . . . 0.0 111.063 -175.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.422 HG11 ' HG3' ' A' ' 12' ' ' ARG . 2.6 p -118.93 115.16 47.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-O 121.647 0.736 . . . . 0.0 110.263 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 41.1 t-20 -91.3 107.98 19.57 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.33 -0.85 . . . . 0.0 108.981 178.143 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -78.64 -5.4 52.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.762 0.315 . . . . 0.0 111.306 -173.225 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -100.26 -29.41 12.46 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.868 0.366 . . . . 0.0 110.536 -177.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -107.69 -3.9 18.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.773 178.741 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 27' ' ' ARG . 0.0 OUTLIER 57.7 54.19 6.51 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.197 -179.357 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.22 130.22 49.25 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.984 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.405 HG23 ' HB ' ' A' ' 22' ' ' VAL . 0.0 OUTLIER -117.9 101.0 7.94 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 176.638 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 10.7 t -116.09 148.4 40.29 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.221 0.534 . . . . 0.0 111.848 -173.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.3 m95 -99.52 14.88 28.37 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.374 -0.83 . . . . 0.0 108.782 172.201 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -105.66 153.62 21.57 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 114.868 -1.06 . . . . 0.0 109.796 -179.664 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -85.9 116.73 66.85 Favored Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.043 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo . . . . . 0 N--CA 1.462 -0.371 0 C-N-CA 122.844 2.362 . . . . 0.0 112.274 -179.625 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.755 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 30.1 mt . . . . . 0 N--CA 1.451 -0.41 0 N-CA-C 111.294 0.109 . . . . 0.0 111.294 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.768 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 81.2 Cg_exo -59.78 35.7 0.05 OUTLIER 'Trans proline' 0 N--CA 1.486 1.088 0 C-N-CA 124.444 3.429 . . . . 0.0 115.417 175.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.412 ' H ' ' C ' ' A' ' 5' ' ' LEU . 70.8 m 68.14 -54.27 0.52 Allowed 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 123.629 0.771 . . . . 0.0 112.54 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -80.06 -2.16 88.51 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 121.099 -0.572 . . . . 0.0 112.374 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.768 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 83.5 m95 -102.29 138.42 39.25 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.648 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -129.52 139.08 51.65 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.898 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -87.67 137.79 32.03 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.888 0.375 . . . . 0.0 110.092 178.219 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 12' ' ' ARG . 1.4 mtp85 -135.87 -177.21 4.59 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.302 176.722 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.64 142.63 51.3 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.679 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.07 -172.71 2.9 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.688 -178.431 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.24 -36.17 75.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.493 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 19.5 mttm -73.91 -54.39 8.05 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 134.13 20.81 0.81 Allowed Glycine 0 N--CA 1.444 -0.767 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.366 178.765 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.41 ' HB3' ' HZ3' ' A' ' 31' ' ' TRP . 0.1 OUTLIER -83.94 147.47 27.46 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 110.34 -0.245 . . . . 0.0 110.34 -179.995 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -82.29 105.41 13.34 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.818 0.342 . . . . 0.0 111.022 178.423 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 42.0 p90 -109.24 152.96 24.5 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 172.747 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.717 ' HD1' HD11 ' A' ' 5' ' ' LEU . 56.6 m-85 -107.56 123.69 48.82 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.289 0.566 . . . . 0.0 110.478 -174.418 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.4 p -117.02 114.91 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.612 -177.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.413 ' HB2' ' CD2' ' A' ' 9' ' ' TRP . 26.5 t-20 -82.43 122.24 27.77 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.982 -1.008 . . . . 0.0 108.334 174.549 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -83.96 -42.95 15.72 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -168.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.28 -42.12 72.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.785 0.326 . . . . 0.0 110.996 -176.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -87.77 -10.76 50.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.568 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 56.62 54.75 7.04 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.996 -179.048 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -116.46 134.19 55.15 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.496 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.63 111.57 17.81 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.424 -179.33 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.415 HG22 ' CZ3' ' A' ' 9' ' ' TRP . 6.5 t -127.27 153.33 46.27 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.568 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.41 ' HZ3' ' HB3' ' A' ' 18' ' ' ARG . 44.9 m95 -104.33 14.96 29.25 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.359 0.599 . . . . 0.0 109.611 178.227 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -117.89 165.15 14.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.237 178.608 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 12.6 mtp85 -86.83 113.56 53.81 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-O 120.734 0.302 . . . . 0.0 110.798 179.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.408 ' HG3' ' CD2' ' A' ' 9' ' ' TRP . 58.1 Cg_endo . . . . . 0 N--CA 1.464 -0.238 0 C-N-CA 122.807 2.338 . . . . 0.0 112.419 178.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.733 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 19.8 mt . . . . . 0 N--CA 1.447 -0.609 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.882 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 87.3 Cg_exo -53.58 150.9 26.26 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 122.733 2.289 . . . . 0.0 111.104 171.79 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 m -59.97 93.89 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.156 0.503 . . . . 0.0 110.847 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.409 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 139.67 -18.83 2.99 Favored Glycine 0 N--CA 1.44 -1.056 0 C-N-CA 120.917 -0.658 . . . . 0.0 112.307 -177.045 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.882 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 93.9 m95 -93.26 139.16 30.93 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 179.534 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -128.51 130.83 48.05 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.72 179.233 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.12 126.22 32.89 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 178.107 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.406 ' O ' ' HA ' ' A' ' 19' ' ' THR . 59.7 mtp85 -138.57 173.79 11.22 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.389 -178.788 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -136.03 116.11 13.35 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.408 -174.415 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.48 ' HB2' ' CE1' ' A' ' 20' ' ' TYR . 6.5 t0 -99.65 152.46 20.04 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.496 -177.853 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 60.02 -100.0 0.1 Allowed 'General case' 0 N--CA 1.463 0.22 0 O-C-N 123.619 0.575 . . . . 0.0 112.072 176.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.55 53.17 0.94 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.0 0.428 . . . . 0.0 110.823 -175.575 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.404 ' HA2' ' HB2' ' A' ' 13' ' ' LYS . . . 82.64 23.0 57.27 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.863 175.349 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.49 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 18.6 mmm-85 -76.73 110.86 11.67 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.653 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.406 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 1.4 m -81.44 124.61 29.58 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.562 -173.859 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.48 ' CE1' ' HB2' ' A' ' 14' ' ' ASP . 34.2 p90 -137.0 167.2 21.96 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.181 175.227 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.442 ' HD1' HD11 ' A' ' 5' ' ' LEU . 52.6 m-85 -113.6 121.0 42.86 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-O 121.26 0.552 . . . . 0.0 110.097 -179.516 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.4 p -111.83 117.56 55.45 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.263 -177.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.409 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 24.9 t-20 -90.99 126.43 36.08 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.504 -178.932 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -94.92 -8.76 36.16 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -173.444 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -83.53 -54.34 5.02 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 175.876 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -91.65 -8.63 46.62 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.065 -176.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 58.38 59.48 2.98 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.34 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.01 142.55 51.2 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.272 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.59 100.93 10.49 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.884 177.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.706 HG23 ' H ' ' A' ' 32' ' ' THR . 0.5 OUTLIER -111.78 138.78 47.9 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.05 0.453 . . . . 0.0 111.029 -172.842 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 59.3 m95 -109.89 32.31 5.18 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.502 0.668 . . . . 0.0 109.737 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.706 ' H ' HG23 ' A' ' 30' ' ' THR . 1.3 t -137.47 163.94 29.9 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.418 -177.375 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.525 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 14.4 mmm180 -75.57 115.28 44.29 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-O 121.111 0.482 . . . . 0.0 110.831 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.525 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 6.7 Cg_exo . . . . . 0 N--CA 1.461 -0.386 0 C-N-CA 123.427 2.752 . . . . 0.0 112.821 -177.639 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.767 HD13 ' HB3' ' A' ' 9' ' ' TRP . 6.1 mt . . . . . 0 C--O 1.233 0.23 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.661 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 51.3 Cg_exo -60.05 164.05 13.01 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.627 2.218 . . . . 0.0 111.204 171.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -50.76 -37.45 42.21 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -175.349 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.426 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -102.37 5.86 52.52 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.635 -0.793 . . . . 0.0 114.166 -174.317 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.767 ' HB3' HD13 ' A' ' 5' ' ' LEU . 89.5 m95 -104.44 144.43 31.68 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 118.227 1.014 . . . . 0.0 109.964 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -137.31 129.05 28.74 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.962 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.14 116.65 24.47 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 175.637 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.72 -170.36 2.11 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.342 0.592 . . . . 0.0 110.892 -177.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -122.22 126.78 48.97 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.38 -178.052 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.496 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -58.76 -53.14 61.7 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.373 -177.853 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 170.99 -47.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 O-C-N 124.098 0.874 . . . . 0.0 109.038 -178.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.32 37.41 1.18 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.629 -177.705 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.1 -11.52 42.4 Favored Glycine 0 CA--C 1.517 0.205 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.897 177.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.496 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 14.1 mtt180 -61.27 138.25 58.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.937 0.399 . . . . 0.0 111.145 -177.733 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -97.16 122.25 39.96 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.892 -177.389 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.5 p90 -133.39 153.25 51.76 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 175.222 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.556 ' CD1' HD11 ' A' ' 5' ' ' LEU . 50.7 m-85 -109.41 119.37 39.25 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.481 0.658 . . . . 0.0 110.391 -176.028 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.2 p -114.84 115.28 49.02 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.188 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.404 -177.275 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.426 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 28.4 t-20 -85.62 111.23 19.87 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.617 175.123 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -81.28 -10.38 59.59 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.787 -170.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -89.75 -54.83 3.88 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.131 0.491 . . . . 0.0 110.092 -178.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 19.8 t30 -83.96 -4.45 58.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.545 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.4 mtm180 57.41 52.52 8.53 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.013 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.09 134.83 54.76 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.06 0.457 . . . . 0.0 111.304 -178.609 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.13 104.03 13.9 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.97 179.135 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.552 HG23 HG22 ' A' ' 32' ' ' THR . 0.9 OUTLIER -116.93 129.07 55.82 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.56 -173.626 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.3 m95 -100.31 39.89 1.31 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.356 0.598 . . . . 0.0 110.131 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.552 HG22 HG23 ' A' ' 30' ' ' THR . 0.6 OUTLIER -144.79 151.59 39.04 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.849 -176.88 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.54 ' HD3' ' OH ' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -69.14 114.09 21.13 Favored Pre-proline 0 C--N 1.32 -0.705 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 175.178 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 11.4 Cg_exo . . . . . 0 C--N 1.344 0.299 0 C-N-CA 123.529 2.819 . . . . 0.0 113.593 -176.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.869 HD21 ' HD2' ' A' ' 21' ' ' TYR . 3.6 mp . . . . . 0 N--CA 1.447 -0.592 0 CA-C-O 121.059 0.457 . . . . 0.0 111.095 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.799 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 89.1 Cg_exo -53.16 163.93 2.03 Favored 'Trans proline' 0 N--CA 1.474 0.343 0 C-N-CA 124.084 3.189 . . . . 0.0 113.05 176.066 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.05 120.07 10.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.353 -0.385 . . . . 0.0 109.967 175.57 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 108.51 -28.75 10.99 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 111.449 -0.66 . . . . 0.0 111.449 -174.056 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.799 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 64.4 m95 -83.49 117.17 22.91 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 178.015 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -120.64 136.28 54.87 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 175.448 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.42 140.21 29.83 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 178.193 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.427 ' HD2' ' OH ' ' A' ' 20' ' ' TYR . 2.8 mtm180 -139.06 -168.38 2.42 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.243 0.544 . . . . 0.0 110.41 -178.942 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.3 OUTLIER -140.08 151.2 45.17 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.063 -179.862 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -78.84 -165.93 0.81 Allowed 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 110.313 -0.255 . . . . 0.0 110.313 179.301 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.61 -15.16 63.25 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.027 0.381 . . . . 0.0 112.027 -176.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -108.08 -44.05 4.26 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.762 0.315 . . . . 0.0 110.807 -178.539 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 140.35 23.11 0.29 Allowed Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.254 -0.974 . . . . 0.0 113.126 178.18 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.423 ' HB3' ' HZ3' ' A' ' 31' ' ' TRP . 12.7 mtm-85 -85.99 144.61 27.51 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 177.725 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.2 117.95 23.28 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -172.26 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.427 ' OH ' ' HD2' ' A' ' 12' ' ' ARG . 13.9 p90 -129.62 149.48 51.36 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.013 171.278 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.869 ' HD2' HD21 ' A' ' 5' ' ' LEU . 84.0 m-85 -110.21 128.15 55.34 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 120.998 0.427 . . . . 0.0 110.217 -176.712 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 p -117.11 110.1 30.09 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.879 0.847 . . . . 0.0 110.687 -177.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.497 ' HB2' ' CD2' ' A' ' 9' ' ' TRP . 43.2 t-20 -90.07 112.91 24.52 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.139 178.525 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -71.95 -29.25 64.08 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.642 -174.513 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -75.36 -57.34 3.95 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.892 0.377 . . . . 0.0 111.132 -174.656 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -85.82 -5.99 59.16 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.162 -177.059 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.4 ttm180 62.21 57.63 1.96 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-O 121.241 0.544 . . . . 0.0 111.406 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.23 131.04 53.99 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.889 178.87 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.53 76.79 1.22 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.461 0.648 . . . . 0.0 109.677 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.6 t -99.27 148.17 24.42 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.835 -170.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.423 ' HZ3' ' HB3' ' A' ' 18' ' ' ARG . 60.5 m95 -100.23 46.35 0.96 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.575 0.702 . . . . 0.0 109.129 175.208 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -152.22 157.27 41.22 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.362 -177.196 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.448 ' HA ' ' HD2' ' A' ' 34' ' ' PRO . 0.2 OUTLIER -65.23 125.13 88.75 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-O 120.58 0.228 . . . . 0.0 111.001 178.923 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.448 ' HD2' ' HA ' ' A' ' 33' ' ' ARG . 9.7 Cg_endo . . . . . 0 CA--C 1.53 0.283 0 C-N-CA 123.711 2.941 . . . . 0.0 113.242 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.745 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 67.3 mt . . . . . 0 N--CA 1.456 -0.155 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.803 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 81.2 Cg_exo -55.68 167.67 2.03 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 124.249 3.299 . . . . 0.0 112.855 172.76 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.66 95.71 0.11 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.62 178.008 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.407 ' HA3' ' HB2' ' A' ' 25' ' ' ASN . . . 134.42 -22.97 3.67 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.614 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.803 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 88.2 m95 -86.08 129.83 34.72 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 -177.446 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.471 ' HB3' HG13 ' A' ' 22' ' ' VAL . 38.0 tt0 -122.75 130.41 52.9 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.434 -177.584 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -87.29 119.63 27.75 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.941 0.401 . . . . 0.0 110.064 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.467 ' HD2' HG11 ' A' ' 22' ' ' VAL . 44.3 mtt180 -126.04 -179.35 4.66 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.991 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.8 mtmp? -140.7 150.69 43.78 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.772 -179.159 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -93.05 -175.49 3.88 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.006 176.349 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.71 -26.13 68.52 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -177.67 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.7 mtmp? -87.69 -8.81 55.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.084 0.469 . . . . 0.0 110.432 178.566 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 90.35 20.95 39.66 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.811 175.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -81.39 123.27 28.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.832 0.316 . . . . 0.0 110.242 177.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -72.75 123.54 23.52 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.409 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.481 ' HB3' ' CE3' ' A' ' 31' ' ' TRP . 37.2 p90 -129.89 155.05 46.67 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 174.23 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.57 ' HD1' HD11 ' A' ' 5' ' ' LEU . 25.6 m-85 -105.93 117.74 34.8 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.38 -176.426 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.471 HG13 ' HB3' ' A' ' 10' ' ' GLU . 2.3 p -109.94 107.07 21.98 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.203 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.467 ' HB2' ' CD2' ' A' ' 9' ' ' TRP . 55.8 t-20 -84.89 112.56 20.67 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.756 178.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -83.91 -16.49 44.08 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.213 0.53 . . . . 0.0 109.911 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.407 ' HB2' ' HA3' ' A' ' 8' ' ' GLY . 7.6 t-20 -73.57 -54.2 8.75 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.382 178.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.456 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 4.4 t30 -107.44 28.16 8.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.16 -177.609 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER 37.41 51.7 1.19 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.151 0.981 . . . . 0.0 113.047 178.227 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.64 132.34 54.61 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.017 0.437 . . . . 0.0 111.219 -176.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -119.6 104.4 10.25 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 178.544 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.544 ' OG1' HG22 ' A' ' 32' ' ' THR . 3.9 t -126.11 148.01 49.47 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.084 0.469 . . . . 0.0 111.252 -174.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.481 ' CE3' ' HB3' ' A' ' 20' ' ' TYR . 33.9 m95 -99.87 -5.58 28.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.637 177.161 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.544 HG22 ' OG1' ' A' ' 30' ' ' THR . 2.4 t -95.5 165.81 12.17 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.711 177.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.64 130.21 87.52 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 177.333 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo . . . . . 0 C--O 1.236 0.384 0 C-N-CA 123.128 2.552 . . . . 0.0 112.648 177.798 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.673 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 22.7 mt . . . . . 0 CA--C 1.514 -0.432 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.893 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 72.2 Cg_exo -55.83 155.56 22.19 Favored 'Trans proline' 0 C--O 1.236 0.391 0 C-N-CA 122.526 2.151 . . . . 0.0 111.141 171.713 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.82 99.72 0.17 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.959 0.409 . . . . 0.0 110.16 -179.47 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.42 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 132.97 -19.01 4.44 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.472 -177.42 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.893 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 90.9 m95 -91.51 135.84 33.56 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -126.95 132.23 50.89 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.756 -177.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.427 ' HG2' HD12 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -90.14 114.62 26.61 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.167 0.508 . . . . 0.0 110.365 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.661 ' HD2' HG11 ' A' ' 22' ' ' VAL . 48.6 mtt180 -109.31 -178.85 3.67 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.647 178.32 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -136.55 144.02 43.98 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.433 -179.348 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.416 ' CG ' ' H ' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -96.96 171.46 8.48 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.45 176.653 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.11 -26.28 68.2 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -176.434 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.416 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 22.9 mmmt -84.66 -4.34 58.96 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.851 0.358 . . . . 0.0 110.686 -179.338 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.23 12.66 55.96 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.346 177.137 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.401 ' HB3' ' HZ3' ' A' ' 31' ' ' TRP . 4.0 mmp_? -81.0 144.83 31.51 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 179.216 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.7 m -98.9 120.5 39.44 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.438 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.0 p90 -124.58 148.31 47.92 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 176.436 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.602 ' HD1' HD11 ' A' ' 5' ' ' LEU . 58.0 m-85 -105.33 122.08 45.21 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.633 0.73 . . . . 0.0 110.683 -174.098 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.661 HG11 ' HD2' ' A' ' 12' ' ' ARG . 2.5 p -115.92 113.86 44.5 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.099 -177.458 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.42 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 37.7 t-20 -89.48 117.35 28.33 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.147 178.477 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 78.9 m-70 -83.93 -20.79 32.35 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.362 -174.54 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -84.67 -41.78 15.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.081 0.467 . . . . 0.0 110.434 -179.037 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -95.75 -1.21 50.29 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.96 -178.667 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 56.21 40.77 29.93 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.701 177.467 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.67 141.82 47.7 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.858 0.361 . . . . 0.0 111.352 -176.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.42 109.75 14.26 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.255 178.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 2.6 t -127.62 151.46 48.9 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.017 0.437 . . . . 0.0 110.987 -177.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.401 ' HZ3' ' HB3' ' A' ' 18' ' ' ARG . 47.2 m95 -103.19 12.93 35.08 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.312 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -109.24 158.76 17.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.576 -178.127 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.438 HH11 ' HD3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -85.21 116.69 66.54 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-O 120.769 0.318 . . . . 0.0 111.161 178.209 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo . . . . . 0 N--CA 1.455 -0.791 0 C-N-CA 122.639 2.226 . . . . 0.0 111.55 175.971 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.613 HD11 ' HD1' ' A' ' 21' ' ' TYR . 20.6 mt . . . . . 0 N--CA 1.451 -0.405 0 CA-C-O 120.749 0.309 . . . . 0.0 111.102 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.798 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 74.2 Cg_exo -56.8 162.65 8.4 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.922 2.415 . . . . 0.0 111.274 169.379 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -14.61 9.69 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -176.002 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -108.48 -1.98 32.94 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.424 -0.894 . . . . 0.0 113.406 -177.268 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.798 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 80.0 m95 -104.34 138.61 40.51 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 117.932 0.866 . . . . 0.0 110.676 -176.402 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -121.48 133.94 55.05 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.43 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.06 120.15 32.42 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.159 0.504 . . . . 0.0 110.374 -179.139 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.568 ' HG3' HG11 ' A' ' 22' ' ' VAL . 0.8 OUTLIER -115.61 165.63 12.82 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.691 177.203 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -114.28 135.76 53.72 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.861 -177.528 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.407 ' O ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -66.91 -57.71 6.41 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.952 178.9 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 14' ' ' ASP . . . 168.07 -48.64 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.296 0 O-C-N 123.958 0.786 . . . . 0.0 109.583 -178.432 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.59 45.9 1.0 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.686 0.755 . . . . 0.0 110.901 -175.176 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.26 -17.46 18.29 Favored Glycine 0 C--N 1.317 -0.5 0 CA-C-N 114.816 -1.084 . . . . 0.0 113.227 176.664 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -65.02 118.14 8.68 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.931 0.396 . . . . 0.0 110.664 -178.267 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -102.89 130.61 49.99 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.496 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 37.6 p90 -124.13 161.73 25.04 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.129 0.49 . . . . 0.0 110.322 176.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.613 ' HD1' HD11 ' A' ' 5' ' ' LEU . 33.6 m-85 -108.47 117.52 34.38 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.43 -174.96 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.568 HG11 ' HG3' ' A' ' 12' ' ' ARG . 3.7 p -115.53 115.65 50.01 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 CA-C-O 121.822 0.82 . . . . 0.0 109.695 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 29.3 t-20 -90.22 108.45 19.76 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.771 -177.152 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -88.25 38.68 0.87 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.179 0.514 . . . . 0.0 111.042 -176.54 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -137.3 -47.76 0.58 Allowed 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 178.028 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -92.54 -8.35 44.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.115 174.595 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.93 56.8 2.75 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.678 177.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -127.61 155.35 44.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.168 0.509 . . . . 0.0 111.192 177.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.44 102.94 8.58 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.151 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.667 ' HB ' ' HZ3' ' A' ' 9' ' ' TRP . 0.9 OUTLIER -120.17 136.88 54.47 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.198 -169.519 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 58.0 m95 -101.99 -19.32 15.26 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.052 0.453 . . . . 0.0 110.238 178.824 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.467 HG22 HG23 ' A' ' 30' ' ' THR . 1.4 t -79.63 163.0 24.94 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.731 179.001 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.44 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 8.2 mpt_? -78.06 120.92 83.07 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 176.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 16.1 Cg_exo . . . . . 0 C--N 1.343 0.283 0 C-N-CA 122.769 2.313 . . . . 0.0 111.773 179.101 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.832 HD13 ' HB3' ' A' ' 9' ' ' TRP . 7.4 mt . . . . . 0 C--O 1.234 0.27 0 CA-C-O 120.816 0.341 . . . . 0.0 110.859 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.878 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 50.9 Cg_exo -61.02 -161.47 0.03 OUTLIER 'Trans proline' 0 N--CA 1.474 0.33 0 C-N-CA 124.034 3.156 . . . . 0.0 114.016 -179.791 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.9 94.2 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.945 -1.025 . . . . 0.0 112.55 -174.703 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 77.66 18.43 77.47 Favored Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 121.003 -0.618 . . . . 0.0 113.727 173.43 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.878 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 74.6 m95 -82.63 129.19 34.9 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 176.549 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -132.38 136.76 47.03 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 121.174 -0.21 . . . . 0.0 110.659 -179.206 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.405 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 1.6 pt-20 -90.34 117.27 28.93 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.456 0.646 . . . . 0.0 109.602 174.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.493 ' O ' ' HA ' ' A' ' 19' ' ' THR . 0.0 OUTLIER -110.17 -174.84 2.58 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.543 -179.614 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.33 130.19 26.22 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.618 -178.16 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.693 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . 35.0 t70 -81.47 55.01 2.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.221 177.616 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 67.77 -58.19 0.44 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.845 0.858 . . . . 0.0 112.656 178.593 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.63 30.01 0.66 Allowed 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 122.611 0.365 . . . . 0.0 111.708 -174.666 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 77.17 7.89 86.87 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 120.959 -0.639 . . . . 0.0 113.079 177.53 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.693 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 0.1 OUTLIER -74.06 99.06 3.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.668 0.271 . . . . 0.0 110.315 178.613 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.493 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 30.3 m -72.86 121.68 20.37 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.329 0.585 . . . . 0.0 112.168 -177.527 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.486 ' HB3' ' CE3' ' A' ' 31' ' ' TRP . 28.3 p90 -126.85 142.76 51.46 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.39 -0.823 . . . . 0.0 108.796 171.125 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.605 ' HD2' HD11 ' A' ' 5' ' ' LEU . 74.2 m-85 -98.39 120.59 39.08 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.695 0.76 . . . . 0.0 110.21 -176.659 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 p -111.98 117.0 54.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.276 -177.423 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -89.04 120.03 30.09 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.472 -0.785 . . . . 0.0 108.963 177.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -82.32 -22.24 35.69 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.78 -173.829 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -76.88 -47.82 20.1 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.251 -174.293 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -107.59 7.49 28.7 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.928 0.394 . . . . 0.0 110.726 178.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 54.03 45.2 28.08 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.399 178.948 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.88 135.0 35.66 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.305 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.77 108.7 12.8 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.629 -179.464 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 12.4 t -127.51 149.61 50.05 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.126 0.488 . . . . 0.0 110.701 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.486 ' CE3' ' HB3' ' A' ' 20' ' ' TYR . 49.1 m95 -102.77 21.51 15.36 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.569 0.7 . . . . 0.0 109.203 177.588 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -118.9 160.71 21.44 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 114.911 -1.041 . . . . 0.0 109.367 175.247 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.462 ' HG3' ' CE1' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -78.43 120.97 83.05 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-O 120.681 0.277 . . . . 0.0 110.288 179.101 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo . . . . . 0 N--CA 1.461 -0.391 0 C-N-CA 122.65 2.233 . . . . 0.0 112.332 -178.061 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.73 HD11 ' HD1' ' A' ' 21' ' ' TYR . 17.9 mt . . . . . 0 CA--C 1.516 -0.341 0 CA-C-O 120.723 0.297 . . . . 0.0 110.856 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.788 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 83.6 Cg_exo -53.7 144.34 54.05 Favored 'Trans proline' 0 CA--C 1.52 -0.198 0 C-N-CA 122.901 2.401 . . . . 0.0 110.774 170.744 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.0 m -58.12 92.38 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.29 0.567 . . . . 0.0 110.214 178.148 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.47 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 145.75 -29.21 1.72 Allowed Glycine 0 N--CA 1.438 -1.204 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.515 -173.722 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.788 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 93.2 m95 -90.64 131.07 36.55 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 176.639 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -124.04 117.44 24.73 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -179.087 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -81.8 103.55 11.56 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 121.66 0.743 . . . . 0.0 110.098 176.81 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.567 ' HD2' HG11 ' A' ' 22' ' ' VAL . 9.2 mtt-85 -107.94 174.88 5.68 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.638 -1.164 . . . . 0.0 109.105 -178.358 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.91 128.77 54.73 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 120.937 0.398 . . . . 0.0 110.467 -176.073 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -99.46 -2.97 34.66 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.609 0.719 . . . . 0.0 109.416 -179.235 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.628 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . . . -159.76 -156.41 0.5 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.909 -1.041 . . . . 0.0 109.915 -179.18 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.57 32.58 0.65 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.239 0.543 . . . . 0.0 111.188 -174.906 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 149.63 -6.81 0.78 Allowed Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.23 -177.624 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.628 ' HB2' ' HB3' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -79.16 101.44 7.93 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 175.533 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.53 134.87 36.61 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.124 -176.904 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 28.1 p90 -134.36 155.92 49.42 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.412 176.135 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.73 ' HD1' HD11 ' A' ' 5' ' ' LEU . 24.8 m-85 -106.45 113.71 27.39 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.352 0.596 . . . . 0.0 110.622 -175.497 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.567 HG11 ' HD2' ' A' ' 12' ' ' ARG . 2.3 p -108.55 111.17 34.83 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.208 -179.58 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.47 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 23.8 t-20 -82.21 121.77 27.06 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 178.1 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 59.8 m-70 -84.19 -17.86 38.54 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -169.067 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.7 p30 -95.34 -37.69 10.85 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.269 -0.572 . . . . 0.0 110.874 -179.028 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 19.5 t30 -93.75 -2.81 53.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.537 -0.302 . . . . 0.0 110.625 178.785 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 26.4 mtm180 55.58 45.89 23.97 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.461 176.701 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.04 131.61 56.31 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.108 0.48 . . . . 0.0 111.22 -178.714 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -111.35 96.34 6.06 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.955 -178.811 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.494 HG22 ' HZ3' ' A' ' 9' ' ' TRP . 1.8 t -116.46 145.38 43.33 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.238 0.542 . . . . 0.0 111.434 -175.22 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 31.8 m95 -99.85 7.9 44.58 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 171.435 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -97.2 144.57 26.89 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.522 -177.626 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.454 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 8.9 mmm180 -67.99 119.54 67.75 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-O 120.74 0.305 . . . . 0.0 111.213 177.776 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 6.7 Cg_exo . . . . . 0 C--N 1.342 0.214 0 C-N-CA 123.428 2.752 . . . . 0.0 112.518 178.068 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.821 HD11 ' HD1' ' A' ' 21' ' ' TYR . 28.3 mt . . . . . 0 N--CA 1.448 -0.535 0 CA-C-O 119.544 -0.265 . . . . 0.0 110.364 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.746 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 87.3 Cg_exo -58.41 42.16 0.05 OUTLIER 'Trans proline' 0 N--CA 1.489 1.229 0 C-N-CA 124.627 3.552 . . . . 0.0 115.749 176.266 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.8 m 66.43 -59.45 0.34 Allowed 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.993 0.917 . . . . 0.0 112.752 177.873 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -73.46 -19.59 79.7 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 121.194 -0.527 . . . . 0.0 112.163 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.8 ' HB3' HD13 ' A' ' 5' ' ' LEU . 93.6 m95 -87.58 137.81 32.02 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 179.699 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -128.23 122.4 31.7 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.926 179.012 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -82.66 117.9 22.94 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.135 0.493 . . . . 0.0 110.021 178.462 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.501 ' O ' ' HA ' ' A' ' 19' ' ' THR . 39.0 mtt180 -122.77 -176.47 3.4 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.887 -178.51 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -133.48 137.84 45.86 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.065 -179.024 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -77.85 -175.9 4.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.667 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.07 -28.53 69.67 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.726 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.8 mmtt -82.28 -27.37 32.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.874 0.369 . . . . 0.0 110.665 177.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 113.14 13.5 10.81 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.686 -0.769 . . . . 0.0 113.136 176.491 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.493 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.3 OUTLIER -84.95 142.04 29.93 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.848 0.356 . . . . 0.0 110.492 179.258 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.501 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 0.7 OUTLIER -79.11 125.09 28.96 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.339 -178.909 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -127.75 161.3 29.28 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 172.719 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.821 ' HD1' HD11 ' A' ' 5' ' ' LEU . 50.6 m-85 -112.89 111.28 21.92 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.535 0.683 . . . . 0.0 110.712 -173.313 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.486 HG11 ' HD2' ' A' ' 12' ' ' ARG . 3.0 p -108.51 107.64 23.32 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.035 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.455 -178.411 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.482 ' HB3' ' OG1' ' A' ' 28' ' ' THR . 54.3 t-20 -82.1 112.8 19.47 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.037 178.139 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -82.15 -17.31 46.79 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.068 0.461 . . . . 0.0 110.368 -176.37 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -81.44 -41.13 22.29 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.279 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 57.7 m-20 -97.99 -3.25 38.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.042 -178.52 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 57.76 52.31 8.27 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.982 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.482 ' OG1' ' HB3' ' A' ' 23' ' ' ASN . 33.8 p -124.25 132.15 53.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.995 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.67 78.87 1.61 Allowed 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 173.333 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.573 ' HB ' ' HZ3' ' A' ' 9' ' ' TRP . 0.9 OUTLIER -91.72 128.98 37.76 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.449 -169.043 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 39.5 m95 -101.61 58.97 0.86 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.27 0.557 . . . . 0.0 109.72 177.844 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -167.26 146.88 5.25 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.327 -176.797 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.469 ' HD2' ' OH ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -67.18 114.61 19.38 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-O 120.64 0.257 . . . . 0.0 110.659 177.562 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo . . . . . 0 N--CA 1.463 -0.277 0 C-N-CA 122.853 2.368 . . . . 0.0 112.688 -177.195 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.804 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 10.5 mt . . . . . 0 N--CA 1.45 -0.454 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.872 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 75.8 Cg_exo -54.35 163.74 3.34 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.855 2.37 . . . . 0.0 112.29 174.421 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.64 94.73 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.361 -177.321 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.416 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 128.38 -17.61 5.86 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.208 178.168 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.872 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 96.5 m95 -87.55 134.47 33.62 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 117.794 0.797 . . . . 0.0 110.165 -177.063 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -125.8 132.66 52.23 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.753 177.647 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.445 ' H ' ' HG3' ' A' ' 11' ' ' GLU . 0.0 OUTLIER -88.42 117.74 27.57 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.274 0.559 . . . . 0.0 110.893 -178.998 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.6 ttp85 -121.68 -177.95 3.69 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.523 0.678 . . . . 0.0 110.32 177.744 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.45 129.3 23.2 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.445 -177.103 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -81.7 176.01 9.99 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 120.788 -0.365 . . . . 0.0 110.467 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.16 -19.89 63.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.902 0.382 . . . . 0.0 111.269 -178.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.5 mttp -71.89 -28.15 63.32 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.548 176.392 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 112.07 -23.29 16.83 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.454 -178.468 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.77 144.3 52.74 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.975 0.417 . . . . 0.0 111.929 -176.15 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.19 138.48 32.34 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.632 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 49.0 p90 -141.1 162.75 34.75 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 172.645 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.629 ' HD1' HD11 ' A' ' 5' ' ' LEU . 8.9 m-85 -111.93 120.24 41.25 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.134 0.492 . . . . 0.0 110.839 -174.368 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.448 ' HB ' HG23 ' A' ' 29' ' ' THR . 2.5 p -109.22 114.4 46.81 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.01 179.034 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.431 ' HB2' ' CE3' ' A' ' 9' ' ' TRP . 57.5 t-20 -88.74 113.67 24.55 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.92 -179.535 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -80.72 -16.14 54.69 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.769 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -85.88 -32.96 21.38 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.486 -179.339 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -104.13 -11.0 17.55 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.2 -178.2 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 65.1 37.47 6.66 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.0 -179.131 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.64 141.23 51.96 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.953 0.406 . . . . 0.0 111.382 -178.455 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.448 HG23 ' HB ' ' A' ' 22' ' ' VAL . 0.2 OUTLIER -114.93 93.47 4.33 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.856 178.471 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.6 146.48 25.25 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.289 0.566 . . . . 0.0 111.335 -173.418 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 55.9 m95 -106.93 8.4 30.54 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.834 177.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.7 t -110.28 161.52 15.53 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.81 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.48 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 0.0 OUTLIER -77.03 121.71 85.16 Favored Pre-proline 0 C--N 1.321 -0.64 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 176.447 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.48 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 17.6 Cg_exo . . . . . 0 C--N 1.345 0.377 0 C-N-CA 122.883 2.389 . . . . 0.0 112.44 -177.036 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.863 HD11 ' HD1' ' A' ' 21' ' ' TYR . 27.8 mt . . . . . 0 N--CA 1.454 -0.258 0 CA-C-O 120.803 0.335 . . . . 0.0 111.583 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.674 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 86.4 Cg_exo -54.95 167.15 1.72 Allowed 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 123.426 2.751 . . . . 0.0 111.815 170.493 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.97 -8.28 15.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.837 0.351 . . . . 0.0 111.655 -177.562 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -113.94 -0.56 24.16 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.615 -179.098 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.674 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 84.2 m95 -109.35 131.18 55.31 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 117.793 0.796 . . . . 0.0 110.001 -178.519 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -114.21 133.17 55.8 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.713 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.526 ' HG2' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -87.19 118.47 26.62 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 178.85 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -114.28 175.54 5.43 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.144 0.497 . . . . 0.0 110.133 179.591 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.41 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -140.3 132.3 27.81 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.933 -178.269 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.09 27.88 0.98 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.055 -179.153 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 73.01 -34.63 0.3 Allowed 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 123.546 0.738 . . . . 0.0 112.635 176.469 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -90.02 35.27 0.85 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.062 0.458 . . . . 0.0 111.027 -178.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 72.8 5.49 64.7 Favored Glycine 0 C--N 1.328 0.102 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.119 178.752 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.41 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -83.56 101.76 11.68 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 -177.001 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 4.7 m -90.36 122.25 33.08 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.075 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 37.5 p90 -129.24 158.43 39.07 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.054 0.454 . . . . 0.0 109.999 178.302 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.863 ' HD1' HD11 ' A' ' 5' ' ' LEU . 46.2 m-85 -105.7 117.7 34.69 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.385 -174.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.7 p -110.98 114.77 48.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.847 0 CA-C-O 121.626 0.726 . . . . 0.0 110.092 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -84.41 126.21 33.04 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.43 -179.253 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 -84.89 -12.53 53.26 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -171.483 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -83.32 -59.17 2.55 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.141 0.496 . . . . 0.0 110.042 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -87.89 -15.62 36.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.872 -176.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 69.46 34.73 2.74 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.271 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.5 134.47 33.67 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.702 178.017 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.5 91.66 4.14 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 176.356 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.613 HG23 HG22 ' A' ' 32' ' ' THR . 0.9 OUTLIER -105.85 122.38 45.99 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.354 -168.038 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 67.2 m95 -97.36 40.03 1.17 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.551 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.613 HG22 HG23 ' A' ' 30' ' ' THR . 6.6 t -156.89 172.14 19.18 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.461 -0.79 . . . . 0.0 108.884 -177.44 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.548 ' HD2' ' HA ' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -74.13 134.38 77.47 Favored Pre-proline 0 C--N 1.318 -0.77 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.569 177.911 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo . . . . . 0 C--N 1.349 0.573 0 C-N-CA 123.422 2.748 . . . . 0.0 112.948 174.539 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.87 HD13 ' HB3' ' A' ' 9' ' ' TRP . 14.8 mt . . . . . 0 N--CA 1.454 -0.244 0 CA-C-O 120.31 0.1 . . . . 0.0 110.823 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.771 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 75.6 Cg_exo -59.32 -167.14 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.363 2.709 . . . . 0.0 113.458 174.966 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.18 -49.44 75.95 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.233 -0.894 . . . . 0.0 112.713 -174.901 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.55 ' HA3' ' OD1' ' A' ' 25' ' ' ASN . . . -116.34 19.59 13.01 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 119.968 -1.11 . . . . 0.0 114.309 -172.529 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.87 ' HB3' HD13 ' A' ' 5' ' ' LEU . 92.5 m95 -100.28 140.25 34.8 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 117.819 0.809 . . . . 0.0 110.125 -179.09 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.523 ' OE1' ' HD2' ' A' ' 12' ' ' ARG . 21.4 tt0 -133.51 125.13 28.25 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 177.438 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -85.2 119.55 25.7 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.941 0.4 . . . . 0.0 110.322 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.523 ' HD2' ' OE1' ' A' ' 10' ' ' GLU . 0.3 OUTLIER -116.6 -166.5 1.16 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.956 178.98 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.504 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.4 OUTLIER -135.1 149.1 49.99 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.634 -174.511 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -78.48 -164.99 0.63 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.261 177.17 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.46 -20.41 63.1 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -178.531 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.419 ' HD3' ' HA ' ' A' ' 16' ' ' LYS . 61.5 mmtt -107.47 -50.6 3.05 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.757 0.313 . . . . 0.0 111.217 -178.586 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 152.97 21.48 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.592 -0.813 . . . . 0.0 113.071 -179.717 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.504 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -77.63 128.82 34.74 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 177.397 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.441 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 0.2 OUTLIER -80.59 113.02 18.49 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.031 0.443 . . . . 0.0 111.753 -176.468 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.8 p90 -120.97 156.86 31.18 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 173.312 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.781 ' HD1' HD11 ' A' ' 5' ' ' LEU . 20.8 m-85 -106.4 122.18 45.75 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.23 0.538 . . . . 0.0 110.929 -172.723 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.415 HG11 ' HD3' ' A' ' 12' ' ' ARG . 2.5 p -119.16 111.16 32.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.787 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.229 179.398 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 31.8 t-20 -77.71 128.17 33.62 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 177.062 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 65.7 m-70 -95.19 -15.07 23.55 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -168.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.55 ' OD1' ' HA3' ' A' ' 8' ' ' GLY . 10.6 p-10 -103.52 -20.21 14.11 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.95 179.621 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -105.71 -16.06 14.79 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.087 0.47 . . . . 0.0 110.198 175.205 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.12 50.0 2.55 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.426 177.626 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -112.65 128.35 56.36 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.991 178.609 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.17 103.51 12.72 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.731 176.774 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.553 HG23 ' H ' ' A' ' 32' ' ' THR . 1.4 t -125.12 147.92 48.79 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.422 0.63 . . . . 0.0 111.667 -174.181 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 57.1 m95 -106.63 39.99 1.72 Allowed 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 174.265 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.553 ' H ' HG23 ' A' ' 30' ' ' THR . 0.5 OUTLIER -136.32 154.67 50.79 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.47 -178.102 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.434 HH11 ' HD3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -75.88 112.39 19.81 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-O 120.743 0.306 . . . . 0.0 110.8 -179.187 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 31.6 Cg_exo . . . . . 0 C--N 1.345 0.349 0 C-N-CA 123.26 2.64 . . . . 0.0 112.607 -179.702 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.748 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 39.1 mt . . . . . 0 N--CA 1.448 -0.546 0 CA-C-O 120.607 0.242 . . . . 0.0 110.642 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.729 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 75.6 Cg_exo -56.67 164.13 6.21 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 122.452 2.101 . . . . 0.0 110.839 166.856 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -66.69 -8.8 30.3 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.94 0.4 . . . . 0.0 111.374 -177.13 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -99.87 -21.47 13.98 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 121.013 -0.613 . . . . 0.0 113.231 177.997 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.748 ' HB2' ' HB3' ' A' ' 5' ' ' LEU . 74.3 m95 -96.35 143.67 27.2 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 117.442 0.621 . . . . 0.0 110.097 -173.599 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -136.38 131.66 34.51 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.111 178.57 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -83.24 125.51 31.65 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.127 0.489 . . . . 0.0 110.095 178.261 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 2.6 ttt180 -121.69 -166.15 1.34 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.912 179.065 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.615 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 28.6 mtpt -135.85 149.22 48.96 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.186 -179.758 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.438 ' CG ' ' H ' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -95.06 177.17 5.97 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.426 175.55 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.42 -28.02 67.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.821 0.343 . . . . 0.0 111.778 -177.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.438 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 2.6 mtmp? -88.1 -9.48 53.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.238 -178.881 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 100.67 11.99 39.18 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.752 -0.737 . . . . 0.0 113.158 176.659 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.615 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -77.04 161.2 28.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 117.082 0.441 . . . . 0.0 110.302 178.606 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.53 116.85 32.75 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.952 -178.806 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.8 p90 -125.12 157.94 35.12 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 175.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.619 ' CD1' HD11 ' A' ' 5' ' ' LEU . 31.5 m-85 -106.29 118.8 37.58 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.397 0.618 . . . . 0.0 110.804 -175.332 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.1 p -108.83 110.94 33.91 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.089 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.421 ' HB2' ' CD2' ' A' ' 9' ' ' TRP . 23.2 t30 -84.31 121.47 27.56 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.457 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -82.05 -21.49 36.89 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.45 -174.1 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.96 -57.92 3.7 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.415 -177.184 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -101.2 1.81 39.38 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.343 -177.712 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.1 29.21 17.53 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 123.577 0.548 . . . . 0.0 111.64 -179.031 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.6 129.71 34.99 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.967 0.413 . . . . 0.0 110.353 177.213 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -118.96 107.28 13.35 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.203 -178.841 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.632 HG22 ' HZ3' ' A' ' 9' ' ' TRP . 6.5 t -127.56 149.24 50.24 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.208 0.528 . . . . 0.0 111.697 -175.588 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.436 ' HZ3' ' HB3' ' A' ' 18' ' ' ARG . 16.4 m95 -97.92 7.95 45.52 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 172.507 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -103.92 150.79 23.86 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 114.26 -1.336 . . . . 0.0 110.352 -176.87 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.502 ' HD2' ' HA ' ' A' ' 33' ' ' ARG . 11.0 mmm180 -72.68 121.32 84.64 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-O 120.762 0.315 . . . . 0.0 110.91 177.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 21.9 Cg_exo . . . . . 0 C--O 1.236 0.415 0 C-N-CA 122.906 2.404 . . . . 0.0 112.058 179.271 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.596 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 36.4 mt . . . . . 0 N--CA 1.454 -0.275 0 CA-C-O 120.718 0.294 . . . . 0.0 110.624 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.819 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 77.7 Cg_exo -57.27 156.08 26.98 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 122.841 2.361 . . . . 0.0 111.23 170.561 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.42 90.06 0.07 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.104 0.478 . . . . 0.0 110.654 179.6 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 142.08 -15.72 2.57 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.417 -178.787 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.819 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 86.6 m95 -93.46 143.86 25.89 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 117.152 0.476 . . . . 0.0 109.841 179.654 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -137.62 136.12 37.22 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.364 -177.774 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.83 124.79 34.0 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.778 0.323 . . . . 0.0 110.237 178.456 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 73.5 mtt180 -131.91 172.5 12.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.851 0.358 . . . . 0.0 110.33 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.449 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -117.88 161.39 19.83 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.107 -174.365 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.438 ' CG ' ' H ' ' A' ' 16' ' ' LYS . 1.1 p-10 -111.55 -171.93 1.94 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.908 176.418 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.11 -13.19 60.21 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -178.203 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.438 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -89.18 -35.15 16.39 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.636 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 118.94 20.92 3.97 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 121.07 -0.586 . . . . 0.0 112.121 179.535 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.449 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -95.89 153.92 17.5 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.634 0.254 . . . . 0.0 110.488 -179.837 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.6 m -106.53 116.41 31.89 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.269 179.032 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -114.99 163.67 15.26 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 175.55 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.591 ' HD1' HD11 ' A' ' 5' ' ' LEU . 75.0 m-85 -110.28 122.84 48.62 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.504 0.668 . . . . 0.0 110.827 -177.518 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.4 p -115.31 118.37 58.58 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.032 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -82.64 132.51 35.18 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 176.705 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 34.0 m-70 -87.59 -31.96 19.58 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -169.582 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -87.06 -35.03 18.96 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.107 0.479 . . . . 0.0 110.543 -179.505 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -85.46 -28.72 24.84 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.475 178.167 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 64.63 46.56 3.13 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.955 -177.287 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.92 132.91 53.61 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.331 177.469 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -111.92 101.48 9.79 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.09 0.471 . . . . 0.0 109.952 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.5 t -120.55 150.1 41.39 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.152 0.501 . . . . 0.0 110.815 -175.629 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -99.39 46.28 0.98 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.293 0.568 . . . . 0.0 109.646 179.053 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.9 t -153.98 141.49 19.79 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.227 -0.897 . . . . 0.0 108.793 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.439 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 0.0 OUTLIER -88.08 112.81 51.73 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-O 121.623 0.725 . . . . 0.0 109.665 178.948 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.503 ' HG2' ' CE2' ' A' ' 9' ' ' TRP . 3.6 Cg_exo . . . . . 0 N--CA 1.458 -0.595 0 C-N-CA 123.553 2.836 . . . . 0.0 112.628 -173.092 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.723 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 19.6 mt . . . . . 0 N--CA 1.453 -0.295 0 CA-C-O 120.689 0.281 . . . . 0.0 110.928 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.892 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 52.2 Cg_exo -61.0 -179.47 0.3 Allowed 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.352 2.701 . . . . 0.0 112.776 175.856 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.12 104.35 0.24 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.024 -177.28 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.511 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 95.73 5.38 60.02 Favored Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 120.998 -0.62 . . . . 0.0 113.744 173.905 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.892 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 82.1 m95 -91.67 130.8 37.4 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 117.804 0.802 . . . . 0.0 109.832 -179.49 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -132.14 145.85 51.65 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 178.471 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.95 137.54 37.35 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.319 0.581 . . . . 0.0 110.241 179.258 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.9 mtm180 -130.81 177.45 7.4 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.839 177.145 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.441 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -135.98 135.65 39.7 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.408 0.623 . . . . 0.0 111.356 -177.346 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.617 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . 12.3 t70 -67.81 159.99 29.19 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.151 -0.932 . . . . 0.0 108.8 172.011 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.1 -29.2 63.32 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.743 0.306 . . . . 0.0 111.811 -178.096 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.7 mttp -85.74 4.43 36.78 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.163 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 86.33 34.37 12.39 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.628 177.951 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.617 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 1.9 mtp180 -95.72 128.52 42.67 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 179.187 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 32.9 m -90.94 125.18 35.7 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.988 0.423 . . . . 0.0 111.361 -175.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -139.94 162.7 34.56 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 176.308 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.549 ' HD1' HD11 ' A' ' 5' ' ' LEU . 71.1 m-85 -113.72 125.86 54.59 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.154 0.502 . . . . 0.0 110.803 -175.819 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.8 p -116.23 110.38 31.38 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.174 -178.89 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.511 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 33.5 t-20 -81.91 117.86 22.49 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 176.141 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -78.07 -22.78 48.53 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.867 0.365 . . . . 0.0 110.95 -174.381 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -81.74 -43.66 18.11 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.522 -178.158 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.423 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 43.4 t30 -100.54 6.21 44.19 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.733 -178.691 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.423 ' HG2' ' O ' ' A' ' 26' ' ' ASN . 7.9 ptp180 45.54 35.84 2.23 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.295 1.038 . . . . 0.0 112.638 -179.394 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.76 122.34 43.76 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 121.073 0.463 . . . . 0.0 111.24 -178.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -104.47 86.46 2.52 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.164 178.326 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.519 HG23 ' H ' ' A' ' 32' ' ' THR . 1.3 t -98.9 153.0 19.15 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.072 -174.604 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 57.2 m95 -107.42 24.34 13.02 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.471 0.653 . . . . 0.0 109.482 178.048 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.519 ' H ' HG23 ' A' ' 30' ' ' THR . 0.6 OUTLIER -123.74 159.26 29.83 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.252 -177.439 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.94 114.36 43.44 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 175.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo . . . . . 0 C--O 1.233 0.259 0 C-N-CA 122.946 2.431 . . . . 0.0 112.82 -179.428 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.788 HD11 ' HD1' ' A' ' 21' ' ' TYR . 59.3 mt . . . . . 0 N--CA 1.448 -0.55 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.702 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 72.9 Cg_exo -58.64 171.92 1.75 Allowed 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.964 2.442 . . . . 0.0 112.159 171.474 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.79 7.37 1.15 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.18 -0.464 . . . . 0.0 112.129 -175.477 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -137.73 6.65 3.53 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.999 178.68 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' TRP . . . . . 0.764 ' HB3' HD13 ' A' ' 5' ' ' LEU . 79.6 m95 -111.47 134.39 53.08 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 117.268 0.534 . . . . 0.0 109.577 -178.864 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.617 ' OE1' ' HD2' ' A' ' 12' ' ' ARG . 43.3 tt0 -120.08 121.51 39.02 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.044 -178.793 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -85.03 117.7 24.15 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.024 0.44 . . . . 0.0 109.839 177.211 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.617 ' HD2' ' OE1' ' A' ' 10' ' ' GLU . 2.3 mtp180 -115.18 -170.0 1.67 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.36 -178.254 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.06 134.04 30.8 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.167 -175.764 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.416 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . 5.8 t70 -76.82 164.82 25.48 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.523 173.784 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.76 -22.77 67.07 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.071 0.462 . . . . 0.0 111.261 -177.759 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.487 ' HG3' ' HG2' ' A' ' 18' ' ' ARG . 13.5 pttm -96.24 14.88 22.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.344 178.918 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 72.13 45.65 39.41 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.499 178.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.487 ' HG2' ' HG3' ' A' ' 16' ' ' LYS . 6.6 mmt-85 -106.21 143.4 34.4 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 178.612 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.1 m -100.33 115.17 29.33 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.613 -175.272 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.1 p90 -133.84 161.67 34.11 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.998 -0.547 . . . . 0.0 109.828 175.171 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.788 ' HD1' HD11 ' A' ' 5' ' ' LEU . 35.7 m-85 -116.62 125.07 51.27 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.243 0.544 . . . . 0.0 110.673 -175.064 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.598 HG11 ' HD3' ' A' ' 12' ' ' ARG . 2.5 p -118.8 108.85 25.09 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 121.815 0.817 . . . . 0.0 110.574 -178.407 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -80.85 116.32 20.78 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.143 -0.935 . . . . 0.0 108.779 178.349 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -86.4 -16.15 38.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.802 0.334 . . . . 0.0 111.375 -174.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -76.55 -36.07 57.86 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.936 0.398 . . . . 0.0 110.425 -179.193 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -113.12 -2.82 14.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.057 -179.098 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 57.74 52.76 7.78 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.045 -178.657 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.6 130.21 56.75 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.904 179.35 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.55 105.44 15.08 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.798 177.774 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.422 HG22 ' HZ3' ' A' ' 9' ' ' TRP . 0.7 OUTLIER -127.81 152.59 47.6 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 120.765 0.317 . . . . 0.0 110.926 -176.279 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 46.6 m95 -101.15 -3.18 29.63 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.917 0.865 . . . . 0.0 108.718 173.123 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.449 ' O ' ' HD3' ' A' ' 34' ' ' PRO . 1.8 m -74.52 136.91 42.18 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.334 -1.303 . . . . 0.0 110.339 177.806 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.08 110.86 11.18 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.637 0.256 . . . . 0.0 110.7 177.696 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.536 ' HG2' HD22 ' A' ' 5' ' ' LEU . 73.4 Cg_endo . . . . . 0 N--CA 1.456 -0.699 0 C-N-CA 122.642 2.228 . . . . 0.0 112.642 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.586 0 N-CA-C 111.702 -0.559 . . . . 0.0 111.702 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -114.46 114.75 45.0 Favored Pre-proline 0 C--N 1.323 -0.556 0 CA-C-O 120.815 0.34 . . . . 0.0 111.195 -178.626 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -68.2 142.0 54.1 Favored 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 122.843 2.362 . . . . 0.0 111.176 174.433 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.27 -27.4 4.78 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.921 -0.657 . . . . 0.0 111.668 179.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.817 HD21 ' HD2' ' A' ' 21' ' ' TYR . 5.2 mp -76.39 127.11 85.4 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-O 120.626 0.25 . . . . 0.0 110.768 178.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.833 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 82.9 Cg_exo -53.43 160.88 4.5 Favored 'Trans proline' 0 N--CA 1.477 0.543 0 C-N-CA 123.833 3.022 . . . . 0.0 113.578 177.024 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 m -63.58 103.77 0.57 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.449 176.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 128.61 -22.08 5.27 Favored Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 111.253 -0.739 . . . . 0.0 111.253 -176.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.833 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 71.0 m95 -86.43 141.51 29.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.921 0.391 . . . . 0.0 110.264 178.638 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -136.52 150.16 48.51 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 176.154 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.49 145.5 31.73 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 177.034 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -145.26 -175.13 4.58 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.998 0.427 . . . . 0.0 109.997 176.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.428 ' HE3' HG23 ' A' ' 19' ' ' THR . 3.5 mttt -139.21 152.99 47.8 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.873 -178.379 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.502 ' OD1' ' HB2' ' A' ' 18' ' ' ARG . 1.0 OUTLIER -91.49 19.93 5.76 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.289 0.566 . . . . 0.0 110.398 178.936 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.401 ' HB3' ' O ' ' A' ' 14' ' ' ASP . . . 78.46 -27.96 0.16 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 114.626 -1.17 . . . . 0.0 111.599 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.54 42.06 1.14 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.824 0.821 . . . . 0.0 111.394 -176.269 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.93 -31.53 3.07 Favored Glycine 0 C--N 1.32 -0.351 0 CA-C-N 114.596 -1.184 . . . . 0.0 113.511 175.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.502 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 0.1 OUTLIER -62.94 122.76 16.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.111 0.482 . . . . 0.0 111.135 -174.591 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.428 HG23 ' HE3' ' A' ' 13' ' ' LYS . 25.5 m -103.83 116.85 33.05 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.41 -178.037 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.8 p90 -120.32 154.56 34.84 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.946 0.403 . . . . 0.0 109.929 178.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.817 ' HD2' HD21 ' A' ' 5' ' ' LEU . 79.7 m-85 -105.95 121.17 43.56 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.406 0.622 . . . . 0.0 110.34 -176.069 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 p -115.2 110.97 33.87 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 CA-C-O 121.787 0.803 . . . . 0.0 110.126 -176.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -89.88 122.48 32.97 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.319 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -89.99 -25.87 20.64 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.042 -175.108 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.46 -32.48 60.65 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.759 -177.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -110.81 -0.54 16.92 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.751 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER 58.06 45.9 17.11 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.436 178.043 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -113.09 144.82 41.97 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.612 -176.006 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.64 100.84 7.69 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 173.847 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.413 ' HB ' ' HZ3' ' A' ' 9' ' ' TRP . 1.1 m -115.99 127.19 54.74 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.44 -168.111 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -95.08 59.56 2.28 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.565 0.698 . . . . 0.0 109.118 175.337 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -167.61 145.33 4.55 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.9 -172.192 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.414 ' HA ' ' HD2' ' A' ' 34' ' ' PRO . 0.1 OUTLIER -69.31 117.55 53.48 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-O 120.966 0.412 . . . . 0.0 110.596 178.211 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.414 ' HD2' ' HA ' ' A' ' 33' ' ' ARG . 24.9 Cg_endo -62.33 134.62 49.48 Favored 'Trans proline' 0 C--O 1.237 0.433 0 C-N-CA 123.153 2.569 . . . . 0.0 113.112 -177.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -103.1 -12.82 8.83 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.469 0 CA-C-O 121.67 0.748 . . . . 0.0 110.151 178.005 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.311 -1.069 0 CA-C-N 114.005 -1.452 . . . . 0.0 109.207 179.244 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.723 0 N-CA-C 112.073 -0.411 . . . . 0.0 112.073 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -62.17 -49.16 85.91 Favored Pre-proline 0 CA--C 1.538 0.491 0 N-CA-C 111.432 0.16 . . . . 0.0 111.432 178.694 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -76.95 -135.03 0.02 OUTLIER 'Trans proline' 0 C--N 1.357 0.977 0 C-N-CA 122.273 1.982 . . . . 0.0 111.397 174.181 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -70.0 -63.52 3.27 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.686 -0.768 . . . . 0.0 111.634 176.588 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.605 HD11 ' HD1' ' A' ' 21' ' ' TYR . 18.0 mt -127.03 155.8 75.32 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 110.486 -0.191 . . . . 0.0 110.486 177.206 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.793 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 77.9 Cg_exo -56.63 152.78 39.34 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.809 2.34 . . . . 0.0 111.105 170.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.6 92.35 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.471 0.653 . . . . 0.0 110.308 177.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.456 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 141.25 -16.49 2.73 Favored Glycine 0 N--CA 1.443 -0.876 0 CA-C-N 115.683 -0.689 . . . . 0.0 112.359 -176.463 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.793 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 91.6 m95 -97.86 137.94 35.96 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 109.236 -0.654 . . . . 0.0 109.236 177.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.435 ' HB3' HG13 ' A' ' 22' ' ' VAL . 23.8 tt0 -126.89 127.97 45.75 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -91.29 110.31 21.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.763 0.792 . . . . 0.0 110.408 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.616 ' O ' ' HA ' ' A' ' 19' ' ' THR . 1.8 mtt180 -100.73 168.2 9.83 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.431 -178.158 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.709 ' HB3' ' HA2' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -128.09 98.16 5.02 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.047 0.451 . . . . 0.0 110.046 -177.505 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.463 ' HB2' ' CE1' ' A' ' 20' ' ' TYR . 23.7 t70 -80.67 134.05 35.81 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.619 -174.325 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 62.72 -99.97 0.09 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.088 173.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.68 -6.81 59.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.968 0.413 . . . . 0.0 111.074 -176.091 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.709 ' HA2' ' HB3' ' A' ' 13' ' ' LYS . . . 118.71 25.47 2.83 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.533 -0.841 . . . . 0.0 111.902 -177.605 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.412 ' HB3' ' HZ3' ' A' ' 31' ' ' TRP . 11.9 mtm180 -72.21 112.64 8.47 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 176.804 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.616 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 2.7 m -76.19 124.66 27.81 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.137 0.494 . . . . 0.0 112.249 -174.198 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.463 ' CE1' ' HB2' ' A' ' 14' ' ' ASP . 43.5 p90 -132.59 158.84 41.18 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.266 173.482 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.605 ' HD1' HD11 ' A' ' 5' ' ' LEU . 36.4 m-85 -108.58 121.31 44.72 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.265 0.555 . . . . 0.0 111.316 -174.164 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.57 ' CG1' ' HG3' ' A' ' 12' ' ' ARG . 2.5 p -116.34 109.32 27.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.026 -178.654 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.456 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 17.7 t-20 -79.13 131.33 36.19 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 177.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 62.5 m-70 -94.24 -7.97 40.52 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -170.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -91.24 -54.87 3.75 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.35 0.595 . . . . 0.0 109.716 177.365 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 32.2 t-20 -89.53 -6.12 56.66 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.457 -179.236 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.448 ' HA ' ' HD2' ' A' ' 27' ' ' ARG . 0.5 OUTLIER 58.77 32.25 22.02 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.495 178.074 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.72 124.35 32.89 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.16 0.505 . . . . 0.0 110.818 178.902 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.3 98.44 7.98 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.77 178.584 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.6 t -117.55 143.75 45.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.278 0.561 . . . . 0.0 111.743 -172.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.412 ' HZ3' ' HB3' ' A' ' 18' ' ' ARG . 80.6 m95 -101.48 42.24 1.14 Allowed 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 172.72 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -140.57 151.07 44.42 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.736 -1.12 . . . . 0.0 109.283 -174.132 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.509 ' HD2' ' HA ' ' A' ' 33' ' ' ARG . 1.1 mmm180 -75.77 117.43 63.6 Favored Pre-proline 0 C--N 1.322 -0.616 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 177.065 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -54.12 122.26 11.12 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 123.086 2.524 . . . . 0.0 111.956 -178.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -88.77 41.01 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 121.737 0.779 . . . . 0.0 110.876 -176.007 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.308 -1.197 0 CA-C-N 114.429 -1.259 . . . . 0.0 108.806 -178.358 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.584 0 N-CA-C 111.859 -0.496 . . . . 0.0 111.859 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.488 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.1 OUTLIER -80.24 124.57 82.55 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-O 120.754 0.311 . . . . 0.0 110.787 -178.94 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.488 ' HD3' ' HA ' ' A' ' 2' ' ' SER . 0.9 OUTLIER -83.0 -141.34 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.811 0 C-N-CA 122.943 2.429 . . . . 0.0 112.272 -179.774 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.401 ' H ' ' HB2' ' A' ' 3' ' ' PRO . . . 117.15 -31.54 5.8 Favored Glycine 0 N--CA 1.449 -0.451 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 -177.814 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.71 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 19.9 mt -84.26 152.69 61.79 Favored Pre-proline 0 C--N 1.324 -0.514 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 176.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.878 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 79.8 Cg_exo -54.66 160.47 7.25 Favored 'Trans proline' 0 C--O 1.237 0.437 0 C-N-CA 122.827 2.352 . . . . 0.0 111.736 173.725 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.55 88.54 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.746 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 137.3 -8.93 3.79 Favored Glycine 0 N--CA 1.442 -0.907 0 C-N-CA 120.33 -0.938 . . . . 0.0 113.304 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.878 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 88.0 m95 -95.63 140.58 30.24 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 117.869 0.834 . . . . 0.0 109.936 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -131.65 140.58 49.4 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -179.099 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -93.24 138.03 32.01 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.026 0.441 . . . . 0.0 110.96 -177.385 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.422 ' HG3' HG11 ' A' ' 22' ' ' VAL . 3.8 mtt180 -132.26 175.83 8.92 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.224 174.145 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 7.7 mptt -130.09 160.89 32.37 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 121.188 0.518 . . . . 0.0 111.128 -175.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -91.22 8.28 36.61 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.683 178.504 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 72.53 7.78 5.62 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.937 178.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.1 mttp -116.82 -32.89 4.97 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.124 0.488 . . . . 0.0 110.128 175.227 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 145.19 8.34 0.36 Allowed Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.009 177.27 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.03 126.78 44.82 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.9 0.35 . . . . 0.0 110.212 177.359 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.86 120.91 41.44 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.384 -176.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 29.8 p90 -115.89 164.48 14.35 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 175.317 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -110.3 126.26 54.01 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.062 0.458 . . . . 0.0 111.063 -175.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.422 HG11 ' HG3' ' A' ' 12' ' ' ARG . 2.6 p -118.93 115.16 47.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-O 121.647 0.736 . . . . 0.0 110.263 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 41.1 t-20 -91.3 107.98 19.57 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.33 -0.85 . . . . 0.0 108.981 178.143 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -78.64 -5.4 52.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.762 0.315 . . . . 0.0 111.306 -173.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -100.26 -29.41 12.46 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.868 0.366 . . . . 0.0 110.536 -177.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -107.69 -3.9 18.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.773 178.741 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 27' ' ' ARG . 0.0 OUTLIER 57.7 54.19 6.51 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.197 -179.357 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.22 130.22 49.25 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.984 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.405 HG23 ' HB ' ' A' ' 22' ' ' VAL . 0.0 OUTLIER -117.9 101.0 7.94 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 176.638 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 10.7 t -116.09 148.4 40.29 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.221 0.534 . . . . 0.0 111.848 -173.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.3 m95 -99.52 14.88 28.37 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.374 -0.83 . . . . 0.0 108.782 172.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -105.66 153.62 21.57 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 114.868 -1.06 . . . . 0.0 109.796 -179.664 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -85.9 116.73 66.85 Favored Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.043 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -69.7 87.61 0.54 Allowed 'Trans proline' 0 N--CA 1.462 -0.371 0 C-N-CA 122.844 2.362 . . . . 0.0 112.274 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -83.77 6.93 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.982 0.896 . . . . 0.0 109.944 177.319 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 2.3 ttm . . . . . 0 C--N 1.311 -1.069 0 CA-C-N 113.969 -1.469 . . . . 0.0 108.848 178.164 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.798 0 N-CA-C 112.037 -0.425 . . . . 0.0 112.037 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.1 m 58.02 71.94 0.96 Allowed Pre-proline 0 N--CA 1.466 0.33 0 C-N-CA 122.874 0.47 . . . . 0.0 111.187 -178.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -64.17 -39.67 29.79 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.877 2.385 . . . . 0.0 112.341 -178.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.13 111.45 1.7 Allowed Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 111.07 -0.812 . . . . 0.0 111.07 -177.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.755 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 30.1 mt -132.54 164.8 40.97 Favored Pre-proline 0 C--N 1.323 -0.586 0 O-C-N 122.881 -0.187 . . . . 0.0 111.294 -174.166 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.768 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 81.2 Cg_exo -59.78 35.7 0.05 OUTLIER 'Trans proline' 0 N--CA 1.486 1.088 0 C-N-CA 124.444 3.429 . . . . 0.0 115.417 175.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.412 ' H ' ' C ' ' A' ' 5' ' ' LEU . 70.8 m 68.14 -54.27 0.52 Allowed 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 123.629 0.771 . . . . 0.0 112.54 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -80.06 -2.16 88.51 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 121.099 -0.572 . . . . 0.0 112.374 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.768 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 83.5 m95 -102.29 138.42 39.25 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.648 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -129.52 139.08 51.65 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.898 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -87.67 137.79 32.03 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.888 0.375 . . . . 0.0 110.092 178.219 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 12' ' ' ARG . 1.4 mtp85 -135.87 -177.21 4.59 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.302 176.722 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.64 142.63 51.3 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.679 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.07 -172.71 2.9 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.688 -178.431 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.24 -36.17 75.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.493 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 19.5 mttm -73.91 -54.39 8.05 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 134.13 20.81 0.81 Allowed Glycine 0 N--CA 1.444 -0.767 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.366 178.765 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.41 ' HB3' ' HZ3' ' A' ' 31' ' ' TRP . 0.1 OUTLIER -83.94 147.47 27.46 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 110.34 -0.245 . . . . 0.0 110.34 -179.995 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -82.29 105.41 13.34 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.818 0.342 . . . . 0.0 111.022 178.423 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 42.0 p90 -109.24 152.96 24.5 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 172.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.717 ' HD1' HD11 ' A' ' 5' ' ' LEU . 56.6 m-85 -107.56 123.69 48.82 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.289 0.566 . . . . 0.0 110.478 -174.418 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.4 p -117.02 114.91 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.612 -177.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.413 ' HB2' ' CD2' ' A' ' 9' ' ' TRP . 26.5 t-20 -82.43 122.24 27.77 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.982 -1.008 . . . . 0.0 108.334 174.549 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -83.96 -42.95 15.72 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -168.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.28 -42.12 72.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.785 0.326 . . . . 0.0 110.996 -176.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -87.77 -10.76 50.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.568 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 56.62 54.75 7.04 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.996 -179.048 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -116.46 134.19 55.15 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.496 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.63 111.57 17.81 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.424 -179.33 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.415 HG22 ' CZ3' ' A' ' 9' ' ' TRP . 6.5 t -127.27 153.33 46.27 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.568 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.41 ' HZ3' ' HB3' ' A' ' 18' ' ' ARG . 44.9 m95 -104.33 14.96 29.25 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.359 0.599 . . . . 0.0 109.611 178.227 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -117.89 165.15 14.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.237 178.608 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 12.6 mtp85 -86.83 113.56 53.81 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-O 120.734 0.302 . . . . 0.0 110.798 179.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.408 ' HG3' ' CD2' ' A' ' 9' ' ' TRP . 58.1 Cg_endo -73.35 136.12 23.57 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 C-N-CA 122.807 2.338 . . . . 0.0 112.419 178.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -116.4 8.71 7.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.579 0.704 . . . . 0.0 110.712 -179.046 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.077 0 CA-C-N 114.557 -1.201 . . . . 0.0 109.651 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.817 0 N-CA-C 111.851 -0.5 . . . . 0.0 111.851 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -105.13 105.04 50.22 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 176.426 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -71.88 -175.33 1.62 Allowed 'Trans proline' 0 C--O 1.235 0.344 0 C-N-CA 122.818 2.345 . . . . 0.0 112.131 -178.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -78.53 54.41 4.04 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.881 -0.676 . . . . 0.0 111.68 177.535 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.733 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 19.8 mt -133.1 152.95 80.56 Favored Pre-proline 0 N--CA 1.447 -0.609 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 -176.909 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.882 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 87.3 Cg_exo -53.58 150.9 26.26 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 122.733 2.289 . . . . 0.0 111.104 171.79 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 m -59.97 93.89 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.156 0.503 . . . . 0.0 110.847 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.409 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 139.67 -18.83 2.99 Favored Glycine 0 N--CA 1.44 -1.056 0 C-N-CA 120.917 -0.658 . . . . 0.0 112.307 -177.045 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.882 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 93.9 m95 -93.26 139.16 30.93 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 179.534 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -128.51 130.83 48.05 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.72 179.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.12 126.22 32.89 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 178.107 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.406 ' O ' ' HA ' ' A' ' 19' ' ' THR . 59.7 mtp85 -138.57 173.79 11.22 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.389 -178.788 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -136.03 116.11 13.35 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.408 -174.415 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.48 ' HB2' ' CE1' ' A' ' 20' ' ' TYR . 6.5 t0 -99.65 152.46 20.04 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.496 -177.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 60.02 -100.0 0.1 Allowed 'General case' 0 N--CA 1.463 0.22 0 O-C-N 123.619 0.575 . . . . 0.0 112.072 176.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.55 53.17 0.94 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.0 0.428 . . . . 0.0 110.823 -175.575 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.404 ' HA2' ' HB2' ' A' ' 13' ' ' LYS . . . 82.64 23.0 57.27 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.863 175.349 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.49 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 18.6 mmm-85 -76.73 110.86 11.67 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.653 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.406 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 1.4 m -81.44 124.61 29.58 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.562 -173.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.48 ' CE1' ' HB2' ' A' ' 14' ' ' ASP . 34.2 p90 -137.0 167.2 21.96 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.181 175.227 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.442 ' HD1' HD11 ' A' ' 5' ' ' LEU . 52.6 m-85 -113.6 121.0 42.86 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-O 121.26 0.552 . . . . 0.0 110.097 -179.516 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.4 p -111.83 117.56 55.45 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.263 -177.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.409 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 24.9 t-20 -90.99 126.43 36.08 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.504 -178.932 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -94.92 -8.76 36.16 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -173.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -83.53 -54.34 5.02 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 175.876 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -91.65 -8.63 46.62 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.065 -176.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 58.38 59.48 2.98 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.34 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.01 142.55 51.2 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.272 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.59 100.93 10.49 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.884 177.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.706 HG23 ' H ' ' A' ' 32' ' ' THR . 0.5 OUTLIER -111.78 138.78 47.9 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.05 0.453 . . . . 0.0 111.029 -172.842 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 59.3 m95 -109.89 32.31 5.18 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.502 0.668 . . . . 0.0 109.737 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.706 ' H ' HG23 ' A' ' 30' ' ' THR . 1.3 t -137.47 163.94 29.9 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.418 -177.375 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.525 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 14.4 mmm180 -75.57 115.28 44.29 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-O 121.111 0.482 . . . . 0.0 110.831 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.525 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 6.7 Cg_exo -74.55 127.36 10.94 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 123.427 2.752 . . . . 0.0 112.821 -177.639 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.1 pt -106.38 10.43 9.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.759 0.79 . . . . 0.0 110.799 176.236 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.311 -1.094 0 CA-C-N 114.876 -1.056 . . . . 0.0 110.208 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.714 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -85.76 135.81 37.52 Favored Pre-proline 0 C--N 1.322 -0.621 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 176.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -68.16 75.29 0.71 Allowed 'Trans proline' 0 C--O 1.234 0.284 0 C-N-CA 123.189 2.592 . . . . 0.0 112.602 -178.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -107.39 45.08 1.35 Allowed Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.909 178.621 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.767 HD13 ' HB3' ' A' ' 9' ' ' TRP . 6.1 mt -107.33 172.94 3.39 Favored Pre-proline 0 C--N 1.327 -0.407 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 179.434 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.661 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 51.3 Cg_exo -60.05 164.05 13.01 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.627 2.218 . . . . 0.0 111.204 171.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -50.76 -37.45 42.21 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -175.349 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.426 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -102.37 5.86 52.52 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.635 -0.793 . . . . 0.0 114.166 -174.317 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.767 ' HB3' HD13 ' A' ' 5' ' ' LEU . 89.5 m95 -104.44 144.43 31.68 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 118.227 1.014 . . . . 0.0 109.964 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -137.31 129.05 28.74 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.962 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.14 116.65 24.47 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 175.637 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.72 -170.36 2.11 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.342 0.592 . . . . 0.0 110.892 -177.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -122.22 126.78 48.97 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.38 -178.052 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.496 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -58.76 -53.14 61.7 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.373 -177.853 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 170.99 -47.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 O-C-N 124.098 0.874 . . . . 0.0 109.038 -178.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.32 37.41 1.18 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.629 -177.705 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.1 -11.52 42.4 Favored Glycine 0 CA--C 1.517 0.205 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.897 177.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.496 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 14.1 mtt180 -61.27 138.25 58.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.937 0.399 . . . . 0.0 111.145 -177.733 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -97.16 122.25 39.96 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.892 -177.389 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.5 p90 -133.39 153.25 51.76 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 175.222 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.556 ' CD1' HD11 ' A' ' 5' ' ' LEU . 50.7 m-85 -109.41 119.37 39.25 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.481 0.658 . . . . 0.0 110.391 -176.028 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.2 p -114.84 115.28 49.02 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.188 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.404 -177.275 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.426 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 28.4 t-20 -85.62 111.23 19.87 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.617 175.123 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -81.28 -10.38 59.59 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.787 -170.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -89.75 -54.83 3.88 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.131 0.491 . . . . 0.0 110.092 -178.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 19.8 t30 -83.96 -4.45 58.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.545 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.4 mtm180 57.41 52.52 8.53 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.013 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.09 134.83 54.76 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.06 0.457 . . . . 0.0 111.304 -178.609 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.13 104.03 13.9 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.97 179.135 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.552 HG23 HG22 ' A' ' 32' ' ' THR . 0.9 OUTLIER -116.93 129.07 55.82 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.56 -173.626 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.3 m95 -100.31 39.89 1.31 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.356 0.598 . . . . 0.0 110.131 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.552 HG22 HG23 ' A' ' 30' ' ' THR . 0.6 OUTLIER -144.79 151.59 39.04 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.849 -176.88 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.54 ' HD3' ' OH ' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -69.14 114.09 21.13 Favored Pre-proline 0 C--N 1.32 -0.705 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 175.178 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 11.4 Cg_exo -70.86 62.06 2.37 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 123.529 2.819 . . . . 0.0 113.593 -176.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 4.1 mm -104.37 62.85 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.766 178.541 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.313 -0.999 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.546 177.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.734 0 N-CA-C 111.978 -0.449 . . . . 0.0 111.978 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.83 118.5 45.93 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 120.735 0.303 . . . . 0.0 110.582 178.476 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -79.99 -14.37 12.33 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.764 2.309 . . . . 0.0 112.896 -177.32 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 65.7 -140.02 39.93 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -173.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.869 HD21 ' HD2' ' A' ' 21' ' ' TYR . 3.6 mp -97.84 118.79 63.53 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 117.232 0.516 . . . . 0.0 111.095 174.808 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.799 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 89.1 Cg_exo -53.16 163.93 2.03 Favored 'Trans proline' 0 N--CA 1.474 0.343 0 C-N-CA 124.084 3.189 . . . . 0.0 113.05 176.066 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.05 120.07 10.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.353 -0.385 . . . . 0.0 109.967 175.57 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 108.51 -28.75 10.99 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 111.449 -0.66 . . . . 0.0 111.449 -174.056 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.799 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 64.4 m95 -83.49 117.17 22.91 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 178.015 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -120.64 136.28 54.87 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 175.448 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.42 140.21 29.83 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 178.193 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.427 ' HD2' ' OH ' ' A' ' 20' ' ' TYR . 2.8 mtm180 -139.06 -168.38 2.42 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.243 0.544 . . . . 0.0 110.41 -178.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.3 OUTLIER -140.08 151.2 45.17 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.063 -179.862 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -78.84 -165.93 0.81 Allowed 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 110.313 -0.255 . . . . 0.0 110.313 179.301 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.61 -15.16 63.25 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.027 0.381 . . . . 0.0 112.027 -176.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -108.08 -44.05 4.26 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.762 0.315 . . . . 0.0 110.807 -178.539 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 140.35 23.11 0.29 Allowed Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.254 -0.974 . . . . 0.0 113.126 178.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.423 ' HB3' ' HZ3' ' A' ' 31' ' ' TRP . 12.7 mtm-85 -85.99 144.61 27.51 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 177.725 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.2 117.95 23.28 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -172.26 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.427 ' OH ' ' HD2' ' A' ' 12' ' ' ARG . 13.9 p90 -129.62 149.48 51.36 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.013 171.278 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.869 ' HD2' HD21 ' A' ' 5' ' ' LEU . 84.0 m-85 -110.21 128.15 55.34 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 120.998 0.427 . . . . 0.0 110.217 -176.712 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 p -117.11 110.1 30.09 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.879 0.847 . . . . 0.0 110.687 -177.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.497 ' HB2' ' CD2' ' A' ' 9' ' ' TRP . 43.2 t-20 -90.07 112.91 24.52 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.139 178.525 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -71.95 -29.25 64.08 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.642 -174.513 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -75.36 -57.34 3.95 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.892 0.377 . . . . 0.0 111.132 -174.656 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -85.82 -5.99 59.16 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.162 -177.059 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.4 ttm180 62.21 57.63 1.96 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-O 121.241 0.544 . . . . 0.0 111.406 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.23 131.04 53.99 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.889 178.87 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.53 76.79 1.22 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.461 0.648 . . . . 0.0 109.677 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.6 t -99.27 148.17 24.42 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.835 -170.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.423 ' HZ3' ' HB3' ' A' ' 18' ' ' ARG . 60.5 m95 -100.23 46.35 0.96 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.575 0.702 . . . . 0.0 109.129 175.208 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -152.22 157.27 41.22 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.362 -177.196 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.448 ' HA ' ' HD2' ' A' ' 34' ' ' PRO . 0.2 OUTLIER -65.23 125.13 88.75 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-O 120.58 0.228 . . . . 0.0 111.001 178.923 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.448 ' HD2' ' HA ' ' A' ' 33' ' ' ARG . 9.7 Cg_endo -52.0 111.16 0.54 Allowed 'Trans proline' 0 CA--C 1.53 0.283 0 C-N-CA 123.711 2.941 . . . . 0.0 113.242 178.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -116.63 1.77 7.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.765 0.793 . . . . 0.0 110.287 177.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.7 ttm . . . . . 0 C--O 1.251 1.16 0 CA-C-N 114.269 -1.332 . . . . 0.0 109.958 179.945 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.599 0 N-CA-C 111.733 -0.547 . . . . 0.0 111.733 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -49.99 90.54 Favored Pre-proline 0 CA--C 1.54 0.595 0 N-CA-C 112.257 0.465 . . . . 0.0 112.257 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -74.39 62.55 5.32 Favored 'Trans proline' 0 C--N 1.357 0.991 0 C-N-CA 122.3 2.0 . . . . 0.0 112.096 176.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 167.79 97.8 0.12 Allowed Glycine 0 N--CA 1.448 -0.56 0 N-CA-C 110.908 -0.877 . . . . 0.0 110.908 179.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.745 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 67.3 mt -59.02 138.26 87.75 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -170.513 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.803 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 81.2 Cg_exo -55.68 167.67 2.03 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 124.249 3.299 . . . . 0.0 112.855 172.76 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.66 95.71 0.11 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.62 178.008 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.407 ' HA3' ' HB2' ' A' ' 25' ' ' ASN . . . 134.42 -22.97 3.67 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.614 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.803 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 88.2 m95 -86.08 129.83 34.72 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 -177.446 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.471 ' HB3' HG13 ' A' ' 22' ' ' VAL . 38.0 tt0 -122.75 130.41 52.9 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.434 -177.584 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -87.29 119.63 27.75 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.941 0.401 . . . . 0.0 110.064 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.467 ' HD2' HG11 ' A' ' 22' ' ' VAL . 44.3 mtt180 -126.04 -179.35 4.66 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.991 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.8 mtmp? -140.7 150.69 43.78 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.772 -179.159 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -93.05 -175.49 3.88 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.006 176.349 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.71 -26.13 68.52 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -177.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.7 mtmp? -87.69 -8.81 55.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.084 0.469 . . . . 0.0 110.432 178.566 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 90.35 20.95 39.66 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.811 175.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -81.39 123.27 28.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.832 0.316 . . . . 0.0 110.242 177.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -72.75 123.54 23.52 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.409 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.481 ' HB3' ' CE3' ' A' ' 31' ' ' TRP . 37.2 p90 -129.89 155.05 46.67 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 174.23 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.57 ' HD1' HD11 ' A' ' 5' ' ' LEU . 25.6 m-85 -105.93 117.74 34.8 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.38 -176.426 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.471 HG13 ' HB3' ' A' ' 10' ' ' GLU . 2.3 p -109.94 107.07 21.98 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.203 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.467 ' HB2' ' CD2' ' A' ' 9' ' ' TRP . 55.8 t-20 -84.89 112.56 20.67 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.756 178.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -83.91 -16.49 44.08 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.213 0.53 . . . . 0.0 109.911 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.407 ' HB2' ' HA3' ' A' ' 8' ' ' GLY . 7.6 t-20 -73.57 -54.2 8.75 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.382 178.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.456 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 4.4 t30 -107.44 28.16 8.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.16 -177.609 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER 37.41 51.7 1.19 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.151 0.981 . . . . 0.0 113.047 178.227 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.64 132.34 54.61 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.017 0.437 . . . . 0.0 111.219 -176.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -119.6 104.4 10.25 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 178.544 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.544 ' OG1' HG22 ' A' ' 32' ' ' THR . 3.9 t -126.11 148.01 49.47 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.084 0.469 . . . . 0.0 111.252 -174.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.481 ' CE3' ' HB3' ' A' ' 20' ' ' TYR . 33.9 m95 -99.87 -5.58 28.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.637 177.161 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.544 HG22 ' OG1' ' A' ' 30' ' ' THR . 2.4 t -95.5 165.81 12.17 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.711 177.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.64 130.21 87.52 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 177.333 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -51.01 149.45 15.04 Favored 'Trans proline' 0 C--O 1.236 0.384 0 C-N-CA 123.128 2.552 . . . . 0.0 112.648 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 5.4 mm -82.13 71.95 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.685 0.755 . . . . 0.0 110.559 -176.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.309 -1.154 0 CA-C-N 115.021 -0.99 . . . . 0.0 109.531 176.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.74 0 N-CA-C 111.984 -0.446 . . . . 0.0 111.984 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.73 105.64 28.14 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 178.562 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -84.2 54.21 4.21 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.807 2.338 . . . . 0.0 112.506 -177.201 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 89.32 -21.94 25.99 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.153 -178.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.673 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 22.7 mt -118.46 151.26 49.39 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 177.606 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.893 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 72.2 Cg_exo -55.83 155.56 22.19 Favored 'Trans proline' 0 C--O 1.236 0.391 0 C-N-CA 122.526 2.151 . . . . 0.0 111.141 171.713 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.82 99.72 0.17 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.959 0.409 . . . . 0.0 110.16 -179.47 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.42 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 132.97 -19.01 4.44 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.472 -177.42 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.893 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 90.9 m95 -91.51 135.84 33.56 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -126.95 132.23 50.89 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.756 -177.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.427 ' HG2' HD12 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -90.14 114.62 26.61 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.167 0.508 . . . . 0.0 110.365 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.661 ' HD2' HG11 ' A' ' 22' ' ' VAL . 48.6 mtt180 -109.31 -178.85 3.67 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.647 178.32 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -136.55 144.02 43.98 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.433 -179.348 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.416 ' CG ' ' H ' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -96.96 171.46 8.48 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.45 176.653 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.11 -26.28 68.2 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -176.434 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.416 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 22.9 mmmt -84.66 -4.34 58.96 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.851 0.358 . . . . 0.0 110.686 -179.338 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.23 12.66 55.96 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.346 177.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.401 ' HB3' ' HZ3' ' A' ' 31' ' ' TRP . 4.0 mmp_? -81.0 144.83 31.51 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 179.216 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.7 m -98.9 120.5 39.44 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.438 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.0 p90 -124.58 148.31 47.92 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 176.436 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.602 ' HD1' HD11 ' A' ' 5' ' ' LEU . 58.0 m-85 -105.33 122.08 45.21 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.633 0.73 . . . . 0.0 110.683 -174.098 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.661 HG11 ' HD2' ' A' ' 12' ' ' ARG . 2.5 p -115.92 113.86 44.5 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.099 -177.458 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.42 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 37.7 t-20 -89.48 117.35 28.33 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.147 178.477 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 78.9 m-70 -83.93 -20.79 32.35 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.362 -174.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -84.67 -41.78 15.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.081 0.467 . . . . 0.0 110.434 -179.037 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -95.75 -1.21 50.29 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.96 -178.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 56.21 40.77 29.93 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.701 177.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.67 141.82 47.7 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.858 0.361 . . . . 0.0 111.352 -176.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.42 109.75 14.26 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.255 178.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 2.6 t -127.62 151.46 48.9 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.017 0.437 . . . . 0.0 110.987 -177.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.401 ' HZ3' ' HB3' ' A' ' 18' ' ' ARG . 47.2 m95 -103.19 12.93 35.08 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.312 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -109.24 158.76 17.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.576 -178.127 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.438 HH11 ' HD3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -85.21 116.69 66.54 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-O 120.769 0.318 . . . . 0.0 111.161 178.209 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -82.5 132.27 6.75 Favored 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 122.639 2.226 . . . . 0.0 111.55 175.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.37 15.35 7.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 121.79 0.805 . . . . 0.0 110.551 -177.414 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.308 -1.211 0 CA-C-N 114.462 -1.245 . . . . 0.0 109.296 178.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.652 0 N-CA-C 111.865 -0.494 . . . . 0.0 111.865 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.1 m -115.45 91.7 29.89 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-O 121.027 0.441 . . . . 0.0 110.53 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -68.95 104.66 1.22 Allowed 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 122.857 2.371 . . . . 0.0 112.104 -177.187 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 71.89 26.47 72.58 Favored Glycine 0 N--CA 1.447 -0.609 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.44 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.613 HD11 ' HD1' ' A' ' 21' ' ' TYR . 20.6 mt -138.65 155.13 73.6 Favored Pre-proline 0 N--CA 1.451 -0.405 0 CA-C-O 120.749 0.309 . . . . 0.0 111.102 -179.103 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.798 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 74.2 Cg_exo -56.8 162.65 8.4 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.922 2.415 . . . . 0.0 111.274 169.379 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -14.61 9.69 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -176.002 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -108.48 -1.98 32.94 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.424 -0.894 . . . . 0.0 113.406 -177.268 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.798 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 80.0 m95 -104.34 138.61 40.51 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 117.932 0.866 . . . . 0.0 110.676 -176.402 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -121.48 133.94 55.05 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.43 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.06 120.15 32.42 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.159 0.504 . . . . 0.0 110.374 -179.139 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.568 ' HG3' HG11 ' A' ' 22' ' ' VAL . 0.8 OUTLIER -115.61 165.63 12.82 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.691 177.203 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -114.28 135.76 53.72 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.861 -177.528 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.407 ' O ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -66.91 -57.71 6.41 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.952 178.9 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 14' ' ' ASP . . . 168.07 -48.64 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.296 0 O-C-N 123.958 0.786 . . . . 0.0 109.583 -178.432 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.59 45.9 1.0 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.686 0.755 . . . . 0.0 110.901 -175.176 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.26 -17.46 18.29 Favored Glycine 0 C--N 1.317 -0.5 0 CA-C-N 114.816 -1.084 . . . . 0.0 113.227 176.664 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -65.02 118.14 8.68 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.931 0.396 . . . . 0.0 110.664 -178.267 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -102.89 130.61 49.99 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.496 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 37.6 p90 -124.13 161.73 25.04 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.129 0.49 . . . . 0.0 110.322 176.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.613 ' HD1' HD11 ' A' ' 5' ' ' LEU . 33.6 m-85 -108.47 117.52 34.38 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.43 -174.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.568 HG11 ' HG3' ' A' ' 12' ' ' ARG . 3.7 p -115.53 115.65 50.01 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 CA-C-O 121.822 0.82 . . . . 0.0 109.695 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 29.3 t-20 -90.22 108.45 19.76 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.771 -177.152 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -88.25 38.68 0.87 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.179 0.514 . . . . 0.0 111.042 -176.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -137.3 -47.76 0.58 Allowed 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 178.028 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -92.54 -8.35 44.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.115 174.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.93 56.8 2.75 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.678 177.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -127.61 155.35 44.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.168 0.509 . . . . 0.0 111.192 177.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.44 102.94 8.58 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.151 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.667 ' HB ' ' HZ3' ' A' ' 9' ' ' TRP . 0.9 OUTLIER -120.17 136.88 54.47 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.198 -169.519 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 58.0 m95 -101.99 -19.32 15.26 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.052 0.453 . . . . 0.0 110.238 178.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.467 HG22 HG23 ' A' ' 30' ' ' THR . 1.4 t -79.63 163.0 24.94 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.731 179.001 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.44 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 8.2 mpt_? -78.06 120.92 83.07 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 176.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 16.1 Cg_exo -67.01 126.47 15.25 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.769 2.313 . . . . 0.0 111.773 179.101 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 3.5 mm -84.69 68.16 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.8 0.81 . . . . 0.0 110.44 -178.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.466 ' HG2' ' HB3' ' A' ' 6' ' ' PRO . 0.7 OUTLIER . . . . . 0 C--N 1.31 -1.138 0 CA-C-N 114.92 -1.036 . . . . 0.0 109.291 178.267 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.703 0 N-CA-C 111.952 -0.459 . . . . 0.0 111.952 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.467 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.3 OUTLIER -69.44 133.28 89.15 Favored Pre-proline 0 C--N 1.328 -0.366 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 177.859 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 2' ' ' SER . 2.7 Cg_exo -75.65 62.93 6.48 Favored 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 123.13 2.553 . . . . 0.0 112.116 179.271 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.71 127.7 8.12 Favored Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 176.429 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.832 HD13 ' HB3' ' A' ' 9' ' ' TRP . 7.4 mt -63.98 148.16 95.45 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-O 120.816 0.341 . . . . 0.0 110.859 -176.537 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.878 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 50.9 Cg_exo -61.02 -161.47 0.03 OUTLIER 'Trans proline' 0 N--CA 1.474 0.33 0 C-N-CA 124.034 3.156 . . . . 0.0 114.016 -179.791 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.9 94.2 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.945 -1.025 . . . . 0.0 112.55 -174.703 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 77.66 18.43 77.47 Favored Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 121.003 -0.618 . . . . 0.0 113.727 173.43 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.878 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 74.6 m95 -82.63 129.19 34.9 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 176.549 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -132.38 136.76 47.03 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 121.174 -0.21 . . . . 0.0 110.659 -179.206 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.405 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 1.6 pt-20 -90.34 117.27 28.93 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.456 0.646 . . . . 0.0 109.602 174.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.493 ' O ' ' HA ' ' A' ' 19' ' ' THR . 0.0 OUTLIER -110.17 -174.84 2.58 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.543 -179.614 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.33 130.19 26.22 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.618 -178.16 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.693 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . 35.0 t70 -81.47 55.01 2.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.221 177.616 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 67.77 -58.19 0.44 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.845 0.858 . . . . 0.0 112.656 178.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.63 30.01 0.66 Allowed 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 122.611 0.365 . . . . 0.0 111.708 -174.666 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 77.17 7.89 86.87 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 120.959 -0.639 . . . . 0.0 113.079 177.53 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.693 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 0.1 OUTLIER -74.06 99.06 3.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.668 0.271 . . . . 0.0 110.315 178.613 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.493 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 30.3 m -72.86 121.68 20.37 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.329 0.585 . . . . 0.0 112.168 -177.527 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.486 ' HB3' ' CE3' ' A' ' 31' ' ' TRP . 28.3 p90 -126.85 142.76 51.46 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.39 -0.823 . . . . 0.0 108.796 171.125 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.605 ' HD2' HD11 ' A' ' 5' ' ' LEU . 74.2 m-85 -98.39 120.59 39.08 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.695 0.76 . . . . 0.0 110.21 -176.659 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 p -111.98 117.0 54.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.276 -177.423 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -89.04 120.03 30.09 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.472 -0.785 . . . . 0.0 108.963 177.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -82.32 -22.24 35.69 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.78 -173.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -76.88 -47.82 20.1 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.251 -174.293 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -107.59 7.49 28.7 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.928 0.394 . . . . 0.0 110.726 178.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 54.03 45.2 28.08 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.399 178.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.88 135.0 35.66 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.305 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.77 108.7 12.8 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.629 -179.464 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 12.4 t -127.51 149.61 50.05 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.126 0.488 . . . . 0.0 110.701 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.486 ' CE3' ' HB3' ' A' ' 20' ' ' TYR . 49.1 m95 -102.77 21.51 15.36 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.569 0.7 . . . . 0.0 109.203 177.588 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -118.9 160.71 21.44 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 114.911 -1.041 . . . . 0.0 109.367 175.247 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.462 ' HG3' ' CE1' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -78.43 120.97 83.05 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-O 120.681 0.277 . . . . 0.0 110.288 179.101 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -66.67 120.22 7.31 Favored 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.65 2.233 . . . . 0.0 112.332 -178.061 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -106.1 33.06 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 122.063 0.935 . . . . 0.0 109.184 174.304 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.432 ' O ' ' HG2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.121 0 CA-C-N 113.703 -1.589 . . . . 0.0 108.1 -178.134 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.744 0 N-CA-C 111.375 -0.69 . . . . 0.0 111.375 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.455 ' CB ' ' HD3' ' A' ' 3' ' ' PRO . 0.1 OUTLIER -71.31 -52.44 8.96 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 174.116 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.455 ' HD3' ' CB ' ' A' ' 2' ' ' SER . 4.2 Cg_exo -78.71 161.26 27.7 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 122.098 1.866 . . . . 0.0 110.731 169.256 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -112.53 168.1 12.56 Favored Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.567 -0.825 . . . . 0.0 111.924 -178.27 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.73 HD11 ' HD1' ' A' ' 21' ' ' TYR . 17.9 mt -114.75 151.42 45.37 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-O 120.723 0.297 . . . . 0.0 110.856 179.71 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.788 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 83.6 Cg_exo -53.7 144.34 54.05 Favored 'Trans proline' 0 CA--C 1.52 -0.198 0 C-N-CA 122.901 2.401 . . . . 0.0 110.774 170.744 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.0 m -58.12 92.38 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.29 0.567 . . . . 0.0 110.214 178.148 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.47 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 145.75 -29.21 1.72 Allowed Glycine 0 N--CA 1.438 -1.204 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.515 -173.722 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.788 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 93.2 m95 -90.64 131.07 36.55 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 176.639 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -124.04 117.44 24.73 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -179.087 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -81.8 103.55 11.56 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 121.66 0.743 . . . . 0.0 110.098 176.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.567 ' HD2' HG11 ' A' ' 22' ' ' VAL . 9.2 mtt-85 -107.94 174.88 5.68 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.638 -1.164 . . . . 0.0 109.105 -178.358 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.91 128.77 54.73 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 120.937 0.398 . . . . 0.0 110.467 -176.073 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -99.46 -2.97 34.66 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.609 0.719 . . . . 0.0 109.416 -179.235 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.628 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . . . -159.76 -156.41 0.5 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.909 -1.041 . . . . 0.0 109.915 -179.18 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.57 32.58 0.65 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.239 0.543 . . . . 0.0 111.188 -174.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 149.63 -6.81 0.78 Allowed Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.23 -177.624 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.628 ' HB2' ' HB3' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -79.16 101.44 7.93 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 175.533 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.53 134.87 36.61 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.124 -176.904 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 28.1 p90 -134.36 155.92 49.42 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.412 176.135 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.73 ' HD1' HD11 ' A' ' 5' ' ' LEU . 24.8 m-85 -106.45 113.71 27.39 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.352 0.596 . . . . 0.0 110.622 -175.497 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.567 HG11 ' HD2' ' A' ' 12' ' ' ARG . 2.3 p -108.55 111.17 34.83 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.208 -179.58 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.47 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 23.8 t-20 -82.21 121.77 27.06 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 178.1 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 59.8 m-70 -84.19 -17.86 38.54 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -169.067 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.7 p30 -95.34 -37.69 10.85 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.269 -0.572 . . . . 0.0 110.874 -179.028 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 19.5 t30 -93.75 -2.81 53.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.537 -0.302 . . . . 0.0 110.625 178.785 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 26.4 mtm180 55.58 45.89 23.97 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.461 176.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.04 131.61 56.31 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.108 0.48 . . . . 0.0 111.22 -178.714 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -111.35 96.34 6.06 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.955 -178.811 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.494 HG22 ' HZ3' ' A' ' 9' ' ' TRP . 1.8 t -116.46 145.38 43.33 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.238 0.542 . . . . 0.0 111.434 -175.22 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 31.8 m95 -99.85 7.9 44.58 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 171.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -97.2 144.57 26.89 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.522 -177.626 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.454 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 8.9 mmm180 -67.99 119.54 67.75 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-O 120.74 0.305 . . . . 0.0 111.213 177.776 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 6.7 Cg_exo -72.82 66.83 3.95 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 123.428 2.752 . . . . 0.0 112.518 178.068 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 11.4 mt 72.66 -60.92 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.707 -179.175 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 4.6 ttm . . . . . 0 C--N 1.305 -1.351 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.668 -177.583 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.819 0 N-CA-C 111.595 -0.602 . . . . 0.0 111.595 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.57 -54.94 51.05 Favored Pre-proline 0 CA--C 1.537 0.474 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -177.728 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -65.25 -19.56 62.29 Favored 'Trans proline' 0 C--N 1.359 1.123 0 C-N-CA 121.72 1.613 . . . . 0.0 112.273 178.299 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 81.14 -64.19 4.19 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.201 -178.538 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.821 HD11 ' HD1' ' A' ' 21' ' ' TYR . 28.3 mt -140.48 173.83 4.58 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-O 119.544 -0.265 . . . . 0.0 110.364 -176.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.746 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 87.3 Cg_exo -58.41 42.16 0.05 OUTLIER 'Trans proline' 0 N--CA 1.489 1.229 0 C-N-CA 124.627 3.552 . . . . 0.0 115.749 176.266 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.8 m 66.43 -59.45 0.34 Allowed 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.993 0.917 . . . . 0.0 112.752 177.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -73.46 -19.59 79.7 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 121.194 -0.527 . . . . 0.0 112.163 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.8 ' HB3' HD13 ' A' ' 5' ' ' LEU . 93.6 m95 -87.58 137.81 32.02 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 179.699 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -128.23 122.4 31.7 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.926 179.012 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -82.66 117.9 22.94 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.135 0.493 . . . . 0.0 110.021 178.462 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.501 ' O ' ' HA ' ' A' ' 19' ' ' THR . 39.0 mtt180 -122.77 -176.47 3.4 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.887 -178.51 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -133.48 137.84 45.86 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.065 -179.024 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -77.85 -175.9 4.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.667 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.07 -28.53 69.67 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.726 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.8 mmtt -82.28 -27.37 32.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.874 0.369 . . . . 0.0 110.665 177.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 113.14 13.5 10.81 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.686 -0.769 . . . . 0.0 113.136 176.491 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.493 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.3 OUTLIER -84.95 142.04 29.93 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.848 0.356 . . . . 0.0 110.492 179.258 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.501 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 0.7 OUTLIER -79.11 125.09 28.96 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.339 -178.909 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -127.75 161.3 29.28 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 172.719 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.821 ' HD1' HD11 ' A' ' 5' ' ' LEU . 50.6 m-85 -112.89 111.28 21.92 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.535 0.683 . . . . 0.0 110.712 -173.313 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.486 HG11 ' HD2' ' A' ' 12' ' ' ARG . 3.0 p -108.51 107.64 23.32 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.035 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.455 -178.411 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.482 ' HB3' ' OG1' ' A' ' 28' ' ' THR . 54.3 t-20 -82.1 112.8 19.47 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.037 178.139 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -82.15 -17.31 46.79 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.068 0.461 . . . . 0.0 110.368 -176.37 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -81.44 -41.13 22.29 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.279 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 57.7 m-20 -97.99 -3.25 38.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.042 -178.52 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 57.76 52.31 8.27 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.982 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.482 ' OG1' ' HB3' ' A' ' 23' ' ' ASN . 33.8 p -124.25 132.15 53.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.995 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.67 78.87 1.61 Allowed 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 173.333 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.573 ' HB ' ' HZ3' ' A' ' 9' ' ' TRP . 0.9 OUTLIER -91.72 128.98 37.76 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.449 -169.043 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 39.5 m95 -101.61 58.97 0.86 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.27 0.557 . . . . 0.0 109.72 177.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -167.26 146.88 5.25 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.327 -176.797 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.469 ' HD2' ' OH ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -67.18 114.61 19.38 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-O 120.64 0.257 . . . . 0.0 110.659 177.562 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -73.88 157.23 47.67 Favored 'Trans proline' 0 N--CA 1.463 -0.277 0 C-N-CA 122.853 2.368 . . . . 0.0 112.688 -177.195 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -96.81 -20.76 5.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.949 0.881 . . . . 0.0 109.538 176.094 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 3.7 tpt . . . . . 0 C--O 1.25 1.121 0 CA-C-N 113.505 -1.679 . . . . 0.0 109.157 179.139 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.656 0 N-CA-C 111.676 -0.57 . . . . 0.0 111.676 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.11 144.06 92.14 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 175.508 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.68 37.91 0.6 Allowed 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 122.846 2.364 . . . . 0.0 113.281 -176.478 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 79.05 -56.9 4.35 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 121.218 -0.515 . . . . 0.0 112.35 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.804 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 10.5 mt -140.53 156.87 69.19 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.872 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 75.8 Cg_exo -54.35 163.74 3.34 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.855 2.37 . . . . 0.0 112.29 174.421 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.64 94.73 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.361 -177.321 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.416 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 128.38 -17.61 5.86 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.208 178.168 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.872 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 96.5 m95 -87.55 134.47 33.62 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 117.794 0.797 . . . . 0.0 110.165 -177.063 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -125.8 132.66 52.23 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.753 177.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.445 ' H ' ' HG3' ' A' ' 11' ' ' GLU . 0.0 OUTLIER -88.42 117.74 27.57 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.274 0.559 . . . . 0.0 110.893 -178.998 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.6 ttp85 -121.68 -177.95 3.69 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.523 0.678 . . . . 0.0 110.32 177.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.45 129.3 23.2 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.445 -177.103 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -81.7 176.01 9.99 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 120.788 -0.365 . . . . 0.0 110.467 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.16 -19.89 63.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.902 0.382 . . . . 0.0 111.269 -178.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.5 mttp -71.89 -28.15 63.32 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.548 176.392 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 112.07 -23.29 16.83 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.454 -178.468 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.77 144.3 52.74 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.975 0.417 . . . . 0.0 111.929 -176.15 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.19 138.48 32.34 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.632 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 49.0 p90 -141.1 162.75 34.75 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 172.645 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.629 ' HD1' HD11 ' A' ' 5' ' ' LEU . 8.9 m-85 -111.93 120.24 41.25 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.134 0.492 . . . . 0.0 110.839 -174.368 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.448 ' HB ' HG23 ' A' ' 29' ' ' THR . 2.5 p -109.22 114.4 46.81 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.01 179.034 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.431 ' HB2' ' CE3' ' A' ' 9' ' ' TRP . 57.5 t-20 -88.74 113.67 24.55 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.92 -179.535 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -80.72 -16.14 54.69 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.769 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -85.88 -32.96 21.38 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.486 -179.339 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -104.13 -11.0 17.55 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.2 -178.2 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 65.1 37.47 6.66 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.0 -179.131 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.64 141.23 51.96 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.953 0.406 . . . . 0.0 111.382 -178.455 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.448 HG23 ' HB ' ' A' ' 22' ' ' VAL . 0.2 OUTLIER -114.93 93.47 4.33 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.856 178.471 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.6 146.48 25.25 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.289 0.566 . . . . 0.0 111.335 -173.418 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 55.9 m95 -106.93 8.4 30.54 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.834 177.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.7 t -110.28 161.52 15.53 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.81 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.48 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 0.0 OUTLIER -77.03 121.71 85.16 Favored Pre-proline 0 C--N 1.321 -0.64 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 176.447 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.48 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 17.6 Cg_exo -65.44 170.7 10.5 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.883 2.389 . . . . 0.0 112.44 -177.036 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -80.87 67.98 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.487 0.661 . . . . 0.0 110.869 -178.421 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 2.2 ttp . . . . . 0 C--O 1.248 0.998 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.784 177.837 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.742 0 N-CA-C 111.77 -0.532 . . . . 0.0 111.77 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.449 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.2 OUTLIER -134.92 143.64 47.03 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-O 120.599 0.238 . . . . 0.0 110.724 -179.709 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 2' ' ' SER . 5.0 Cg_exo -78.29 -117.84 0.01 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 123.194 2.596 . . . . 0.0 111.537 175.866 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.439 ' H ' ' HB2' ' A' ' 3' ' ' PRO . . . 72.33 84.87 0.22 Allowed Glycine 0 C--N 1.329 0.174 0 C-N-CA 120.987 -0.625 . . . . 0.0 112.526 177.444 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.863 HD11 ' HD1' ' A' ' 21' ' ' TYR . 27.8 mt -100.93 157.44 33.67 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-O 120.803 0.335 . . . . 0.0 111.583 -177.439 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.674 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 86.4 Cg_exo -54.95 167.15 1.72 Allowed 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 123.426 2.751 . . . . 0.0 111.815 170.493 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.97 -8.28 15.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.837 0.351 . . . . 0.0 111.655 -177.562 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -113.94 -0.56 24.16 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.615 -179.098 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.674 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 84.2 m95 -109.35 131.18 55.31 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 117.793 0.796 . . . . 0.0 110.001 -178.519 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -114.21 133.17 55.8 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.526 ' HG2' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -87.19 118.47 26.62 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 178.85 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -114.28 175.54 5.43 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.144 0.497 . . . . 0.0 110.133 179.591 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.41 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -140.3 132.3 27.81 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.933 -178.269 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.09 27.88 0.98 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.055 -179.153 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 73.01 -34.63 0.3 Allowed 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 123.546 0.738 . . . . 0.0 112.635 176.469 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -90.02 35.27 0.85 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.062 0.458 . . . . 0.0 111.027 -178.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 72.8 5.49 64.7 Favored Glycine 0 C--N 1.328 0.102 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.119 178.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.41 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -83.56 101.76 11.68 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 -177.001 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 4.7 m -90.36 122.25 33.08 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.075 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 37.5 p90 -129.24 158.43 39.07 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.054 0.454 . . . . 0.0 109.999 178.302 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.863 ' HD1' HD11 ' A' ' 5' ' ' LEU . 46.2 m-85 -105.7 117.7 34.69 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.385 -174.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.7 p -110.98 114.77 48.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.847 0 CA-C-O 121.626 0.726 . . . . 0.0 110.092 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -84.41 126.21 33.04 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.43 -179.253 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 -84.89 -12.53 53.26 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -171.483 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -83.32 -59.17 2.55 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.141 0.496 . . . . 0.0 110.042 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -87.89 -15.62 36.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.872 -176.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 69.46 34.73 2.74 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.271 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.5 134.47 33.67 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.702 178.017 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.5 91.66 4.14 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 176.356 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.613 HG23 HG22 ' A' ' 32' ' ' THR . 0.9 OUTLIER -105.85 122.38 45.99 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.354 -168.038 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 67.2 m95 -97.36 40.03 1.17 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.551 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.613 HG22 HG23 ' A' ' 30' ' ' THR . 6.6 t -156.89 172.14 19.18 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.461 -0.79 . . . . 0.0 108.884 -177.44 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.548 ' HD2' ' HA ' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -74.13 134.38 77.47 Favored Pre-proline 0 C--N 1.318 -0.77 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.569 177.911 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -51.64 -177.47 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 123.422 2.748 . . . . 0.0 112.948 174.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 7.1 mm 58.64 43.23 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.094 0 CA-C-O 122.364 1.078 . . . . 0.0 109.517 -167.247 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 30.4 ttm . . . . . 0 C--O 1.25 1.089 0 CA-C-N 114.159 -1.382 . . . . 0.0 108.808 178.252 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.785 0 N-CA-C 112.223 -0.351 . . . . 0.0 112.223 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.42 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 24.4 m -112.87 109.73 52.43 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-O 120.868 0.366 . . . . 0.0 110.861 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 2' ' ' SER . 10.8 Cg_exo -71.82 127.39 12.95 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 122.94 2.426 . . . . 0.0 111.83 177.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -139.56 -86.12 0.13 Allowed Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.181 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.87 HD13 ' HB3' ' A' ' 9' ' ' TRP . 14.8 mt -103.71 169.96 6.73 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.982 -0.109 . . . . 0.0 110.823 -178.871 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.771 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 75.6 Cg_exo -59.32 -167.14 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.363 2.709 . . . . 0.0 113.458 174.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.18 -49.44 75.95 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.233 -0.894 . . . . 0.0 112.713 -174.901 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.55 ' HA3' ' OD1' ' A' ' 25' ' ' ASN . . . -116.34 19.59 13.01 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 119.968 -1.11 . . . . 0.0 114.309 -172.529 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.87 ' HB3' HD13 ' A' ' 5' ' ' LEU . 92.5 m95 -100.28 140.25 34.8 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 117.819 0.809 . . . . 0.0 110.125 -179.09 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.523 ' OE1' ' HD2' ' A' ' 12' ' ' ARG . 21.4 tt0 -133.51 125.13 28.25 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 177.438 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -85.2 119.55 25.7 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.941 0.4 . . . . 0.0 110.322 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.523 ' HD2' ' OE1' ' A' ' 10' ' ' GLU . 0.3 OUTLIER -116.6 -166.5 1.16 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.956 178.98 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.504 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.4 OUTLIER -135.1 149.1 49.99 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.634 -174.511 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -78.48 -164.99 0.63 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.261 177.17 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.46 -20.41 63.1 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -178.531 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.419 ' HD3' ' HA ' ' A' ' 16' ' ' LYS . 61.5 mmtt -107.47 -50.6 3.05 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.757 0.313 . . . . 0.0 111.217 -178.586 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 152.97 21.48 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.592 -0.813 . . . . 0.0 113.071 -179.717 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.504 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -77.63 128.82 34.74 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 177.397 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.441 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 0.2 OUTLIER -80.59 113.02 18.49 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.031 0.443 . . . . 0.0 111.753 -176.468 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.8 p90 -120.97 156.86 31.18 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 173.312 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.781 ' HD1' HD11 ' A' ' 5' ' ' LEU . 20.8 m-85 -106.4 122.18 45.75 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.23 0.538 . . . . 0.0 110.929 -172.723 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.415 HG11 ' HD3' ' A' ' 12' ' ' ARG . 2.5 p -119.16 111.16 32.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.787 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.229 179.398 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 31.8 t-20 -77.71 128.17 33.62 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 177.062 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 65.7 m-70 -95.19 -15.07 23.55 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -168.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.55 ' OD1' ' HA3' ' A' ' 8' ' ' GLY . 10.6 p-10 -103.52 -20.21 14.11 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.95 179.621 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -105.71 -16.06 14.79 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.087 0.47 . . . . 0.0 110.198 175.205 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.12 50.0 2.55 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.426 177.626 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -112.65 128.35 56.36 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.991 178.609 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.17 103.51 12.72 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.731 176.774 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.553 HG23 ' H ' ' A' ' 32' ' ' THR . 1.4 t -125.12 147.92 48.79 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.422 0.63 . . . . 0.0 111.667 -174.181 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 57.1 m95 -106.63 39.99 1.72 Allowed 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 174.265 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.553 ' H ' HG23 ' A' ' 30' ' ' THR . 0.5 OUTLIER -136.32 154.67 50.79 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.47 -178.102 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.434 HH11 ' HD3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -75.88 112.39 19.81 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-O 120.743 0.306 . . . . 0.0 110.8 -179.187 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 31.6 Cg_exo -62.19 150.78 85.56 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 123.26 2.64 . . . . 0.0 112.607 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -114.75 -4.45 11.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 121.478 0.656 . . . . 0.0 111.325 -178.396 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.8 ptt? . . . . . 0 C--N 1.311 -1.095 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.55 -177.277 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.667 0 N-CA-C 112.515 -0.234 . . . . 0.0 112.515 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.29 -51.54 0.65 Allowed Pre-proline 0 CA--C 1.54 0.56 0 CA-C-O 119.89 -0.1 . . . . 0.0 111.26 177.784 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -69.44 116.29 4.46 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 121.882 1.721 . . . . 0.0 111.913 177.067 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -83.11 -137.48 2.99 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.265 -179.281 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.748 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 39.1 mt -124.57 167.98 14.36 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-O 120.607 0.242 . . . . 0.0 110.642 -176.974 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.729 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 75.6 Cg_exo -56.67 164.13 6.21 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 122.452 2.101 . . . . 0.0 110.839 166.856 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -66.69 -8.8 30.3 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.94 0.4 . . . . 0.0 111.374 -177.13 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -99.87 -21.47 13.98 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 121.013 -0.613 . . . . 0.0 113.231 177.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.748 ' HB2' ' HB3' ' A' ' 5' ' ' LEU . 74.3 m95 -96.35 143.67 27.2 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 117.442 0.621 . . . . 0.0 110.097 -173.599 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -136.38 131.66 34.51 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.111 178.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -83.24 125.51 31.65 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.127 0.489 . . . . 0.0 110.095 178.261 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 2.6 ttt180 -121.69 -166.15 1.34 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.912 179.065 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.615 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 28.6 mtpt -135.85 149.22 48.96 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.186 -179.758 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.438 ' CG ' ' H ' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -95.06 177.17 5.97 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.426 175.55 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.42 -28.02 67.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.821 0.343 . . . . 0.0 111.778 -177.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.438 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 2.6 mtmp? -88.1 -9.48 53.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.238 -178.881 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 100.67 11.99 39.18 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.752 -0.737 . . . . 0.0 113.158 176.659 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.615 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -77.04 161.2 28.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 117.082 0.441 . . . . 0.0 110.302 178.606 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.53 116.85 32.75 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.952 -178.806 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.8 p90 -125.12 157.94 35.12 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 175.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.619 ' CD1' HD11 ' A' ' 5' ' ' LEU . 31.5 m-85 -106.29 118.8 37.58 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.397 0.618 . . . . 0.0 110.804 -175.332 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.1 p -108.83 110.94 33.91 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.089 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.421 ' HB2' ' CD2' ' A' ' 9' ' ' TRP . 23.2 t30 -84.31 121.47 27.56 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.457 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -82.05 -21.49 36.89 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.45 -174.1 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.96 -57.92 3.7 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.415 -177.184 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -101.2 1.81 39.38 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.343 -177.712 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.1 29.21 17.53 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 123.577 0.548 . . . . 0.0 111.64 -179.031 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.6 129.71 34.99 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.967 0.413 . . . . 0.0 110.353 177.213 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -118.96 107.28 13.35 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.203 -178.841 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.632 HG22 ' HZ3' ' A' ' 9' ' ' TRP . 6.5 t -127.56 149.24 50.24 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.208 0.528 . . . . 0.0 111.697 -175.588 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.436 ' HZ3' ' HB3' ' A' ' 18' ' ' ARG . 16.4 m95 -97.92 7.95 45.52 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 172.507 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -103.92 150.79 23.86 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 114.26 -1.336 . . . . 0.0 110.352 -176.87 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.502 ' HD2' ' HA ' ' A' ' 33' ' ' ARG . 11.0 mmm180 -72.68 121.32 84.64 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-O 120.762 0.315 . . . . 0.0 110.91 177.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 21.9 Cg_exo -64.34 121.19 8.72 Favored 'Trans proline' 0 C--O 1.236 0.415 0 C-N-CA 122.906 2.404 . . . . 0.0 112.058 179.271 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.51 HD12 ' O ' ' A' ' 35' ' ' ILE . 1.4 pp -86.55 86.02 2.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 122.343 1.068 . . . . 0.0 110.823 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.092 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.145 178.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.668 0 N-CA-C 112.182 -0.367 . . . . 0.0 112.182 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.1 m -131.52 98.1 18.6 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-O 120.849 0.356 . . . . 0.0 110.575 -178.263 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -88.75 172.97 4.45 Favored 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.229 2.619 . . . . 0.0 111.837 176.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 84.65 -50.14 4.35 Favored Glycine 0 CA--C 1.517 0.214 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.577 177.346 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.596 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 36.4 mt -106.99 155.43 39.2 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-O 120.718 0.294 . . . . 0.0 110.624 179.781 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.819 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 77.7 Cg_exo -57.27 156.08 26.98 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 122.841 2.361 . . . . 0.0 111.23 170.561 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.42 90.06 0.07 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.104 0.478 . . . . 0.0 110.654 179.6 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 142.08 -15.72 2.57 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.417 -178.787 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.819 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 86.6 m95 -93.46 143.86 25.89 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 117.152 0.476 . . . . 0.0 109.841 179.654 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -137.62 136.12 37.22 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.364 -177.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.83 124.79 34.0 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.778 0.323 . . . . 0.0 110.237 178.456 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 73.5 mtt180 -131.91 172.5 12.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.851 0.358 . . . . 0.0 110.33 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.449 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -117.88 161.39 19.83 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.107 -174.365 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.438 ' CG ' ' H ' ' A' ' 16' ' ' LYS . 1.1 p-10 -111.55 -171.93 1.94 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.908 176.418 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.11 -13.19 60.21 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -178.203 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.438 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -89.18 -35.15 16.39 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.636 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 118.94 20.92 3.97 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 121.07 -0.586 . . . . 0.0 112.121 179.535 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.449 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -95.89 153.92 17.5 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.634 0.254 . . . . 0.0 110.488 -179.837 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.6 m -106.53 116.41 31.89 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.269 179.032 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -114.99 163.67 15.26 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 175.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.591 ' HD1' HD11 ' A' ' 5' ' ' LEU . 75.0 m-85 -110.28 122.84 48.62 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.504 0.668 . . . . 0.0 110.827 -177.518 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.4 p -115.31 118.37 58.58 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.032 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -82.64 132.51 35.18 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 176.705 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 34.0 m-70 -87.59 -31.96 19.58 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -169.582 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -87.06 -35.03 18.96 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.107 0.479 . . . . 0.0 110.543 -179.505 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -85.46 -28.72 24.84 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.475 178.167 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 64.63 46.56 3.13 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.955 -177.287 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.92 132.91 53.61 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.331 177.469 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -111.92 101.48 9.79 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.09 0.471 . . . . 0.0 109.952 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.5 t -120.55 150.1 41.39 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.152 0.501 . . . . 0.0 110.815 -175.629 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -99.39 46.28 0.98 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.293 0.568 . . . . 0.0 109.646 179.053 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.9 t -153.98 141.49 19.79 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.227 -0.897 . . . . 0.0 108.793 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.439 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 0.0 OUTLIER -88.08 112.81 51.73 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-O 121.623 0.725 . . . . 0.0 109.665 178.948 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.503 ' HG2' ' CE2' ' A' ' 9' ' ' TRP . 3.6 Cg_exo -74.44 127.56 11.2 Favored 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 123.553 2.836 . . . . 0.0 112.628 -173.092 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 5.4 mm -85.66 71.41 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 121.329 0.585 . . . . 0.0 109.444 174.372 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.984 0 CA-C-N 114.513 -1.221 . . . . 0.0 110.669 -178.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.601 0 N-CA-C 112.341 -0.304 . . . . 0.0 112.341 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.456 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.0 OUTLIER -71.88 140.6 83.69 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-O 120.641 0.258 . . . . 0.0 110.821 179.163 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 2' ' ' SER . 4.8 Cg_exo -78.3 44.93 1.71 Allowed 'Trans proline' 0 CA--C 1.529 0.256 0 C-N-CA 123.218 2.612 . . . . 0.0 112.202 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -166.03 152.29 21.38 Favored Glycine 0 N--CA 1.447 -0.573 0 N-CA-C 111.18 -0.768 . . . . 0.0 111.18 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.723 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 19.6 mt -97.76 158.88 32.22 Favored Pre-proline 0 C--N 1.319 -0.72 0 CA-C-N 117.018 0.409 . . . . 0.0 110.928 -177.456 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.892 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 52.2 Cg_exo -61.0 -179.47 0.3 Allowed 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.352 2.701 . . . . 0.0 112.776 175.856 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.12 104.35 0.24 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.024 -177.28 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.511 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 95.73 5.38 60.02 Favored Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 120.998 -0.62 . . . . 0.0 113.744 173.905 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.892 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 82.1 m95 -91.67 130.8 37.4 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 117.804 0.802 . . . . 0.0 109.832 -179.49 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -132.14 145.85 51.65 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 178.471 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.95 137.54 37.35 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.319 0.581 . . . . 0.0 110.241 179.258 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.9 mtm180 -130.81 177.45 7.4 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.839 177.145 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.441 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -135.98 135.65 39.7 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.408 0.623 . . . . 0.0 111.356 -177.346 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.617 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . 12.3 t70 -67.81 159.99 29.19 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.151 -0.932 . . . . 0.0 108.8 172.011 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.1 -29.2 63.32 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.743 0.306 . . . . 0.0 111.811 -178.096 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.7 mttp -85.74 4.43 36.78 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.163 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 86.33 34.37 12.39 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.628 177.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.617 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 1.9 mtp180 -95.72 128.52 42.67 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 179.187 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 32.9 m -90.94 125.18 35.7 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.988 0.423 . . . . 0.0 111.361 -175.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -139.94 162.7 34.56 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 176.308 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.549 ' HD1' HD11 ' A' ' 5' ' ' LEU . 71.1 m-85 -113.72 125.86 54.59 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.154 0.502 . . . . 0.0 110.803 -175.819 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.8 p -116.23 110.38 31.38 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.174 -178.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.511 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 33.5 t-20 -81.91 117.86 22.49 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 176.141 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -78.07 -22.78 48.53 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.867 0.365 . . . . 0.0 110.95 -174.381 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -81.74 -43.66 18.11 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.522 -178.158 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.423 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 43.4 t30 -100.54 6.21 44.19 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.733 -178.691 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.423 ' HG2' ' O ' ' A' ' 26' ' ' ASN . 7.9 ptp180 45.54 35.84 2.23 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.295 1.038 . . . . 0.0 112.638 -179.394 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.76 122.34 43.76 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 121.073 0.463 . . . . 0.0 111.24 -178.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -104.47 86.46 2.52 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.164 178.326 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.519 HG23 ' H ' ' A' ' 32' ' ' THR . 1.3 t -98.9 153.0 19.15 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.072 -174.604 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 57.2 m95 -107.42 24.34 13.02 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.471 0.653 . . . . 0.0 109.482 178.048 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.519 ' H ' HG23 ' A' ' 30' ' ' THR . 0.6 OUTLIER -123.74 159.26 29.83 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.252 -177.439 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.94 114.36 43.44 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 175.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -63.18 105.05 0.44 Allowed 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 122.946 2.431 . . . . 0.0 112.82 -179.428 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 3.3 mm -85.23 90.01 2.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.108 0.48 . . . . 0.0 109.989 176.091 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.693 ' SD ' ' HB3' ' A' ' 6' ' ' PRO . 13.1 ttt . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.532 -0.747 . . . . 0.0 110.166 179.187 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.675 0 N-CA-C 111.844 -0.502 . . . . 0.0 111.844 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.436 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.4 OUTLIER -64.31 146.49 97.77 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.527 0.164 . . . . 0.0 110.828 178.785 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 2' ' ' SER . 39.1 Cg_exo -61.59 -21.22 71.47 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.914 2.409 . . . . 0.0 112.512 -178.816 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 173.33 178.06 43.02 Favored Glycine 0 N--CA 1.442 -0.952 0 N-CA-C 110.665 -0.974 . . . . 0.0 110.665 178.297 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.788 HD11 ' HD1' ' A' ' 21' ' ' TYR . 59.3 mt 61.51 174.31 0.06 OUTLIER Pre-proline 0 N--CA 1.448 -0.55 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 178.105 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.702 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 72.9 Cg_exo -58.64 171.92 1.75 Allowed 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.964 2.442 . . . . 0.0 112.159 171.474 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.79 7.37 1.15 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.18 -0.464 . . . . 0.0 112.129 -175.477 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -137.73 6.65 3.53 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.999 178.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' TRP . . . . . 0.764 ' HB3' HD13 ' A' ' 5' ' ' LEU . 79.6 m95 -111.47 134.39 53.08 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 117.268 0.534 . . . . 0.0 109.577 -178.864 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.617 ' OE1' ' HD2' ' A' ' 12' ' ' ARG . 43.3 tt0 -120.08 121.51 39.02 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.044 -178.793 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -85.03 117.7 24.15 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.024 0.44 . . . . 0.0 109.839 177.211 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.617 ' HD2' ' OE1' ' A' ' 10' ' ' GLU . 2.3 mtp180 -115.18 -170.0 1.67 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.36 -178.254 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.06 134.04 30.8 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.167 -175.764 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.416 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . 5.8 t70 -76.82 164.82 25.48 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.523 173.784 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.76 -22.77 67.07 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.071 0.462 . . . . 0.0 111.261 -177.759 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.487 ' HG3' ' HG2' ' A' ' 18' ' ' ARG . 13.5 pttm -96.24 14.88 22.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.344 178.918 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 72.13 45.65 39.41 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.499 178.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.487 ' HG2' ' HG3' ' A' ' 16' ' ' LYS . 6.6 mmt-85 -106.21 143.4 34.4 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 178.612 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.1 m -100.33 115.17 29.33 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.613 -175.272 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.1 p90 -133.84 161.67 34.11 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.998 -0.547 . . . . 0.0 109.828 175.171 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.788 ' HD1' HD11 ' A' ' 5' ' ' LEU . 35.7 m-85 -116.62 125.07 51.27 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.243 0.544 . . . . 0.0 110.673 -175.064 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.598 HG11 ' HD3' ' A' ' 12' ' ' ARG . 2.5 p -118.8 108.85 25.09 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 121.815 0.817 . . . . 0.0 110.574 -178.407 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -80.85 116.32 20.78 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.143 -0.935 . . . . 0.0 108.779 178.349 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -86.4 -16.15 38.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.802 0.334 . . . . 0.0 111.375 -174.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -76.55 -36.07 57.86 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.936 0.398 . . . . 0.0 110.425 -179.193 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -113.12 -2.82 14.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.057 -179.098 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 57.74 52.76 7.78 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.045 -178.657 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.6 130.21 56.75 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.904 179.35 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.55 105.44 15.08 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.798 177.774 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.422 HG22 ' HZ3' ' A' ' 9' ' ' TRP . 0.7 OUTLIER -127.81 152.59 47.6 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 120.765 0.317 . . . . 0.0 110.926 -176.279 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 46.6 m95 -101.15 -3.18 29.63 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.917 0.865 . . . . 0.0 108.718 173.123 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.449 ' O ' ' HD3' ' A' ' 34' ' ' PRO . 1.8 m -74.52 136.91 42.18 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.334 -1.303 . . . . 0.0 110.339 177.806 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.08 110.86 11.18 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.637 0.256 . . . . 0.0 110.7 177.696 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.536 ' HG2' HD22 ' A' ' 5' ' ' LEU . 73.4 Cg_endo -84.51 99.17 0.74 Allowed 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.642 2.228 . . . . 0.0 112.642 -179.49 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 9.6 mm -105.04 -1.35 9.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 122.059 0.933 . . . . 0.0 110.1 178.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 10.8 ttp . . . . . 0 C--O 1.251 1.148 0 CA-C-N 114.389 -1.278 . . . . 0.0 109.444 -178.918 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.817 HD21 ' HD2' ' A' ' 21' ' ' TYR . 5.2 mp . . . . . 0 N--CA 1.453 -0.32 0 CA-C-O 120.626 0.25 . . . . 0.0 110.768 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.833 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 82.9 Cg_exo -53.43 160.88 4.5 Favored 'Trans proline' 0 N--CA 1.477 0.543 0 C-N-CA 123.833 3.022 . . . . 0.0 113.578 177.024 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 m -63.58 103.77 0.57 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.449 176.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 128.61 -22.08 5.27 Favored Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 111.253 -0.739 . . . . 0.0 111.253 -176.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.833 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 71.0 m95 -86.43 141.51 29.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.921 0.391 . . . . 0.0 110.264 178.638 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -136.52 150.16 48.51 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 176.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.49 145.5 31.73 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 177.034 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -145.26 -175.13 4.58 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.998 0.427 . . . . 0.0 109.997 176.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.428 ' HE3' HG23 ' A' ' 19' ' ' THR . 3.5 mttt -139.21 152.99 47.8 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.873 -178.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.502 ' OD1' ' HB2' ' A' ' 18' ' ' ARG . 1.0 OUTLIER -91.49 19.93 5.76 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.289 0.566 . . . . 0.0 110.398 178.936 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.401 ' HB3' ' O ' ' A' ' 14' ' ' ASP . . . 78.46 -27.96 0.16 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 114.626 -1.17 . . . . 0.0 111.599 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.54 42.06 1.14 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.824 0.821 . . . . 0.0 111.394 -176.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.93 -31.53 3.07 Favored Glycine 0 C--N 1.32 -0.351 0 CA-C-N 114.596 -1.184 . . . . 0.0 113.511 175.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.502 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 0.1 OUTLIER -62.94 122.76 16.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.111 0.482 . . . . 0.0 111.135 -174.591 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.428 HG23 ' HE3' ' A' ' 13' ' ' LYS . 25.5 m -103.83 116.85 33.05 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.41 -178.037 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.8 p90 -120.32 154.56 34.84 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.946 0.403 . . . . 0.0 109.929 178.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.817 ' HD2' HD21 ' A' ' 5' ' ' LEU . 79.7 m-85 -105.95 121.17 43.56 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.406 0.622 . . . . 0.0 110.34 -176.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 p -115.2 110.97 33.87 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 CA-C-O 121.787 0.803 . . . . 0.0 110.126 -176.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -89.88 122.48 32.97 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.319 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -89.99 -25.87 20.64 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.042 -175.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.46 -32.48 60.65 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.759 -177.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -110.81 -0.54 16.92 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.751 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER 58.06 45.9 17.11 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.436 178.043 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -113.09 144.82 41.97 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.612 -176.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.64 100.84 7.69 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 173.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.413 ' HB ' ' HZ3' ' A' ' 9' ' ' TRP . 1.1 m -115.99 127.19 54.74 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.44 -168.111 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -95.08 59.56 2.28 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.565 0.698 . . . . 0.0 109.118 175.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -167.61 145.33 4.55 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.9 -172.192 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.414 ' HA ' ' HD2' ' A' ' 34' ' ' PRO . 0.1 OUTLIER -69.31 117.55 53.48 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-O 120.966 0.412 . . . . 0.0 110.596 178.211 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.414 ' HD2' ' HA ' ' A' ' 33' ' ' ARG . 24.9 Cg_endo . . . . . 0 C--O 1.237 0.433 0 C-N-CA 123.153 2.569 . . . . 0.0 113.112 -177.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.605 HD11 ' HD1' ' A' ' 21' ' ' TYR . 18.0 mt . . . . . 0 C--O 1.235 0.292 0 N-CA-C 110.486 -0.191 . . . . 0.0 110.486 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.793 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 77.9 Cg_exo -56.63 152.78 39.34 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.809 2.34 . . . . 0.0 111.105 170.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.6 92.35 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.471 0.653 . . . . 0.0 110.308 177.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.456 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 141.25 -16.49 2.73 Favored Glycine 0 N--CA 1.443 -0.876 0 CA-C-N 115.683 -0.689 . . . . 0.0 112.359 -176.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.793 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 91.6 m95 -97.86 137.94 35.96 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 109.236 -0.654 . . . . 0.0 109.236 177.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.435 ' HB3' HG13 ' A' ' 22' ' ' VAL . 23.8 tt0 -126.89 127.97 45.75 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -91.29 110.31 21.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.763 0.792 . . . . 0.0 110.408 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.616 ' O ' ' HA ' ' A' ' 19' ' ' THR . 1.8 mtt180 -100.73 168.2 9.83 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.431 -178.158 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.709 ' HB3' ' HA2' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -128.09 98.16 5.02 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.047 0.451 . . . . 0.0 110.046 -177.505 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.463 ' HB2' ' CE1' ' A' ' 20' ' ' TYR . 23.7 t70 -80.67 134.05 35.81 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.619 -174.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 62.72 -99.97 0.09 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.088 173.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.68 -6.81 59.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.968 0.413 . . . . 0.0 111.074 -176.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.709 ' HA2' ' HB3' ' A' ' 13' ' ' LYS . . . 118.71 25.47 2.83 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.533 -0.841 . . . . 0.0 111.902 -177.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.412 ' HB3' ' HZ3' ' A' ' 31' ' ' TRP . 11.9 mtm180 -72.21 112.64 8.47 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 176.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.616 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 2.7 m -76.19 124.66 27.81 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.137 0.494 . . . . 0.0 112.249 -174.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.463 ' CE1' ' HB2' ' A' ' 14' ' ' ASP . 43.5 p90 -132.59 158.84 41.18 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.266 173.482 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.605 ' HD1' HD11 ' A' ' 5' ' ' LEU . 36.4 m-85 -108.58 121.31 44.72 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.265 0.555 . . . . 0.0 111.316 -174.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.57 ' CG1' ' HG3' ' A' ' 12' ' ' ARG . 2.5 p -116.34 109.32 27.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.026 -178.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.456 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 17.7 t-20 -79.13 131.33 36.19 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 177.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 62.5 m-70 -94.24 -7.97 40.52 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -170.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -91.24 -54.87 3.75 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.35 0.595 . . . . 0.0 109.716 177.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 32.2 t-20 -89.53 -6.12 56.66 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.457 -179.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.448 ' HD2' ' HA ' ' A' ' 27' ' ' ARG . 0.5 OUTLIER 58.77 32.25 22.02 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.495 178.074 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.72 124.35 32.89 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.16 0.505 . . . . 0.0 110.818 178.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.3 98.44 7.98 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.77 178.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.6 t -117.55 143.75 45.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.278 0.561 . . . . 0.0 111.743 -172.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.412 ' HZ3' ' HB3' ' A' ' 18' ' ' ARG . 80.6 m95 -101.48 42.24 1.14 Allowed 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 172.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -140.57 151.07 44.42 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.736 -1.12 . . . . 0.0 109.283 -174.132 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.509 ' HA ' ' HD2' ' A' ' 33' ' ' ARG . 1.1 mmm180 -75.77 117.43 63.6 Favored Pre-proline 0 C--N 1.322 -0.616 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 177.065 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo . . . . . 0 C--O 1.235 0.326 0 C-N-CA 123.086 2.524 . . . . 0.0 111.956 -178.815 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.71 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 19.9 mt . . . . . 0 N--CA 1.453 -0.279 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.878 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 79.8 Cg_exo -54.66 160.47 7.25 Favored 'Trans proline' 0 C--O 1.237 0.437 0 C-N-CA 122.827 2.352 . . . . 0.0 111.736 173.725 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.55 88.54 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.746 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 137.3 -8.93 3.79 Favored Glycine 0 N--CA 1.442 -0.907 0 C-N-CA 120.33 -0.938 . . . . 0.0 113.304 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.878 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 88.0 m95 -95.63 140.58 30.24 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 117.869 0.834 . . . . 0.0 109.936 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -131.65 140.58 49.4 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -179.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -93.24 138.03 32.01 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.026 0.441 . . . . 0.0 110.96 -177.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.422 ' HG3' HG11 ' A' ' 22' ' ' VAL . 3.8 mtt180 -132.26 175.83 8.92 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.224 174.145 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 7.7 mptt -130.09 160.89 32.37 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 121.188 0.518 . . . . 0.0 111.128 -175.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -91.22 8.28 36.61 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.683 178.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 72.53 7.78 5.62 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.937 178.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.1 mttp -116.82 -32.89 4.97 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.124 0.488 . . . . 0.0 110.128 175.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 145.19 8.34 0.36 Allowed Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.009 177.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.03 126.78 44.82 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.9 0.35 . . . . 0.0 110.212 177.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.86 120.91 41.44 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.384 -176.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 29.8 p90 -115.89 164.48 14.35 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 175.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -110.3 126.26 54.01 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.062 0.458 . . . . 0.0 111.063 -175.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.422 HG11 ' HG3' ' A' ' 12' ' ' ARG . 2.6 p -118.93 115.16 47.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-O 121.647 0.736 . . . . 0.0 110.263 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 41.1 t-20 -91.3 107.98 19.57 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.33 -0.85 . . . . 0.0 108.981 178.143 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -78.64 -5.4 52.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.762 0.315 . . . . 0.0 111.306 -173.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -100.26 -29.41 12.46 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.868 0.366 . . . . 0.0 110.536 -177.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -107.69 -3.9 18.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.773 178.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 27' ' ' ARG . 0.0 OUTLIER 57.7 54.19 6.51 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.197 -179.357 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.22 130.22 49.25 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.984 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.405 HG23 ' HB ' ' A' ' 22' ' ' VAL . 0.0 OUTLIER -117.9 101.0 7.94 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 176.638 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 10.7 t -116.09 148.4 40.29 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.221 0.534 . . . . 0.0 111.848 -173.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.3 m95 -99.52 14.88 28.37 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.374 -0.83 . . . . 0.0 108.782 172.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -105.66 153.62 21.57 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 114.868 -1.06 . . . . 0.0 109.796 -179.664 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -85.9 116.73 66.85 Favored Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.043 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo . . . . . 0 N--CA 1.462 -0.371 0 C-N-CA 122.844 2.362 . . . . 0.0 112.274 -179.625 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.755 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 30.1 mt . . . . . 0 N--CA 1.451 -0.41 0 N-CA-C 111.294 0.109 . . . . 0.0 111.294 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.768 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 81.2 Cg_exo -59.78 35.7 0.05 OUTLIER 'Trans proline' 0 N--CA 1.486 1.088 0 C-N-CA 124.444 3.429 . . . . 0.0 115.417 175.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.412 ' H ' ' C ' ' A' ' 5' ' ' LEU . 70.8 m 68.14 -54.27 0.52 Allowed 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 123.629 0.771 . . . . 0.0 112.54 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -80.06 -2.16 88.51 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 121.099 -0.572 . . . . 0.0 112.374 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.768 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 83.5 m95 -102.29 138.42 39.25 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -129.52 139.08 51.65 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.898 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -87.67 137.79 32.03 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.888 0.375 . . . . 0.0 110.092 178.219 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 12' ' ' ARG . 1.4 mtp85 -135.87 -177.21 4.59 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.302 176.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.64 142.63 51.3 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.679 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.07 -172.71 2.9 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.688 -178.431 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.24 -36.17 75.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.493 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 19.5 mttm -73.91 -54.39 8.05 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 134.13 20.81 0.81 Allowed Glycine 0 N--CA 1.444 -0.767 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.366 178.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.41 ' HB3' ' HZ3' ' A' ' 31' ' ' TRP . 0.1 OUTLIER -83.94 147.47 27.46 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 110.34 -0.245 . . . . 0.0 110.34 -179.995 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -82.29 105.41 13.34 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.818 0.342 . . . . 0.0 111.022 178.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 42.0 p90 -109.24 152.96 24.5 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 172.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.717 ' HD1' HD11 ' A' ' 5' ' ' LEU . 56.6 m-85 -107.56 123.69 48.82 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.289 0.566 . . . . 0.0 110.478 -174.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.4 p -117.02 114.91 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.612 -177.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.413 ' HB2' ' CD2' ' A' ' 9' ' ' TRP . 26.5 t-20 -82.43 122.24 27.77 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.982 -1.008 . . . . 0.0 108.334 174.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -83.96 -42.95 15.72 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -168.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.28 -42.12 72.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.785 0.326 . . . . 0.0 110.996 -176.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -87.77 -10.76 50.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.568 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 56.62 54.75 7.04 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.996 -179.048 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -116.46 134.19 55.15 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.496 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.63 111.57 17.81 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.424 -179.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.415 HG22 ' CZ3' ' A' ' 9' ' ' TRP . 6.5 t -127.27 153.33 46.27 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.568 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.41 ' HZ3' ' HB3' ' A' ' 18' ' ' ARG . 44.9 m95 -104.33 14.96 29.25 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.359 0.599 . . . . 0.0 109.611 178.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -117.89 165.15 14.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.237 178.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 12.6 mtp85 -86.83 113.56 53.81 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-O 120.734 0.302 . . . . 0.0 110.798 179.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.408 ' HG3' ' CD2' ' A' ' 9' ' ' TRP . 58.1 Cg_endo . . . . . 0 N--CA 1.464 -0.238 0 C-N-CA 122.807 2.338 . . . . 0.0 112.419 178.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.733 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 19.8 mt . . . . . 0 N--CA 1.447 -0.609 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.882 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 87.3 Cg_exo -53.58 150.9 26.26 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 122.733 2.289 . . . . 0.0 111.104 171.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 m -59.97 93.89 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.156 0.503 . . . . 0.0 110.847 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.409 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 139.67 -18.83 2.99 Favored Glycine 0 N--CA 1.44 -1.056 0 C-N-CA 120.917 -0.658 . . . . 0.0 112.307 -177.045 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.882 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 93.9 m95 -93.26 139.16 30.93 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 179.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -128.51 130.83 48.05 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.72 179.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.12 126.22 32.89 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 178.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.406 ' O ' ' HA ' ' A' ' 19' ' ' THR . 59.7 mtp85 -138.57 173.79 11.22 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.389 -178.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -136.03 116.11 13.35 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.408 -174.415 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.48 ' HB2' ' CE1' ' A' ' 20' ' ' TYR . 6.5 t0 -99.65 152.46 20.04 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.496 -177.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 60.02 -100.0 0.1 Allowed 'General case' 0 N--CA 1.463 0.22 0 O-C-N 123.619 0.575 . . . . 0.0 112.072 176.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.55 53.17 0.94 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.0 0.428 . . . . 0.0 110.823 -175.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.404 ' HA2' ' HB2' ' A' ' 13' ' ' LYS . . . 82.64 23.0 57.27 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.863 175.349 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.49 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 18.6 mmm-85 -76.73 110.86 11.67 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.406 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 1.4 m -81.44 124.61 29.58 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.562 -173.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.48 ' CE1' ' HB2' ' A' ' 14' ' ' ASP . 34.2 p90 -137.0 167.2 21.96 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.181 175.227 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.442 ' HD1' HD11 ' A' ' 5' ' ' LEU . 52.6 m-85 -113.6 121.0 42.86 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-O 121.26 0.552 . . . . 0.0 110.097 -179.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.4 p -111.83 117.56 55.45 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.263 -177.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.409 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 24.9 t-20 -90.99 126.43 36.08 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.504 -178.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -94.92 -8.76 36.16 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -173.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -83.53 -54.34 5.02 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 175.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -91.65 -8.63 46.62 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.065 -176.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 58.38 59.48 2.98 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.34 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.01 142.55 51.2 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.272 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.59 100.93 10.49 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.884 177.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.706 HG23 ' H ' ' A' ' 32' ' ' THR . 0.5 OUTLIER -111.78 138.78 47.9 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.05 0.453 . . . . 0.0 111.029 -172.842 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 59.3 m95 -109.89 32.31 5.18 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.502 0.668 . . . . 0.0 109.737 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.706 ' H ' HG23 ' A' ' 30' ' ' THR . 1.3 t -137.47 163.94 29.9 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.418 -177.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.525 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 14.4 mmm180 -75.57 115.28 44.29 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-O 121.111 0.482 . . . . 0.0 110.831 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.525 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 6.7 Cg_exo . . . . . 0 N--CA 1.461 -0.386 0 C-N-CA 123.427 2.752 . . . . 0.0 112.821 -177.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.767 HD13 ' HB3' ' A' ' 9' ' ' TRP . 6.1 mt . . . . . 0 C--O 1.233 0.23 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.661 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 51.3 Cg_exo -60.05 164.05 13.01 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.627 2.218 . . . . 0.0 111.204 171.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -50.76 -37.45 42.21 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -175.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.426 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -102.37 5.86 52.52 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.635 -0.793 . . . . 0.0 114.166 -174.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.767 ' HB3' HD13 ' A' ' 5' ' ' LEU . 89.5 m95 -104.44 144.43 31.68 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 118.227 1.014 . . . . 0.0 109.964 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -137.31 129.05 28.74 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.962 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.14 116.65 24.47 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 175.637 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.72 -170.36 2.11 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.342 0.592 . . . . 0.0 110.892 -177.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -122.22 126.78 48.97 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.38 -178.052 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.496 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -58.76 -53.14 61.7 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.373 -177.853 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 170.99 -47.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 O-C-N 124.098 0.874 . . . . 0.0 109.038 -178.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.32 37.41 1.18 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.629 -177.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.1 -11.52 42.4 Favored Glycine 0 CA--C 1.517 0.205 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.897 177.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.496 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 14.1 mtt180 -61.27 138.25 58.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.937 0.399 . . . . 0.0 111.145 -177.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -97.16 122.25 39.96 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.892 -177.389 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.5 p90 -133.39 153.25 51.76 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 175.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.556 ' CD1' HD11 ' A' ' 5' ' ' LEU . 50.7 m-85 -109.41 119.37 39.25 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.481 0.658 . . . . 0.0 110.391 -176.028 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.2 p -114.84 115.28 49.02 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.188 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.404 -177.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.426 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 28.4 t-20 -85.62 111.23 19.87 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.617 175.123 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -81.28 -10.38 59.59 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.787 -170.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -89.75 -54.83 3.88 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.131 0.491 . . . . 0.0 110.092 -178.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 19.8 t30 -83.96 -4.45 58.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.545 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.4 mtm180 57.41 52.52 8.53 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.013 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.09 134.83 54.76 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.06 0.457 . . . . 0.0 111.304 -178.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.13 104.03 13.9 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.97 179.135 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.552 HG23 HG22 ' A' ' 32' ' ' THR . 0.9 OUTLIER -116.93 129.07 55.82 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.56 -173.626 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.3 m95 -100.31 39.89 1.31 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.356 0.598 . . . . 0.0 110.131 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.552 HG22 HG23 ' A' ' 30' ' ' THR . 0.6 OUTLIER -144.79 151.59 39.04 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.849 -176.88 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.54 ' HD3' ' OH ' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -69.14 114.09 21.13 Favored Pre-proline 0 C--N 1.32 -0.705 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 175.178 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 11.4 Cg_exo . . . . . 0 C--N 1.344 0.299 0 C-N-CA 123.529 2.819 . . . . 0.0 113.593 -176.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.869 HD21 ' HD2' ' A' ' 21' ' ' TYR . 3.6 mp . . . . . 0 N--CA 1.447 -0.592 0 CA-C-O 121.059 0.457 . . . . 0.0 111.095 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.799 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 89.1 Cg_exo -53.16 163.93 2.03 Favored 'Trans proline' 0 N--CA 1.474 0.343 0 C-N-CA 124.084 3.189 . . . . 0.0 113.05 176.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.05 120.07 10.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.353 -0.385 . . . . 0.0 109.967 175.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 108.51 -28.75 10.99 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 111.449 -0.66 . . . . 0.0 111.449 -174.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.799 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 64.4 m95 -83.49 117.17 22.91 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 178.015 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -120.64 136.28 54.87 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 175.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.42 140.21 29.83 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 178.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.427 ' HD2' ' OH ' ' A' ' 20' ' ' TYR . 2.8 mtm180 -139.06 -168.38 2.42 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.243 0.544 . . . . 0.0 110.41 -178.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.3 OUTLIER -140.08 151.2 45.17 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.063 -179.862 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -78.84 -165.93 0.81 Allowed 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 110.313 -0.255 . . . . 0.0 110.313 179.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.61 -15.16 63.25 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.027 0.381 . . . . 0.0 112.027 -176.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -108.08 -44.05 4.26 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.762 0.315 . . . . 0.0 110.807 -178.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 140.35 23.11 0.29 Allowed Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.254 -0.974 . . . . 0.0 113.126 178.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.423 ' HB3' ' HZ3' ' A' ' 31' ' ' TRP . 12.7 mtm-85 -85.99 144.61 27.51 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 177.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.2 117.95 23.28 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -172.26 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.427 ' OH ' ' HD2' ' A' ' 12' ' ' ARG . 13.9 p90 -129.62 149.48 51.36 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.013 171.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.869 ' HD2' HD21 ' A' ' 5' ' ' LEU . 84.0 m-85 -110.21 128.15 55.34 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 120.998 0.427 . . . . 0.0 110.217 -176.712 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 p -117.11 110.1 30.09 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.879 0.847 . . . . 0.0 110.687 -177.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.497 ' HB2' ' CD2' ' A' ' 9' ' ' TRP . 43.2 t-20 -90.07 112.91 24.52 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.139 178.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -71.95 -29.25 64.08 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.642 -174.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -75.36 -57.34 3.95 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.892 0.377 . . . . 0.0 111.132 -174.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -85.82 -5.99 59.16 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.162 -177.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.4 ttm180 62.21 57.63 1.96 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-O 121.241 0.544 . . . . 0.0 111.406 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.23 131.04 53.99 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.889 178.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.53 76.79 1.22 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.461 0.648 . . . . 0.0 109.677 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.6 t -99.27 148.17 24.42 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.835 -170.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.423 ' HZ3' ' HB3' ' A' ' 18' ' ' ARG . 60.5 m95 -100.23 46.35 0.96 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.575 0.702 . . . . 0.0 109.129 175.208 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -152.22 157.27 41.22 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.362 -177.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.448 ' HA ' ' HD2' ' A' ' 34' ' ' PRO . 0.2 OUTLIER -65.23 125.13 88.75 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-O 120.58 0.228 . . . . 0.0 111.001 178.923 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.448 ' HD2' ' HA ' ' A' ' 33' ' ' ARG . 9.7 Cg_endo . . . . . 0 CA--C 1.53 0.283 0 C-N-CA 123.711 2.941 . . . . 0.0 113.242 178.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.745 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 67.3 mt . . . . . 0 N--CA 1.456 -0.155 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.803 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 81.2 Cg_exo -55.68 167.67 2.03 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 124.249 3.299 . . . . 0.0 112.855 172.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.66 95.71 0.11 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.62 178.008 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.407 ' HA3' ' HB2' ' A' ' 25' ' ' ASN . . . 134.42 -22.97 3.67 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.614 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.803 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 88.2 m95 -86.08 129.83 34.72 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 -177.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.471 ' HB3' HG13 ' A' ' 22' ' ' VAL . 38.0 tt0 -122.75 130.41 52.9 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.434 -177.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -87.29 119.63 27.75 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.941 0.401 . . . . 0.0 110.064 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.467 ' HD2' HG11 ' A' ' 22' ' ' VAL . 44.3 mtt180 -126.04 -179.35 4.66 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.991 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.8 mtmp? -140.7 150.69 43.78 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.772 -179.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -93.05 -175.49 3.88 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.006 176.349 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.71 -26.13 68.52 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -177.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.7 mtmp? -87.69 -8.81 55.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.084 0.469 . . . . 0.0 110.432 178.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 90.35 20.95 39.66 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.811 175.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -81.39 123.27 28.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.832 0.316 . . . . 0.0 110.242 177.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -72.75 123.54 23.52 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.409 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.481 ' HB3' ' CE3' ' A' ' 31' ' ' TRP . 37.2 p90 -129.89 155.05 46.67 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 174.23 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.57 ' HD1' HD11 ' A' ' 5' ' ' LEU . 25.6 m-85 -105.93 117.74 34.8 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.38 -176.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.471 HG13 ' HB3' ' A' ' 10' ' ' GLU . 2.3 p -109.94 107.07 21.98 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.203 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.467 ' HB2' ' CD2' ' A' ' 9' ' ' TRP . 55.8 t-20 -84.89 112.56 20.67 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.756 178.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -83.91 -16.49 44.08 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.213 0.53 . . . . 0.0 109.911 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.407 ' HB2' ' HA3' ' A' ' 8' ' ' GLY . 7.6 t-20 -73.57 -54.2 8.75 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.382 178.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.456 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 4.4 t30 -107.44 28.16 8.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.16 -177.609 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER 37.41 51.7 1.19 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.151 0.981 . . . . 0.0 113.047 178.227 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.64 132.34 54.61 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.017 0.437 . . . . 0.0 111.219 -176.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -119.6 104.4 10.25 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 178.544 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.544 ' OG1' HG22 ' A' ' 32' ' ' THR . 3.9 t -126.11 148.01 49.47 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.084 0.469 . . . . 0.0 111.252 -174.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.481 ' CE3' ' HB3' ' A' ' 20' ' ' TYR . 33.9 m95 -99.87 -5.58 28.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.637 177.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.544 HG22 ' OG1' ' A' ' 30' ' ' THR . 2.4 t -95.5 165.81 12.17 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.711 177.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.64 130.21 87.52 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 177.333 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo . . . . . 0 C--O 1.236 0.384 0 C-N-CA 123.128 2.552 . . . . 0.0 112.648 177.798 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.673 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 22.7 mt . . . . . 0 CA--C 1.514 -0.432 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.893 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 72.2 Cg_exo -55.83 155.56 22.19 Favored 'Trans proline' 0 C--O 1.236 0.391 0 C-N-CA 122.526 2.151 . . . . 0.0 111.141 171.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.82 99.72 0.17 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.959 0.409 . . . . 0.0 110.16 -179.47 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.42 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 132.97 -19.01 4.44 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.472 -177.42 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.893 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 90.9 m95 -91.51 135.84 33.56 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -126.95 132.23 50.89 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.756 -177.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.427 ' HG2' HD12 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -90.14 114.62 26.61 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.167 0.508 . . . . 0.0 110.365 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.661 ' HD2' HG11 ' A' ' 22' ' ' VAL . 48.6 mtt180 -109.31 -178.85 3.67 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.647 178.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -136.55 144.02 43.98 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.433 -179.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.416 ' CG ' ' H ' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -96.96 171.46 8.48 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.45 176.653 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.11 -26.28 68.2 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -176.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.416 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 22.9 mmmt -84.66 -4.34 58.96 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.851 0.358 . . . . 0.0 110.686 -179.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.23 12.66 55.96 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.346 177.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.401 ' HB3' ' HZ3' ' A' ' 31' ' ' TRP . 4.0 mmp_? -81.0 144.83 31.51 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 179.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.7 m -98.9 120.5 39.44 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.438 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.0 p90 -124.58 148.31 47.92 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 176.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.602 ' HD1' HD11 ' A' ' 5' ' ' LEU . 58.0 m-85 -105.33 122.08 45.21 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.633 0.73 . . . . 0.0 110.683 -174.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.661 HG11 ' HD2' ' A' ' 12' ' ' ARG . 2.5 p -115.92 113.86 44.5 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.099 -177.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.42 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 37.7 t-20 -89.48 117.35 28.33 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.147 178.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 78.9 m-70 -83.93 -20.79 32.35 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.362 -174.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -84.67 -41.78 15.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.081 0.467 . . . . 0.0 110.434 -179.037 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -95.75 -1.21 50.29 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.96 -178.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 56.21 40.77 29.93 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.701 177.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.67 141.82 47.7 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.858 0.361 . . . . 0.0 111.352 -176.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.42 109.75 14.26 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.255 178.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 2.6 t -127.62 151.46 48.9 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.017 0.437 . . . . 0.0 110.987 -177.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.401 ' HZ3' ' HB3' ' A' ' 18' ' ' ARG . 47.2 m95 -103.19 12.93 35.08 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -109.24 158.76 17.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.576 -178.127 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.438 HH11 ' HD3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -85.21 116.69 66.54 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-O 120.769 0.318 . . . . 0.0 111.161 178.209 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo . . . . . 0 N--CA 1.455 -0.791 0 C-N-CA 122.639 2.226 . . . . 0.0 111.55 175.971 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.613 HD11 ' HD1' ' A' ' 21' ' ' TYR . 20.6 mt . . . . . 0 N--CA 1.451 -0.405 0 CA-C-O 120.749 0.309 . . . . 0.0 111.102 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.798 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 74.2 Cg_exo -56.8 162.65 8.4 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.922 2.415 . . . . 0.0 111.274 169.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -14.61 9.69 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -176.002 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -108.48 -1.98 32.94 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.424 -0.894 . . . . 0.0 113.406 -177.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.798 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 80.0 m95 -104.34 138.61 40.51 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 117.932 0.866 . . . . 0.0 110.676 -176.402 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -121.48 133.94 55.05 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.43 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.06 120.15 32.42 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.159 0.504 . . . . 0.0 110.374 -179.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.568 ' HG3' HG11 ' A' ' 22' ' ' VAL . 0.8 OUTLIER -115.61 165.63 12.82 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.691 177.203 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -114.28 135.76 53.72 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.861 -177.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.407 ' O ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -66.91 -57.71 6.41 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.952 178.9 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 14' ' ' ASP . . . 168.07 -48.64 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.296 0 O-C-N 123.958 0.786 . . . . 0.0 109.583 -178.432 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.59 45.9 1.0 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.686 0.755 . . . . 0.0 110.901 -175.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.26 -17.46 18.29 Favored Glycine 0 C--N 1.317 -0.5 0 CA-C-N 114.816 -1.084 . . . . 0.0 113.227 176.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -65.02 118.14 8.68 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.931 0.396 . . . . 0.0 110.664 -178.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -102.89 130.61 49.99 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.496 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 37.6 p90 -124.13 161.73 25.04 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.129 0.49 . . . . 0.0 110.322 176.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.613 ' HD1' HD11 ' A' ' 5' ' ' LEU . 33.6 m-85 -108.47 117.52 34.38 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.43 -174.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.568 HG11 ' HG3' ' A' ' 12' ' ' ARG . 3.7 p -115.53 115.65 50.01 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 CA-C-O 121.822 0.82 . . . . 0.0 109.695 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 29.3 t-20 -90.22 108.45 19.76 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.771 -177.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -88.25 38.68 0.87 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.179 0.514 . . . . 0.0 111.042 -176.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -137.3 -47.76 0.58 Allowed 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 178.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -92.54 -8.35 44.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.115 174.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.93 56.8 2.75 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.678 177.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -127.61 155.35 44.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.168 0.509 . . . . 0.0 111.192 177.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.44 102.94 8.58 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.151 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.667 ' HB ' ' HZ3' ' A' ' 9' ' ' TRP . 0.9 OUTLIER -120.17 136.88 54.47 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.198 -169.519 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 58.0 m95 -101.99 -19.32 15.26 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.052 0.453 . . . . 0.0 110.238 178.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.467 HG22 HG23 ' A' ' 30' ' ' THR . 1.4 t -79.63 163.0 24.94 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.731 179.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.44 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 8.2 mpt_? -78.06 120.92 83.07 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 176.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 16.1 Cg_exo . . . . . 0 C--N 1.343 0.283 0 C-N-CA 122.769 2.313 . . . . 0.0 111.773 179.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.832 HD13 ' HB3' ' A' ' 9' ' ' TRP . 7.4 mt . . . . . 0 C--O 1.234 0.27 0 CA-C-O 120.816 0.341 . . . . 0.0 110.859 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.878 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 50.9 Cg_exo -61.02 -161.47 0.03 OUTLIER 'Trans proline' 0 N--CA 1.474 0.33 0 C-N-CA 124.034 3.156 . . . . 0.0 114.016 -179.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.9 94.2 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.945 -1.025 . . . . 0.0 112.55 -174.703 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 77.66 18.43 77.47 Favored Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 121.003 -0.618 . . . . 0.0 113.727 173.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.878 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 74.6 m95 -82.63 129.19 34.9 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 176.549 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -132.38 136.76 47.03 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 121.174 -0.21 . . . . 0.0 110.659 -179.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.405 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 1.6 pt-20 -90.34 117.27 28.93 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.456 0.646 . . . . 0.0 109.602 174.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.493 ' O ' ' HA ' ' A' ' 19' ' ' THR . 0.0 OUTLIER -110.17 -174.84 2.58 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.543 -179.614 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.33 130.19 26.22 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.618 -178.16 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.693 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . 35.0 t70 -81.47 55.01 2.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.221 177.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 67.77 -58.19 0.44 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.845 0.858 . . . . 0.0 112.656 178.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.63 30.01 0.66 Allowed 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 122.611 0.365 . . . . 0.0 111.708 -174.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 77.17 7.89 86.87 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 120.959 -0.639 . . . . 0.0 113.079 177.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.693 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 0.1 OUTLIER -74.06 99.06 3.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.668 0.271 . . . . 0.0 110.315 178.613 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.493 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 30.3 m -72.86 121.68 20.37 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.329 0.585 . . . . 0.0 112.168 -177.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.486 ' HB3' ' CE3' ' A' ' 31' ' ' TRP . 28.3 p90 -126.85 142.76 51.46 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.39 -0.823 . . . . 0.0 108.796 171.125 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.605 ' HD2' HD11 ' A' ' 5' ' ' LEU . 74.2 m-85 -98.39 120.59 39.08 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.695 0.76 . . . . 0.0 110.21 -176.659 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 p -111.98 117.0 54.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.276 -177.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -89.04 120.03 30.09 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.472 -0.785 . . . . 0.0 108.963 177.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -82.32 -22.24 35.69 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.78 -173.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -76.88 -47.82 20.1 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.251 -174.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -107.59 7.49 28.7 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.928 0.394 . . . . 0.0 110.726 178.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 54.03 45.2 28.08 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.399 178.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.88 135.0 35.66 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.305 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.77 108.7 12.8 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.629 -179.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 12.4 t -127.51 149.61 50.05 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.126 0.488 . . . . 0.0 110.701 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.486 ' CE3' ' HB3' ' A' ' 20' ' ' TYR . 49.1 m95 -102.77 21.51 15.36 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.569 0.7 . . . . 0.0 109.203 177.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -118.9 160.71 21.44 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 114.911 -1.041 . . . . 0.0 109.367 175.247 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.462 ' HG3' ' CE1' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -78.43 120.97 83.05 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-O 120.681 0.277 . . . . 0.0 110.288 179.101 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo . . . . . 0 N--CA 1.461 -0.391 0 C-N-CA 122.65 2.233 . . . . 0.0 112.332 -178.061 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.73 HD11 ' HD1' ' A' ' 21' ' ' TYR . 17.9 mt . . . . . 0 CA--C 1.516 -0.341 0 CA-C-O 120.723 0.297 . . . . 0.0 110.856 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.788 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 83.6 Cg_exo -53.7 144.34 54.05 Favored 'Trans proline' 0 CA--C 1.52 -0.198 0 C-N-CA 122.901 2.401 . . . . 0.0 110.774 170.744 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.0 m -58.12 92.38 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.29 0.567 . . . . 0.0 110.214 178.148 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.47 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 145.75 -29.21 1.72 Allowed Glycine 0 N--CA 1.438 -1.204 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.515 -173.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.788 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 93.2 m95 -90.64 131.07 36.55 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 176.639 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -124.04 117.44 24.73 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -179.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -81.8 103.55 11.56 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 121.66 0.743 . . . . 0.0 110.098 176.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.567 ' HD2' HG11 ' A' ' 22' ' ' VAL . 9.2 mtt-85 -107.94 174.88 5.68 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.638 -1.164 . . . . 0.0 109.105 -178.358 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.91 128.77 54.73 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 120.937 0.398 . . . . 0.0 110.467 -176.073 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -99.46 -2.97 34.66 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.609 0.719 . . . . 0.0 109.416 -179.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.628 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . . . -159.76 -156.41 0.5 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.909 -1.041 . . . . 0.0 109.915 -179.18 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.57 32.58 0.65 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.239 0.543 . . . . 0.0 111.188 -174.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 149.63 -6.81 0.78 Allowed Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.23 -177.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.628 ' HB2' ' HB3' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -79.16 101.44 7.93 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 175.533 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.53 134.87 36.61 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.124 -176.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 28.1 p90 -134.36 155.92 49.42 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.412 176.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.73 ' HD1' HD11 ' A' ' 5' ' ' LEU . 24.8 m-85 -106.45 113.71 27.39 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.352 0.596 . . . . 0.0 110.622 -175.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.567 HG11 ' HD2' ' A' ' 12' ' ' ARG . 2.3 p -108.55 111.17 34.83 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.208 -179.58 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.47 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 23.8 t-20 -82.21 121.77 27.06 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 178.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 59.8 m-70 -84.19 -17.86 38.54 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -169.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.7 p30 -95.34 -37.69 10.85 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.269 -0.572 . . . . 0.0 110.874 -179.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 19.5 t30 -93.75 -2.81 53.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.537 -0.302 . . . . 0.0 110.625 178.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 26.4 mtm180 55.58 45.89 23.97 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.461 176.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.04 131.61 56.31 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.108 0.48 . . . . 0.0 111.22 -178.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -111.35 96.34 6.06 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.955 -178.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.494 HG22 ' HZ3' ' A' ' 9' ' ' TRP . 1.8 t -116.46 145.38 43.33 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.238 0.542 . . . . 0.0 111.434 -175.22 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 31.8 m95 -99.85 7.9 44.58 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 171.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -97.2 144.57 26.89 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.522 -177.626 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.454 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 8.9 mmm180 -67.99 119.54 67.75 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-O 120.74 0.305 . . . . 0.0 111.213 177.776 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 6.7 Cg_exo . . . . . 0 C--N 1.342 0.214 0 C-N-CA 123.428 2.752 . . . . 0.0 112.518 178.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.821 HD11 ' HD1' ' A' ' 21' ' ' TYR . 28.3 mt . . . . . 0 N--CA 1.448 -0.535 0 CA-C-O 119.544 -0.265 . . . . 0.0 110.364 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.746 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 87.3 Cg_exo -58.41 42.16 0.05 OUTLIER 'Trans proline' 0 N--CA 1.489 1.229 0 C-N-CA 124.627 3.552 . . . . 0.0 115.749 176.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.8 m 66.43 -59.45 0.34 Allowed 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.993 0.917 . . . . 0.0 112.752 177.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -73.46 -19.59 79.7 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 121.194 -0.527 . . . . 0.0 112.163 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.8 ' HB3' HD13 ' A' ' 5' ' ' LEU . 93.6 m95 -87.58 137.81 32.02 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 179.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -128.23 122.4 31.7 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.926 179.012 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -82.66 117.9 22.94 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.135 0.493 . . . . 0.0 110.021 178.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.501 ' O ' ' HA ' ' A' ' 19' ' ' THR . 39.0 mtt180 -122.77 -176.47 3.4 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.887 -178.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -133.48 137.84 45.86 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.065 -179.024 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -77.85 -175.9 4.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.667 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.07 -28.53 69.67 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.726 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.8 mmtt -82.28 -27.37 32.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.874 0.369 . . . . 0.0 110.665 177.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 113.14 13.5 10.81 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.686 -0.769 . . . . 0.0 113.136 176.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.493 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.3 OUTLIER -84.95 142.04 29.93 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.848 0.356 . . . . 0.0 110.492 179.258 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.501 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 0.7 OUTLIER -79.11 125.09 28.96 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.339 -178.909 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -127.75 161.3 29.28 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 172.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.821 ' HD1' HD11 ' A' ' 5' ' ' LEU . 50.6 m-85 -112.89 111.28 21.92 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.535 0.683 . . . . 0.0 110.712 -173.313 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.486 HG11 ' HD2' ' A' ' 12' ' ' ARG . 3.0 p -108.51 107.64 23.32 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.035 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.455 -178.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.482 ' HB3' ' OG1' ' A' ' 28' ' ' THR . 54.3 t-20 -82.1 112.8 19.47 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.037 178.139 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -82.15 -17.31 46.79 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.068 0.461 . . . . 0.0 110.368 -176.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -81.44 -41.13 22.29 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.279 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 57.7 m-20 -97.99 -3.25 38.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.042 -178.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 57.76 52.31 8.27 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.982 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.482 ' OG1' ' HB3' ' A' ' 23' ' ' ASN . 33.8 p -124.25 132.15 53.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.995 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.67 78.87 1.61 Allowed 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 173.333 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.573 ' HB ' ' HZ3' ' A' ' 9' ' ' TRP . 0.9 OUTLIER -91.72 128.98 37.76 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.449 -169.043 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 39.5 m95 -101.61 58.97 0.86 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.27 0.557 . . . . 0.0 109.72 177.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -167.26 146.88 5.25 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.327 -176.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.469 ' HD2' ' OH ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -67.18 114.61 19.38 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-O 120.64 0.257 . . . . 0.0 110.659 177.562 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo . . . . . 0 N--CA 1.463 -0.277 0 C-N-CA 122.853 2.368 . . . . 0.0 112.688 -177.195 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.804 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 10.5 mt . . . . . 0 N--CA 1.45 -0.454 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.872 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 75.8 Cg_exo -54.35 163.74 3.34 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.855 2.37 . . . . 0.0 112.29 174.421 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.64 94.73 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.361 -177.321 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.416 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 128.38 -17.61 5.86 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.208 178.168 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.872 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 96.5 m95 -87.55 134.47 33.62 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 117.794 0.797 . . . . 0.0 110.165 -177.063 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -125.8 132.66 52.23 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.753 177.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.445 ' H ' ' HG3' ' A' ' 11' ' ' GLU . 0.0 OUTLIER -88.42 117.74 27.57 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.274 0.559 . . . . 0.0 110.893 -178.998 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.6 ttp85 -121.68 -177.95 3.69 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.523 0.678 . . . . 0.0 110.32 177.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.45 129.3 23.2 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.445 -177.103 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -81.7 176.01 9.99 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 120.788 -0.365 . . . . 0.0 110.467 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.16 -19.89 63.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.902 0.382 . . . . 0.0 111.269 -178.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.5 mttp -71.89 -28.15 63.32 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.548 176.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 112.07 -23.29 16.83 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.454 -178.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.77 144.3 52.74 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.975 0.417 . . . . 0.0 111.929 -176.15 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.19 138.48 32.34 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.632 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 49.0 p90 -141.1 162.75 34.75 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 172.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.629 ' HD1' HD11 ' A' ' 5' ' ' LEU . 8.9 m-85 -111.93 120.24 41.25 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.134 0.492 . . . . 0.0 110.839 -174.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.448 ' HB ' HG23 ' A' ' 29' ' ' THR . 2.5 p -109.22 114.4 46.81 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.01 179.034 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.431 ' HB2' ' CE3' ' A' ' 9' ' ' TRP . 57.5 t-20 -88.74 113.67 24.55 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.92 -179.535 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -80.72 -16.14 54.69 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.769 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -85.88 -32.96 21.38 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.486 -179.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -104.13 -11.0 17.55 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.2 -178.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 65.1 37.47 6.66 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.0 -179.131 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.64 141.23 51.96 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.953 0.406 . . . . 0.0 111.382 -178.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.448 HG23 ' HB ' ' A' ' 22' ' ' VAL . 0.2 OUTLIER -114.93 93.47 4.33 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.856 178.471 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.6 146.48 25.25 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.289 0.566 . . . . 0.0 111.335 -173.418 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 55.9 m95 -106.93 8.4 30.54 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.834 177.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.7 t -110.28 161.52 15.53 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.81 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.48 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 0.0 OUTLIER -77.03 121.71 85.16 Favored Pre-proline 0 C--N 1.321 -0.64 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 176.447 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.48 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 17.6 Cg_exo . . . . . 0 C--N 1.345 0.377 0 C-N-CA 122.883 2.389 . . . . 0.0 112.44 -177.036 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.863 HD11 ' HD1' ' A' ' 21' ' ' TYR . 27.8 mt . . . . . 0 N--CA 1.454 -0.258 0 CA-C-O 120.803 0.335 . . . . 0.0 111.583 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.674 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 86.4 Cg_exo -54.95 167.15 1.72 Allowed 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 123.426 2.751 . . . . 0.0 111.815 170.493 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.97 -8.28 15.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.837 0.351 . . . . 0.0 111.655 -177.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -113.94 -0.56 24.16 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.615 -179.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.674 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 84.2 m95 -109.35 131.18 55.31 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 117.793 0.796 . . . . 0.0 110.001 -178.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -114.21 133.17 55.8 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.526 ' HG2' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -87.19 118.47 26.62 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 178.85 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -114.28 175.54 5.43 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.144 0.497 . . . . 0.0 110.133 179.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.41 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -140.3 132.3 27.81 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.933 -178.269 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.09 27.88 0.98 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.055 -179.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 73.01 -34.63 0.3 Allowed 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 123.546 0.738 . . . . 0.0 112.635 176.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -90.02 35.27 0.85 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.062 0.458 . . . . 0.0 111.027 -178.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 72.8 5.49 64.7 Favored Glycine 0 C--N 1.328 0.102 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.119 178.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.41 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -83.56 101.76 11.68 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 -177.001 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 4.7 m -90.36 122.25 33.08 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.075 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 37.5 p90 -129.24 158.43 39.07 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.054 0.454 . . . . 0.0 109.999 178.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.863 ' HD1' HD11 ' A' ' 5' ' ' LEU . 46.2 m-85 -105.7 117.7 34.69 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.385 -174.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.7 p -110.98 114.77 48.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.847 0 CA-C-O 121.626 0.726 . . . . 0.0 110.092 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -84.41 126.21 33.04 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.43 -179.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 -84.89 -12.53 53.26 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -171.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -83.32 -59.17 2.55 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.141 0.496 . . . . 0.0 110.042 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -87.89 -15.62 36.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.872 -176.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 69.46 34.73 2.74 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.271 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.5 134.47 33.67 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.702 178.017 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.5 91.66 4.14 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 176.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.613 HG23 HG22 ' A' ' 32' ' ' THR . 0.9 OUTLIER -105.85 122.38 45.99 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.354 -168.038 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 67.2 m95 -97.36 40.03 1.17 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.551 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.613 HG22 HG23 ' A' ' 30' ' ' THR . 6.6 t -156.89 172.14 19.18 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.461 -0.79 . . . . 0.0 108.884 -177.44 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.548 ' HA ' ' HD2' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -74.13 134.38 77.47 Favored Pre-proline 0 C--N 1.318 -0.77 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.569 177.911 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo . . . . . 0 C--N 1.349 0.573 0 C-N-CA 123.422 2.748 . . . . 0.0 112.948 174.539 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.87 HD13 ' HB3' ' A' ' 9' ' ' TRP . 14.8 mt . . . . . 0 N--CA 1.454 -0.244 0 CA-C-O 120.31 0.1 . . . . 0.0 110.823 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.771 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 75.6 Cg_exo -59.32 -167.14 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.363 2.709 . . . . 0.0 113.458 174.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.18 -49.44 75.95 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.233 -0.894 . . . . 0.0 112.713 -174.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.55 ' HA3' ' OD1' ' A' ' 25' ' ' ASN . . . -116.34 19.59 13.01 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 119.968 -1.11 . . . . 0.0 114.309 -172.529 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.87 ' HB3' HD13 ' A' ' 5' ' ' LEU . 92.5 m95 -100.28 140.25 34.8 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 117.819 0.809 . . . . 0.0 110.125 -179.09 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.523 ' OE1' ' HD2' ' A' ' 12' ' ' ARG . 21.4 tt0 -133.51 125.13 28.25 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 177.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -85.2 119.55 25.7 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.941 0.4 . . . . 0.0 110.322 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.523 ' HD2' ' OE1' ' A' ' 10' ' ' GLU . 0.3 OUTLIER -116.6 -166.5 1.16 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.956 178.98 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.504 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.4 OUTLIER -135.1 149.1 49.99 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.634 -174.511 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -78.48 -164.99 0.63 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.261 177.17 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.46 -20.41 63.1 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -178.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.419 ' HD3' ' HA ' ' A' ' 16' ' ' LYS . 61.5 mmtt -107.47 -50.6 3.05 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.757 0.313 . . . . 0.0 111.217 -178.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 152.97 21.48 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.592 -0.813 . . . . 0.0 113.071 -179.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.504 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -77.63 128.82 34.74 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 177.397 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.441 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 0.2 OUTLIER -80.59 113.02 18.49 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.031 0.443 . . . . 0.0 111.753 -176.468 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.8 p90 -120.97 156.86 31.18 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 173.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.781 ' HD1' HD11 ' A' ' 5' ' ' LEU . 20.8 m-85 -106.4 122.18 45.75 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.23 0.538 . . . . 0.0 110.929 -172.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.415 HG11 ' HD3' ' A' ' 12' ' ' ARG . 2.5 p -119.16 111.16 32.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.787 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.229 179.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 31.8 t-20 -77.71 128.17 33.62 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 177.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 65.7 m-70 -95.19 -15.07 23.55 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -168.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.55 ' OD1' ' HA3' ' A' ' 8' ' ' GLY . 10.6 p-10 -103.52 -20.21 14.11 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.95 179.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -105.71 -16.06 14.79 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.087 0.47 . . . . 0.0 110.198 175.205 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.12 50.0 2.55 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.426 177.626 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -112.65 128.35 56.36 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.991 178.609 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.17 103.51 12.72 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.731 176.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.553 HG23 ' H ' ' A' ' 32' ' ' THR . 1.4 t -125.12 147.92 48.79 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.422 0.63 . . . . 0.0 111.667 -174.181 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 57.1 m95 -106.63 39.99 1.72 Allowed 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 174.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.553 ' H ' HG23 ' A' ' 30' ' ' THR . 0.5 OUTLIER -136.32 154.67 50.79 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.47 -178.102 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.434 HH11 ' HD3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -75.88 112.39 19.81 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-O 120.743 0.306 . . . . 0.0 110.8 -179.187 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 31.6 Cg_exo . . . . . 0 C--N 1.345 0.349 0 C-N-CA 123.26 2.64 . . . . 0.0 112.607 -179.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.748 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 39.1 mt . . . . . 0 N--CA 1.448 -0.546 0 CA-C-O 120.607 0.242 . . . . 0.0 110.642 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.729 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 75.6 Cg_exo -56.67 164.13 6.21 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 122.452 2.101 . . . . 0.0 110.839 166.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -66.69 -8.8 30.3 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.94 0.4 . . . . 0.0 111.374 -177.13 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -99.87 -21.47 13.98 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 121.013 -0.613 . . . . 0.0 113.231 177.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.748 ' HB2' ' HB3' ' A' ' 5' ' ' LEU . 74.3 m95 -96.35 143.67 27.2 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 117.442 0.621 . . . . 0.0 110.097 -173.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -136.38 131.66 34.51 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.111 178.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -83.24 125.51 31.65 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.127 0.489 . . . . 0.0 110.095 178.261 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 2.6 ttt180 -121.69 -166.15 1.34 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.912 179.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.615 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 28.6 mtpt -135.85 149.22 48.96 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.186 -179.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.438 ' CG ' ' H ' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -95.06 177.17 5.97 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.426 175.55 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.42 -28.02 67.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.821 0.343 . . . . 0.0 111.778 -177.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.438 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 2.6 mtmp? -88.1 -9.48 53.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.238 -178.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 100.67 11.99 39.18 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.752 -0.737 . . . . 0.0 113.158 176.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.615 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -77.04 161.2 28.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 117.082 0.441 . . . . 0.0 110.302 178.606 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.53 116.85 32.75 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.952 -178.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.8 p90 -125.12 157.94 35.12 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 175.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.619 ' CD1' HD11 ' A' ' 5' ' ' LEU . 31.5 m-85 -106.29 118.8 37.58 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.397 0.618 . . . . 0.0 110.804 -175.332 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.1 p -108.83 110.94 33.91 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.089 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.421 ' HB2' ' CD2' ' A' ' 9' ' ' TRP . 23.2 t30 -84.31 121.47 27.56 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.457 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -82.05 -21.49 36.89 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.45 -174.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.96 -57.92 3.7 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.415 -177.184 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -101.2 1.81 39.38 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.343 -177.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.1 29.21 17.53 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 123.577 0.548 . . . . 0.0 111.64 -179.031 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.6 129.71 34.99 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.967 0.413 . . . . 0.0 110.353 177.213 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -118.96 107.28 13.35 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.203 -178.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.632 HG22 ' HZ3' ' A' ' 9' ' ' TRP . 6.5 t -127.56 149.24 50.24 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.208 0.528 . . . . 0.0 111.697 -175.588 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.436 ' HZ3' ' HB3' ' A' ' 18' ' ' ARG . 16.4 m95 -97.92 7.95 45.52 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 172.507 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -103.92 150.79 23.86 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 114.26 -1.336 . . . . 0.0 110.352 -176.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.502 ' HA ' ' HD2' ' A' ' 33' ' ' ARG . 11.0 mmm180 -72.68 121.32 84.64 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-O 120.762 0.315 . . . . 0.0 110.91 177.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 21.9 Cg_exo . . . . . 0 C--O 1.236 0.415 0 C-N-CA 122.906 2.404 . . . . 0.0 112.058 179.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.596 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 36.4 mt . . . . . 0 N--CA 1.454 -0.275 0 CA-C-O 120.718 0.294 . . . . 0.0 110.624 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.819 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 77.7 Cg_exo -57.27 156.08 26.98 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 122.841 2.361 . . . . 0.0 111.23 170.561 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.42 90.06 0.07 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.104 0.478 . . . . 0.0 110.654 179.6 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 142.08 -15.72 2.57 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.417 -178.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.819 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 86.6 m95 -93.46 143.86 25.89 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 117.152 0.476 . . . . 0.0 109.841 179.654 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -137.62 136.12 37.22 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.364 -177.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.83 124.79 34.0 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.778 0.323 . . . . 0.0 110.237 178.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 73.5 mtt180 -131.91 172.5 12.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.851 0.358 . . . . 0.0 110.33 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.449 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -117.88 161.39 19.83 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.107 -174.365 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.438 ' CG ' ' H ' ' A' ' 16' ' ' LYS . 1.1 p-10 -111.55 -171.93 1.94 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.908 176.418 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.11 -13.19 60.21 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -178.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.438 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -89.18 -35.15 16.39 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.636 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 118.94 20.92 3.97 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 121.07 -0.586 . . . . 0.0 112.121 179.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.449 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -95.89 153.92 17.5 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.634 0.254 . . . . 0.0 110.488 -179.837 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.6 m -106.53 116.41 31.89 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.269 179.032 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -114.99 163.67 15.26 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 175.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.591 ' HD1' HD11 ' A' ' 5' ' ' LEU . 75.0 m-85 -110.28 122.84 48.62 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.504 0.668 . . . . 0.0 110.827 -177.518 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.4 p -115.31 118.37 58.58 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.032 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -82.64 132.51 35.18 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 176.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 34.0 m-70 -87.59 -31.96 19.58 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -169.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -87.06 -35.03 18.96 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.107 0.479 . . . . 0.0 110.543 -179.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -85.46 -28.72 24.84 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.475 178.167 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 64.63 46.56 3.13 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.955 -177.287 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.92 132.91 53.61 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.331 177.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -111.92 101.48 9.79 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.09 0.471 . . . . 0.0 109.952 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.5 t -120.55 150.1 41.39 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.152 0.501 . . . . 0.0 110.815 -175.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -99.39 46.28 0.98 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.293 0.568 . . . . 0.0 109.646 179.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.9 t -153.98 141.49 19.79 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.227 -0.897 . . . . 0.0 108.793 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.439 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 0.0 OUTLIER -88.08 112.81 51.73 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-O 121.623 0.725 . . . . 0.0 109.665 178.948 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.503 ' HG2' ' CE2' ' A' ' 9' ' ' TRP . 3.6 Cg_exo . . . . . 0 N--CA 1.458 -0.595 0 C-N-CA 123.553 2.836 . . . . 0.0 112.628 -173.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.723 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 19.6 mt . . . . . 0 N--CA 1.453 -0.295 0 CA-C-O 120.689 0.281 . . . . 0.0 110.928 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.892 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 52.2 Cg_exo -61.0 -179.47 0.3 Allowed 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.352 2.701 . . . . 0.0 112.776 175.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.12 104.35 0.24 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.024 -177.28 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.511 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 95.73 5.38 60.02 Favored Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 120.998 -0.62 . . . . 0.0 113.744 173.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.892 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 82.1 m95 -91.67 130.8 37.4 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 117.804 0.802 . . . . 0.0 109.832 -179.49 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -132.14 145.85 51.65 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 178.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.95 137.54 37.35 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.319 0.581 . . . . 0.0 110.241 179.258 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.9 mtm180 -130.81 177.45 7.4 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.839 177.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.441 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -135.98 135.65 39.7 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.408 0.623 . . . . 0.0 111.356 -177.346 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.617 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . 12.3 t70 -67.81 159.99 29.19 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.151 -0.932 . . . . 0.0 108.8 172.011 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.1 -29.2 63.32 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.743 0.306 . . . . 0.0 111.811 -178.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.7 mttp -85.74 4.43 36.78 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.163 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 86.33 34.37 12.39 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.628 177.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.617 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 1.9 mtp180 -95.72 128.52 42.67 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 179.187 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 32.9 m -90.94 125.18 35.7 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.988 0.423 . . . . 0.0 111.361 -175.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -139.94 162.7 34.56 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 176.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.549 ' HD1' HD11 ' A' ' 5' ' ' LEU . 71.1 m-85 -113.72 125.86 54.59 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.154 0.502 . . . . 0.0 110.803 -175.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.8 p -116.23 110.38 31.38 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.174 -178.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.511 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 33.5 t-20 -81.91 117.86 22.49 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 176.141 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -78.07 -22.78 48.53 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.867 0.365 . . . . 0.0 110.95 -174.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -81.74 -43.66 18.11 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.522 -178.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.423 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 43.4 t30 -100.54 6.21 44.19 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.733 -178.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.423 ' HG2' ' O ' ' A' ' 26' ' ' ASN . 7.9 ptp180 45.54 35.84 2.23 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.295 1.038 . . . . 0.0 112.638 -179.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.76 122.34 43.76 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 121.073 0.463 . . . . 0.0 111.24 -178.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -104.47 86.46 2.52 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.164 178.326 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.519 HG23 ' H ' ' A' ' 32' ' ' THR . 1.3 t -98.9 153.0 19.15 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.072 -174.604 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 57.2 m95 -107.42 24.34 13.02 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.471 0.653 . . . . 0.0 109.482 178.048 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.519 ' H ' HG23 ' A' ' 30' ' ' THR . 0.6 OUTLIER -123.74 159.26 29.83 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.252 -177.439 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.94 114.36 43.44 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 175.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo . . . . . 0 C--O 1.233 0.259 0 C-N-CA 122.946 2.431 . . . . 0.0 112.82 -179.428 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.788 HD11 ' HD1' ' A' ' 21' ' ' TYR . 59.3 mt . . . . . 0 N--CA 1.448 -0.55 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.702 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 72.9 Cg_exo -58.64 171.92 1.75 Allowed 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.964 2.442 . . . . 0.0 112.159 171.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.79 7.37 1.15 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.18 -0.464 . . . . 0.0 112.129 -175.477 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -137.73 6.65 3.53 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.999 178.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' TRP . . . . . 0.764 ' HB3' HD13 ' A' ' 5' ' ' LEU . 79.6 m95 -111.47 134.39 53.08 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 117.268 0.534 . . . . 0.0 109.577 -178.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.617 ' OE1' ' HD2' ' A' ' 12' ' ' ARG . 43.3 tt0 -120.08 121.51 39.02 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.044 -178.793 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -85.03 117.7 24.15 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.024 0.44 . . . . 0.0 109.839 177.211 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.617 ' HD2' ' OE1' ' A' ' 10' ' ' GLU . 2.3 mtp180 -115.18 -170.0 1.67 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.36 -178.254 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.06 134.04 30.8 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.167 -175.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.416 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . 5.8 t70 -76.82 164.82 25.48 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.523 173.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.76 -22.77 67.07 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.071 0.462 . . . . 0.0 111.261 -177.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.487 ' HG3' ' HG2' ' A' ' 18' ' ' ARG . 13.5 pttm -96.24 14.88 22.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.344 178.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 72.13 45.65 39.41 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.499 178.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.487 ' HG2' ' HG3' ' A' ' 16' ' ' LYS . 6.6 mmt-85 -106.21 143.4 34.4 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 178.612 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.1 m -100.33 115.17 29.33 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.613 -175.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.1 p90 -133.84 161.67 34.11 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.998 -0.547 . . . . 0.0 109.828 175.171 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.788 ' HD1' HD11 ' A' ' 5' ' ' LEU . 35.7 m-85 -116.62 125.07 51.27 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.243 0.544 . . . . 0.0 110.673 -175.064 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.598 HG11 ' HD3' ' A' ' 12' ' ' ARG . 2.5 p -118.8 108.85 25.09 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 121.815 0.817 . . . . 0.0 110.574 -178.407 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -80.85 116.32 20.78 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.143 -0.935 . . . . 0.0 108.779 178.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -86.4 -16.15 38.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.802 0.334 . . . . 0.0 111.375 -174.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -76.55 -36.07 57.86 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.936 0.398 . . . . 0.0 110.425 -179.193 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -113.12 -2.82 14.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.057 -179.098 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 57.74 52.76 7.78 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.045 -178.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.6 130.21 56.75 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.904 179.35 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.55 105.44 15.08 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.798 177.774 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.422 HG22 ' HZ3' ' A' ' 9' ' ' TRP . 0.7 OUTLIER -127.81 152.59 47.6 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 120.765 0.317 . . . . 0.0 110.926 -176.279 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 46.6 m95 -101.15 -3.18 29.63 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.917 0.865 . . . . 0.0 108.718 173.123 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.449 ' O ' ' HD3' ' A' ' 34' ' ' PRO . 1.8 m -74.52 136.91 42.18 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.334 -1.303 . . . . 0.0 110.339 177.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.08 110.86 11.18 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.637 0.256 . . . . 0.0 110.7 177.696 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.536 ' HG2' HD22 ' A' ' 5' ' ' LEU . 73.4 Cg_endo . . . . . 0 N--CA 1.456 -0.699 0 C-N-CA 122.642 2.228 . . . . 0.0 112.642 -179.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.586 0 N-CA-C 111.702 -0.559 . . . . 0.0 111.702 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -114.46 114.75 45.0 Favored Pre-proline 0 C--N 1.323 -0.556 0 CA-C-O 120.815 0.34 . . . . 0.0 111.195 -178.626 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -68.2 142.0 54.1 Favored 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 122.843 2.362 . . . . 0.0 111.176 174.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.27 -27.4 4.78 Favored Glycine 0 N--CA 1.447 -0.617 0 C-N-CA 120.921 -0.657 . . . . 0.0 111.668 179.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.817 HD21 ' HD2' ' A' ' 21' ' ' TYR . 5.2 mp -76.39 127.11 85.4 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-O 120.626 0.25 . . . . 0.0 110.768 178.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.833 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 82.9 Cg_exo -53.43 160.88 4.5 Favored 'Trans proline' 0 N--CA 1.477 0.543 0 C-N-CA 123.833 3.022 . . . . 0.0 113.578 177.024 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 m -63.58 103.77 0.57 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.449 176.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 128.61 -22.08 5.27 Favored Glycine 0 N--CA 1.447 -0.609 0 N-CA-C 111.253 -0.739 . . . . 0.0 111.253 -176.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.833 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 71.0 m95 -86.43 141.51 29.09 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.921 0.391 . . . . 0.0 110.264 178.638 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -136.52 150.16 48.51 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 176.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -106.49 145.5 31.73 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 177.034 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -145.26 -175.13 4.58 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 120.998 0.427 . . . . 0.0 109.997 176.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.428 ' HE3' HG23 ' A' ' 19' ' ' THR . 3.5 mttt -139.21 152.99 47.8 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.873 -178.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.502 ' OD1' ' HB2' ' A' ' 18' ' ' ARG . 1.0 OUTLIER -91.49 19.93 5.76 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.289 0.566 . . . . 0.0 110.398 178.936 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.401 ' HB3' ' O ' ' A' ' 14' ' ' ASP . . . 78.46 -27.96 0.16 Allowed 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 114.626 -1.17 . . . . 0.0 111.599 -179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.54 42.06 1.14 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.824 0.821 . . . . 0.0 111.394 -176.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.93 -31.53 3.07 Favored Glycine 0 C--N 1.32 -0.351 0 CA-C-N 114.596 -1.184 . . . . 0.0 113.511 175.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.502 ' HB2' ' OD1' ' A' ' 14' ' ' ASP . 0.1 OUTLIER -62.94 122.76 16.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.111 0.482 . . . . 0.0 111.135 -174.591 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.428 HG23 ' HE3' ' A' ' 13' ' ' LYS . 25.5 m -103.83 116.85 33.05 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.41 -178.037 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 26.8 p90 -120.32 154.56 34.84 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.946 0.403 . . . . 0.0 109.929 178.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.817 ' HD2' HD21 ' A' ' 5' ' ' LEU . 79.7 m-85 -105.95 121.17 43.56 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 121.406 0.622 . . . . 0.0 110.34 -176.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 p -115.2 110.97 33.87 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 CA-C-O 121.787 0.803 . . . . 0.0 110.126 -176.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 30.7 t-20 -89.88 122.48 32.97 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.319 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.0 m-70 -89.99 -25.87 20.64 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.042 -175.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -75.46 -32.48 60.65 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.759 -177.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -110.81 -0.54 16.92 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.839 -0.619 . . . . 0.0 110.751 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER 58.06 45.9 17.11 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.436 178.043 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -113.09 144.82 41.97 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.612 -176.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.64 100.84 7.69 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 173.847 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.413 ' HB ' ' HZ3' ' A' ' 9' ' ' TRP . 1.1 m -115.99 127.19 54.74 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.44 -168.111 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 68.2 m95 -95.08 59.56 2.28 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.565 0.698 . . . . 0.0 109.118 175.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -167.61 145.33 4.55 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.9 -172.192 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.414 ' HA ' ' HD2' ' A' ' 34' ' ' PRO . 0.1 OUTLIER -69.31 117.55 53.48 Favored Pre-proline 0 C--N 1.324 -0.51 0 CA-C-O 120.966 0.412 . . . . 0.0 110.596 178.211 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.414 ' HD2' ' HA ' ' A' ' 33' ' ' ARG . 24.9 Cg_endo -62.33 134.62 49.48 Favored 'Trans proline' 0 C--O 1.237 0.433 0 C-N-CA 123.153 2.569 . . . . 0.0 113.112 -177.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -103.1 -12.82 8.83 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.469 0 CA-C-O 121.67 0.748 . . . . 0.0 110.151 178.005 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.311 -1.069 0 CA-C-N 114.005 -1.452 . . . . 0.0 109.207 179.244 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.723 0 N-CA-C 112.073 -0.411 . . . . 0.0 112.073 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -62.17 -49.16 85.91 Favored Pre-proline 0 CA--C 1.538 0.491 0 N-CA-C 111.432 0.16 . . . . 0.0 111.432 178.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -76.95 -135.03 0.02 OUTLIER 'Trans proline' 0 C--N 1.357 0.977 0 C-N-CA 122.273 1.982 . . . . 0.0 111.397 174.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -70.0 -63.52 3.27 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.686 -0.768 . . . . 0.0 111.634 176.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.605 HD11 ' HD1' ' A' ' 21' ' ' TYR . 18.0 mt -127.03 155.8 75.32 Favored Pre-proline 0 C--N 1.326 -0.438 0 N-CA-C 110.486 -0.191 . . . . 0.0 110.486 177.206 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.793 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 77.9 Cg_exo -56.63 152.78 39.34 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.809 2.34 . . . . 0.0 111.105 170.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.6 92.35 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.471 0.653 . . . . 0.0 110.308 177.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.456 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 141.25 -16.49 2.73 Favored Glycine 0 N--CA 1.443 -0.876 0 CA-C-N 115.683 -0.689 . . . . 0.0 112.359 -176.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.793 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 91.6 m95 -97.86 137.94 35.96 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 109.236 -0.654 . . . . 0.0 109.236 177.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.435 ' HB3' HG13 ' A' ' 22' ' ' VAL . 23.8 tt0 -126.89 127.97 45.75 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 -179.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -91.29 110.31 21.6 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.763 0.792 . . . . 0.0 110.408 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.616 ' O ' ' HA ' ' A' ' 19' ' ' THR . 1.8 mtt180 -100.73 168.2 9.83 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.009 -0.996 . . . . 0.0 109.431 -178.158 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.709 ' HB3' ' HA2' ' A' ' 17' ' ' GLY . 0.0 OUTLIER -128.09 98.16 5.02 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.047 0.451 . . . . 0.0 110.046 -177.505 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.463 ' HB2' ' CE1' ' A' ' 20' ' ' TYR . 23.7 t70 -80.67 134.05 35.81 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.619 -174.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 62.72 -99.97 0.09 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.088 173.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.68 -6.81 59.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.968 0.413 . . . . 0.0 111.074 -176.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.709 ' HA2' ' HB3' ' A' ' 13' ' ' LYS . . . 118.71 25.47 2.83 Favored Glycine 0 N--CA 1.446 -0.658 0 C-N-CA 120.533 -0.841 . . . . 0.0 111.902 -177.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.412 ' HB3' ' HZ3' ' A' ' 31' ' ' TRP . 11.9 mtm180 -72.21 112.64 8.47 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 176.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.616 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 2.7 m -76.19 124.66 27.81 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.137 0.494 . . . . 0.0 112.249 -174.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.463 ' CE1' ' HB2' ' A' ' 14' ' ' ASP . 43.5 p90 -132.59 158.84 41.18 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.266 173.482 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.605 ' HD1' HD11 ' A' ' 5' ' ' LEU . 36.4 m-85 -108.58 121.31 44.72 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.265 0.555 . . . . 0.0 111.316 -174.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.57 ' CG1' ' HG3' ' A' ' 12' ' ' ARG . 2.5 p -116.34 109.32 27.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 CA-C-N 115.246 -0.888 . . . . 0.0 110.026 -178.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.456 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 17.7 t-20 -79.13 131.33 36.19 Favored 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 109.083 -0.71 . . . . 0.0 109.083 177.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 62.5 m-70 -94.24 -7.97 40.52 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 -170.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -91.24 -54.87 3.75 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.35 0.595 . . . . 0.0 109.716 177.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 32.2 t-20 -89.53 -6.12 56.66 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.457 -179.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.448 ' HD2' ' HA ' ' A' ' 27' ' ' ARG . 0.5 OUTLIER 58.77 32.25 22.02 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.495 178.074 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.72 124.35 32.89 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.16 0.505 . . . . 0.0 110.818 178.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.3 98.44 7.98 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 115.66 -0.7 . . . . 0.0 109.77 178.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.6 t -117.55 143.75 45.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.278 0.561 . . . . 0.0 111.743 -172.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.412 ' HZ3' ' HB3' ' A' ' 18' ' ' ARG . 80.6 m95 -101.48 42.24 1.14 Allowed 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 172.72 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -140.57 151.07 44.42 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 114.736 -1.12 . . . . 0.0 109.283 -174.132 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.509 ' HA ' ' HD2' ' A' ' 33' ' ' ARG . 1.1 mmm180 -75.77 117.43 63.6 Favored Pre-proline 0 C--N 1.322 -0.616 0 N-CA-C 109.978 -0.379 . . . . 0.0 109.978 177.065 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -54.12 122.26 11.12 Favored 'Trans proline' 0 C--O 1.235 0.326 0 C-N-CA 123.086 2.524 . . . . 0.0 111.956 -178.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -88.77 41.01 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 CA-C-O 121.737 0.779 . . . . 0.0 110.876 -176.007 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.308 -1.197 0 CA-C-N 114.429 -1.259 . . . . 0.0 108.806 -178.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.584 0 N-CA-C 111.859 -0.496 . . . . 0.0 111.859 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.488 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.1 OUTLIER -80.24 124.57 82.55 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-O 120.754 0.311 . . . . 0.0 110.787 -178.94 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.488 ' HD3' ' HA ' ' A' ' 2' ' ' SER . 0.9 OUTLIER -83.0 -141.34 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.811 0 C-N-CA 122.943 2.429 . . . . 0.0 112.272 -179.774 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.401 ' H ' ' HB2' ' A' ' 3' ' ' PRO . . . 117.15 -31.54 5.8 Favored Glycine 0 N--CA 1.449 -0.451 0 N-CA-C 111.462 -0.655 . . . . 0.0 111.462 -177.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.71 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 19.9 mt -84.26 152.69 61.79 Favored Pre-proline 0 C--N 1.324 -0.514 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 176.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.878 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 79.8 Cg_exo -54.66 160.47 7.25 Favored 'Trans proline' 0 C--O 1.237 0.437 0 C-N-CA 122.827 2.352 . . . . 0.0 111.736 173.725 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.55 88.54 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.746 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 137.3 -8.93 3.79 Favored Glycine 0 N--CA 1.442 -0.907 0 C-N-CA 120.33 -0.938 . . . . 0.0 113.304 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.878 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 88.0 m95 -95.63 140.58 30.24 Favored 'General case' 0 N--CA 1.451 -0.399 0 CA-C-N 117.869 0.834 . . . . 0.0 109.936 -179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -131.65 140.58 49.4 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -179.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -93.24 138.03 32.01 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.026 0.441 . . . . 0.0 110.96 -177.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.422 ' HG3' HG11 ' A' ' 22' ' ' VAL . 3.8 mtt180 -132.26 175.83 8.92 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.224 174.145 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 7.7 mptt -130.09 160.89 32.37 Favored 'General case' 0 C--N 1.314 -0.952 0 CA-C-O 121.188 0.518 . . . . 0.0 111.128 -175.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.7 p-10 -91.22 8.28 36.61 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.683 178.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 72.53 7.78 5.62 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.937 178.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 3.1 mttp -116.82 -32.89 4.97 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.124 0.488 . . . . 0.0 110.128 175.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 145.19 8.34 0.36 Allowed Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.009 177.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.03 126.78 44.82 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.9 0.35 . . . . 0.0 110.212 177.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -102.86 120.91 41.44 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.384 -176.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 29.8 p90 -115.89 164.48 14.35 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.462 -0.57 . . . . 0.0 109.462 175.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -110.3 126.26 54.01 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.062 0.458 . . . . 0.0 111.063 -175.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.422 HG11 ' HG3' ' A' ' 12' ' ' ARG . 2.6 p -118.93 115.16 47.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.743 0 CA-C-O 121.647 0.736 . . . . 0.0 110.263 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 41.1 t-20 -91.3 107.98 19.57 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.33 -0.85 . . . . 0.0 108.981 178.143 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -78.64 -5.4 52.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.762 0.315 . . . . 0.0 111.306 -173.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 -100.26 -29.41 12.46 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.868 0.366 . . . . 0.0 110.536 -177.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -107.69 -3.9 18.72 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.773 178.741 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 27' ' ' ARG . 0.0 OUTLIER 57.7 54.19 6.51 Favored 'General case' 0 C--O 1.233 0.237 0 CA-C-N 115.666 -0.697 . . . . 0.0 111.197 -179.357 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.22 130.22 49.25 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.984 179.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.405 HG23 ' HB ' ' A' ' 22' ' ' VAL . 0.0 OUTLIER -117.9 101.0 7.94 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 176.638 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 10.7 t -116.09 148.4 40.29 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.221 0.534 . . . . 0.0 111.848 -173.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.3 m95 -99.52 14.88 28.37 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.374 -0.83 . . . . 0.0 108.782 172.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -105.66 153.62 21.57 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 114.868 -1.06 . . . . 0.0 109.796 -179.664 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.401 HH11 ' HD2' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -85.9 116.73 66.85 Favored Pre-proline 0 C--N 1.323 -0.573 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 178.043 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -69.7 87.61 0.54 Allowed 'Trans proline' 0 N--CA 1.462 -0.371 0 C-N-CA 122.844 2.362 . . . . 0.0 112.274 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -83.77 6.93 1.72 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-O 121.982 0.896 . . . . 0.0 109.944 177.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 2.3 ttm . . . . . 0 C--N 1.311 -1.069 0 CA-C-N 113.969 -1.469 . . . . 0.0 108.848 178.164 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.798 0 N-CA-C 112.037 -0.425 . . . . 0.0 112.037 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.1 m 58.02 71.94 0.96 Allowed Pre-proline 0 N--CA 1.466 0.33 0 C-N-CA 122.874 0.47 . . . . 0.0 111.187 -178.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -64.17 -39.67 29.79 Favored 'Trans proline' 0 C--N 1.345 0.379 0 C-N-CA 122.877 2.385 . . . . 0.0 112.341 -178.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.13 111.45 1.7 Allowed Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 111.07 -0.812 . . . . 0.0 111.07 -177.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.755 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 30.1 mt -132.54 164.8 40.97 Favored Pre-proline 0 C--N 1.323 -0.586 0 O-C-N 122.881 -0.187 . . . . 0.0 111.294 -174.166 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.768 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 81.2 Cg_exo -59.78 35.7 0.05 OUTLIER 'Trans proline' 0 N--CA 1.486 1.088 0 C-N-CA 124.444 3.429 . . . . 0.0 115.417 175.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.412 ' H ' ' C ' ' A' ' 5' ' ' LEU . 70.8 m 68.14 -54.27 0.52 Allowed 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 123.629 0.771 . . . . 0.0 112.54 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -80.06 -2.16 88.51 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 121.099 -0.572 . . . . 0.0 112.374 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.768 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 83.5 m95 -102.29 138.42 39.25 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 178.648 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -129.52 139.08 51.65 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.898 -179.051 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -87.67 137.79 32.03 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.888 0.375 . . . . 0.0 110.092 178.219 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.426 HH11 ' HD2' ' A' ' 12' ' ' ARG . 1.4 mtp85 -135.87 -177.21 4.59 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.302 176.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.64 142.63 51.3 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.679 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.07 -172.71 2.9 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.688 -178.431 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -59.24 -36.17 75.0 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.493 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 19.5 mttm -73.91 -54.39 8.05 Favored 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 109.62 -0.511 . . . . 0.0 109.62 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 134.13 20.81 0.81 Allowed Glycine 0 N--CA 1.444 -0.767 0 C-N-CA 120.661 -0.781 . . . . 0.0 112.366 178.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.41 ' HB3' ' HZ3' ' A' ' 31' ' ' TRP . 0.1 OUTLIER -83.94 147.47 27.46 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 110.34 -0.245 . . . . 0.0 110.34 -179.995 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -82.29 105.41 13.34 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 120.818 0.342 . . . . 0.0 111.022 178.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 42.0 p90 -109.24 152.96 24.5 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 172.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.717 ' HD1' HD11 ' A' ' 5' ' ' LEU . 56.6 m-85 -107.56 123.69 48.82 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.289 0.566 . . . . 0.0 110.478 -174.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.4 p -117.02 114.91 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.612 -177.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.413 ' HB2' ' CD2' ' A' ' 9' ' ' TRP . 26.5 t-20 -82.43 122.24 27.77 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 114.982 -1.008 . . . . 0.0 108.334 174.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 54.1 m-70 -83.96 -42.95 15.72 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -168.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -70.28 -42.12 72.49 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.785 0.326 . . . . 0.0 110.996 -176.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -87.77 -10.76 50.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.568 -179.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER 56.62 54.75 7.04 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.996 -179.048 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -116.46 134.19 55.15 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.496 179.856 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.63 111.57 17.81 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.424 -179.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.415 HG22 ' CZ3' ' A' ' 9' ' ' TRP . 6.5 t -127.27 153.33 46.27 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.568 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.41 ' HZ3' ' HB3' ' A' ' 18' ' ' ARG . 44.9 m95 -104.33 14.96 29.25 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.359 0.599 . . . . 0.0 109.611 178.227 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -117.89 165.15 14.03 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.237 178.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 12.6 mtp85 -86.83 113.56 53.81 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-O 120.734 0.302 . . . . 0.0 110.798 179.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.408 ' HG3' ' CD2' ' A' ' 9' ' ' TRP . 58.1 Cg_endo -73.35 136.12 23.57 Favored 'Trans proline' 0 N--CA 1.464 -0.238 0 C-N-CA 122.807 2.338 . . . . 0.0 112.419 178.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -116.4 8.71 7.29 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.579 0.704 . . . . 0.0 110.712 -179.046 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.077 0 CA-C-N 114.557 -1.201 . . . . 0.0 109.651 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.817 0 N-CA-C 111.851 -0.5 . . . . 0.0 111.851 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -105.13 105.04 50.22 Favored Pre-proline 0 C--N 1.323 -0.551 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 176.426 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -71.88 -175.33 1.62 Allowed 'Trans proline' 0 C--O 1.235 0.344 0 C-N-CA 122.818 2.345 . . . . 0.0 112.131 -178.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -78.53 54.41 4.04 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.881 -0.676 . . . . 0.0 111.68 177.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.733 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 19.8 mt -133.1 152.95 80.56 Favored Pre-proline 0 N--CA 1.447 -0.609 0 N-CA-C 109.989 -0.374 . . . . 0.0 109.989 -176.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.882 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 87.3 Cg_exo -53.58 150.9 26.26 Favored 'Trans proline' 0 C--O 1.235 0.356 0 C-N-CA 122.733 2.289 . . . . 0.0 111.104 171.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 m -59.97 93.89 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.156 0.503 . . . . 0.0 110.847 -179.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.409 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 139.67 -18.83 2.99 Favored Glycine 0 N--CA 1.44 -1.056 0 C-N-CA 120.917 -0.658 . . . . 0.0 112.307 -177.045 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.882 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 93.9 m95 -93.26 139.16 30.93 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 179.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -128.51 130.83 48.05 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.72 179.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.12 126.22 32.89 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 178.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.406 ' O ' ' HA ' ' A' ' 19' ' ' THR . 59.7 mtp85 -138.57 173.79 11.22 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.389 -178.788 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -136.03 116.11 13.35 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.408 -174.415 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.48 ' HB2' ' CE1' ' A' ' 20' ' ' TYR . 6.5 t0 -99.65 152.46 20.04 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.496 -177.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 60.02 -100.0 0.1 Allowed 'General case' 0 N--CA 1.463 0.22 0 O-C-N 123.619 0.575 . . . . 0.0 112.072 176.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.55 53.17 0.94 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 121.0 0.428 . . . . 0.0 110.823 -175.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.404 ' HA2' ' HB2' ' A' ' 13' ' ' LYS . . . 82.64 23.0 57.27 Favored Glycine 0 N--CA 1.446 -0.638 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.863 175.349 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.49 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 18.6 mmm-85 -76.73 110.86 11.67 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 178.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.406 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 1.4 m -81.44 124.61 29.58 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.562 -173.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.48 ' CE1' ' HB2' ' A' ' 14' ' ' ASP . 34.2 p90 -137.0 167.2 21.96 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.316 -0.856 . . . . 0.0 109.181 175.227 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.442 ' HD1' HD11 ' A' ' 5' ' ' LEU . 52.6 m-85 -113.6 121.0 42.86 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-O 121.26 0.552 . . . . 0.0 110.097 -179.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.4 p -111.83 117.56 55.45 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.263 -177.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.409 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 24.9 t-20 -90.99 126.43 36.08 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.504 -178.932 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 93.9 m-70 -94.92 -8.76 36.16 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -173.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.4 m-20 -83.53 -54.34 5.02 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 175.876 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 27.6 t30 -91.65 -8.63 46.62 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.065 -176.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.3 mtt85 58.38 59.48 2.98 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.34 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -128.01 142.55 51.2 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.272 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -105.59 100.93 10.49 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.884 177.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.706 HG23 ' H ' ' A' ' 32' ' ' THR . 0.5 OUTLIER -111.78 138.78 47.9 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.05 0.453 . . . . 0.0 111.029 -172.842 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 59.3 m95 -109.89 32.31 5.18 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.502 0.668 . . . . 0.0 109.737 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.706 ' H ' HG23 ' A' ' 30' ' ' THR . 1.3 t -137.47 163.94 29.9 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.039 -0.982 . . . . 0.0 109.418 -177.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.525 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 14.4 mmm180 -75.57 115.28 44.29 Favored Pre-proline 0 C--N 1.324 -0.538 0 CA-C-O 121.111 0.482 . . . . 0.0 110.831 179.129 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.525 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 6.7 Cg_exo -74.55 127.36 10.94 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 123.427 2.752 . . . . 0.0 112.821 -177.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.1 pt -106.38 10.43 9.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-O 121.759 0.79 . . . . 0.0 110.799 176.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.311 -1.094 0 CA-C-N 114.876 -1.056 . . . . 0.0 110.208 -179.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.714 0 N-CA-C 111.405 -0.678 . . . . 0.0 111.405 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -85.76 135.81 37.52 Favored Pre-proline 0 C--N 1.322 -0.621 0 N-CA-C 109.951 -0.388 . . . . 0.0 109.951 176.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 17.7 Cg_exo -68.16 75.29 0.71 Allowed 'Trans proline' 0 C--O 1.234 0.284 0 C-N-CA 123.189 2.592 . . . . 0.0 112.602 -178.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -107.39 45.08 1.35 Allowed Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.909 178.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.767 HD13 ' HB3' ' A' ' 9' ' ' TRP . 6.1 mt -107.33 172.94 3.39 Favored Pre-proline 0 C--N 1.327 -0.407 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 179.434 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.661 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 51.3 Cg_exo -60.05 164.05 13.01 Favored 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.627 2.218 . . . . 0.0 111.204 171.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -50.76 -37.45 42.21 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -175.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.426 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -102.37 5.86 52.52 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 120.635 -0.793 . . . . 0.0 114.166 -174.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.767 ' HB3' HD13 ' A' ' 5' ' ' LEU . 89.5 m95 -104.44 144.43 31.68 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 118.227 1.014 . . . . 0.0 109.964 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -137.31 129.05 28.74 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.199 -0.455 . . . . 0.0 109.962 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.14 116.65 24.47 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 175.637 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -123.72 -170.36 2.11 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.342 0.592 . . . . 0.0 110.892 -177.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -122.22 126.78 48.97 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.38 -178.052 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.496 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -58.76 -53.14 61.7 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.373 -177.853 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 170.99 -47.17 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.351 0 O-C-N 124.098 0.874 . . . . 0.0 109.038 -178.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -95.32 37.41 1.18 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.629 -177.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 81.1 -11.52 42.4 Favored Glycine 0 CA--C 1.517 0.205 0 CA-C-N 115.692 -0.685 . . . . 0.0 112.897 177.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.496 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 14.1 mtt180 -61.27 138.25 58.24 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.937 0.399 . . . . 0.0 111.145 -177.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -97.16 122.25 39.96 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.892 -177.389 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 18.5 p90 -133.39 153.25 51.76 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.642 -0.503 . . . . 0.0 109.642 175.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.556 ' CD1' HD11 ' A' ' 5' ' ' LEU . 50.7 m-85 -109.41 119.37 39.25 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 121.481 0.658 . . . . 0.0 110.391 -176.028 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.2 p -114.84 115.28 49.02 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.188 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.404 -177.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.426 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 28.4 t-20 -85.62 111.23 19.87 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.617 175.123 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 -81.28 -10.38 59.59 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.787 -170.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -89.75 -54.83 3.88 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.131 0.491 . . . . 0.0 110.092 -178.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 19.8 t30 -83.96 -4.45 58.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.545 179.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.4 mtm180 57.41 52.52 8.53 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.733 -0.667 . . . . 0.0 111.013 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.09 134.83 54.76 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-O 121.06 0.457 . . . . 0.0 111.304 -178.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -104.13 104.03 13.9 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.97 179.135 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.552 HG23 HG22 ' A' ' 32' ' ' THR . 0.9 OUTLIER -116.93 129.07 55.82 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.56 -173.626 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.3 m95 -100.31 39.89 1.31 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.356 0.598 . . . . 0.0 110.131 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.552 HG22 HG23 ' A' ' 30' ' ' THR . 0.6 OUTLIER -144.79 151.59 39.04 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.382 -0.826 . . . . 0.0 109.849 -176.88 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.54 ' HD3' ' OH ' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -69.14 114.09 21.13 Favored Pre-proline 0 C--N 1.32 -0.705 0 N-CA-C 109.777 -0.453 . . . . 0.0 109.777 175.178 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 11.4 Cg_exo -70.86 62.06 2.37 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 123.529 2.819 . . . . 0.0 113.593 -176.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 4.1 mm -104.37 62.85 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-N 115.317 -0.856 . . . . 0.0 109.766 178.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.313 -0.999 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.546 177.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.734 0 N-CA-C 111.978 -0.449 . . . . 0.0 111.978 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.83 118.5 45.93 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 120.735 0.303 . . . . 0.0 110.582 178.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -79.99 -14.37 12.33 Favored 'Trans proline' 0 N--CA 1.463 -0.309 0 C-N-CA 122.764 2.309 . . . . 0.0 112.896 -177.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 65.7 -140.02 39.93 Favored Glycine 0 N--CA 1.45 -0.421 0 N-CA-C 110.683 -0.967 . . . . 0.0 110.683 -173.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.869 HD21 ' HD2' ' A' ' 21' ' ' TYR . 3.6 mp -97.84 118.79 63.53 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 117.232 0.516 . . . . 0.0 111.095 174.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.799 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 89.1 Cg_exo -53.16 163.93 2.03 Favored 'Trans proline' 0 N--CA 1.474 0.343 0 C-N-CA 124.084 3.189 . . . . 0.0 113.05 176.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.05 120.07 10.14 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.353 -0.385 . . . . 0.0 109.967 175.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 108.51 -28.75 10.99 Favored Glycine 0 N--CA 1.45 -0.392 0 N-CA-C 111.449 -0.66 . . . . 0.0 111.449 -174.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.799 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 64.4 m95 -83.49 117.17 22.91 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 178.015 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -120.64 136.28 54.87 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 175.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.42 140.21 29.83 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.77 -0.456 . . . . 0.0 109.77 178.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.427 ' HD2' ' OH ' ' A' ' 20' ' ' TYR . 2.8 mtm180 -139.06 -168.38 2.42 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.243 0.544 . . . . 0.0 110.41 -178.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.3 OUTLIER -140.08 151.2 45.17 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.063 -179.862 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -78.84 -165.93 0.81 Allowed 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 110.313 -0.255 . . . . 0.0 110.313 179.301 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -66.61 -15.16 63.25 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 112.027 0.381 . . . . 0.0 112.027 -176.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -108.08 -44.05 4.26 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.762 0.315 . . . . 0.0 110.807 -178.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 140.35 23.11 0.29 Allowed Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.254 -0.974 . . . . 0.0 113.126 178.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.423 ' HB3' ' HZ3' ' A' ' 31' ' ' TRP . 12.7 mtm-85 -85.99 144.61 27.51 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 177.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -83.2 117.95 23.28 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -172.26 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.427 ' OH ' ' HD2' ' A' ' 12' ' ' ARG . 13.9 p90 -129.62 149.48 51.36 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.013 171.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.869 ' HD2' HD21 ' A' ' 5' ' ' LEU . 84.0 m-85 -110.21 128.15 55.34 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-O 120.998 0.427 . . . . 0.0 110.217 -176.712 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 p -117.11 110.1 30.09 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 121.879 0.847 . . . . 0.0 110.687 -177.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.497 ' HB2' ' CD2' ' A' ' 9' ' ' TRP . 43.2 t-20 -90.07 112.91 24.52 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.139 178.525 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -71.95 -29.25 64.08 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.642 -174.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -75.36 -57.34 3.95 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.892 0.377 . . . . 0.0 111.132 -174.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -85.82 -5.99 59.16 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.992 -0.549 . . . . 0.0 111.162 -177.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 1.4 ttm180 62.21 57.63 1.96 Allowed 'General case' 0 C--O 1.232 0.148 0 CA-C-O 121.241 0.544 . . . . 0.0 111.406 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.23 131.04 53.99 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.889 178.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.53 76.79 1.22 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 121.461 0.648 . . . . 0.0 109.677 179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.6 t -99.27 148.17 24.42 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.425 -0.807 . . . . 0.0 111.835 -170.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.423 ' HZ3' ' HB3' ' A' ' 18' ' ' ARG . 60.5 m95 -100.23 46.35 0.96 Allowed 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.575 0.702 . . . . 0.0 109.129 175.208 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -152.22 157.27 41.22 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.362 -177.196 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.448 ' HA ' ' HD2' ' A' ' 34' ' ' PRO . 0.2 OUTLIER -65.23 125.13 88.75 Favored Pre-proline 0 C--N 1.325 -0.462 0 CA-C-O 120.58 0.228 . . . . 0.0 111.001 178.923 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.448 ' HD2' ' HA ' ' A' ' 33' ' ' ARG . 9.7 Cg_endo -52.0 111.16 0.54 Allowed 'Trans proline' 0 CA--C 1.53 0.283 0 C-N-CA 123.711 2.941 . . . . 0.0 113.242 178.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -116.63 1.77 7.97 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 CA-C-O 121.765 0.793 . . . . 0.0 110.287 177.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.7 ttm . . . . . 0 C--O 1.251 1.16 0 CA-C-N 114.269 -1.332 . . . . 0.0 109.958 179.945 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.599 0 N-CA-C 111.733 -0.547 . . . . 0.0 111.733 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -49.99 90.54 Favored Pre-proline 0 CA--C 1.54 0.595 0 N-CA-C 112.257 0.465 . . . . 0.0 112.257 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -74.39 62.55 5.32 Favored 'Trans proline' 0 C--N 1.357 0.991 0 C-N-CA 122.3 2.0 . . . . 0.0 112.096 176.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 167.79 97.8 0.12 Allowed Glycine 0 N--CA 1.448 -0.56 0 N-CA-C 110.908 -0.877 . . . . 0.0 110.908 179.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.745 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 67.3 mt -59.02 138.26 87.75 Favored Pre-proline 0 C--N 1.324 -0.522 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -170.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.803 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 81.2 Cg_exo -55.68 167.67 2.03 Favored 'Trans proline' 0 C--O 1.236 0.4 0 C-N-CA 124.249 3.299 . . . . 0.0 112.855 172.76 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -63.66 95.71 0.11 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.62 178.008 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.407 ' HA3' ' HB2' ' A' ' 25' ' ' ASN . . . 134.42 -22.97 3.67 Favored Glycine 0 N--CA 1.443 -0.842 0 C-N-CA 120.57 -0.824 . . . . 0.0 112.614 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.803 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 88.2 m95 -86.08 129.83 34.72 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 -177.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.471 ' HB3' HG13 ' A' ' 22' ' ' VAL . 38.0 tt0 -122.75 130.41 52.9 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.434 -177.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -87.29 119.63 27.75 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.941 0.401 . . . . 0.0 110.064 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.467 ' HD2' HG11 ' A' ' 22' ' ' VAL . 44.3 mtt180 -126.04 -179.35 4.66 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.099 -0.5 . . . . 0.0 109.991 179.596 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.8 mtmp? -140.7 150.69 43.78 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.772 -179.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -93.05 -175.49 3.88 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.006 176.349 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.71 -26.13 68.52 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -177.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.7 mtmp? -87.69 -8.81 55.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.084 0.469 . . . . 0.0 110.432 178.566 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 90.35 20.95 39.66 Favored Glycine 0 N--CA 1.448 -0.53 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.811 175.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -81.39 123.27 28.42 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.832 0.316 . . . . 0.0 110.242 177.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -72.75 123.54 23.52 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.409 179.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.481 ' HB3' ' CE3' ' A' ' 31' ' ' TRP . 37.2 p90 -129.89 155.05 46.67 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 174.23 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.57 ' HD1' HD11 ' A' ' 5' ' ' LEU . 25.6 m-85 -105.93 117.74 34.8 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.38 -176.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.471 HG13 ' HB3' ' A' ' 10' ' ' GLU . 2.3 p -109.94 107.07 21.98 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.9 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.203 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.467 ' HB2' ' CD2' ' A' ' 9' ' ' TRP . 55.8 t-20 -84.89 112.56 20.67 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.756 178.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.4 m-70 -83.91 -16.49 44.08 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.213 0.53 . . . . 0.0 109.911 -178.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.407 ' HB2' ' HA3' ' A' ' 8' ' ' GLY . 7.6 t-20 -73.57 -54.2 8.75 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.382 178.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.456 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 4.4 t30 -107.44 28.16 8.39 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.16 -177.609 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 26' ' ' ASN . 0.0 OUTLIER 37.41 51.7 1.19 Allowed 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.151 0.981 . . . . 0.0 113.047 178.227 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.64 132.34 54.61 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.017 0.437 . . . . 0.0 111.219 -176.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -119.6 104.4 10.25 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 178.544 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.544 ' OG1' HG22 ' A' ' 32' ' ' THR . 3.9 t -126.11 148.01 49.47 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.084 0.469 . . . . 0.0 111.252 -174.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.481 ' CE3' ' HB3' ' A' ' 20' ' ' TYR . 33.9 m95 -99.87 -5.58 28.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.911 -0.586 . . . . 0.0 109.637 177.161 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.544 HG22 ' OG1' ' A' ' 30' ' ' THR . 2.4 t -95.5 165.81 12.17 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.711 177.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.64 130.21 87.52 Favored Pre-proline 0 C--N 1.323 -0.567 0 N-CA-C 110.191 -0.3 . . . . 0.0 110.191 177.333 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -51.01 149.45 15.04 Favored 'Trans proline' 0 C--O 1.236 0.384 0 C-N-CA 123.128 2.552 . . . . 0.0 112.648 177.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 5.4 mm -82.13 71.95 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.685 0.755 . . . . 0.0 110.559 -176.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.309 -1.154 0 CA-C-N 115.021 -0.99 . . . . 0.0 109.531 176.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.74 0 N-CA-C 111.984 -0.446 . . . . 0.0 111.984 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.73 105.64 28.14 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 178.562 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -84.2 54.21 4.21 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 122.807 2.338 . . . . 0.0 112.506 -177.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 89.32 -21.94 25.99 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.92 -0.657 . . . . 0.0 112.153 -178.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.673 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 22.7 mt -118.46 151.26 49.39 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 177.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.893 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 72.2 Cg_exo -55.83 155.56 22.19 Favored 'Trans proline' 0 C--O 1.236 0.391 0 C-N-CA 122.526 2.151 . . . . 0.0 111.141 171.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.82 99.72 0.17 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.959 0.409 . . . . 0.0 110.16 -179.47 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.42 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 132.97 -19.01 4.44 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.804 -0.712 . . . . 0.0 112.472 -177.42 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.893 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 90.9 m95 -91.51 135.84 33.56 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 -179.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -126.95 132.23 50.89 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.952 -0.567 . . . . 0.0 109.756 -177.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.427 ' HG2' HD12 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -90.14 114.62 26.61 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.167 0.508 . . . . 0.0 110.365 179.981 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.661 ' HD2' HG11 ' A' ' 22' ' ' VAL . 48.6 mtt180 -109.31 -178.85 3.67 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.647 178.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -136.55 144.02 43.98 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.433 -179.348 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.416 ' CG ' ' H ' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -96.96 171.46 8.48 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.663 -0.698 . . . . 0.0 109.45 176.653 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.11 -26.28 68.2 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -176.434 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.416 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 22.9 mmmt -84.66 -4.34 58.96 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.851 0.358 . . . . 0.0 110.686 -179.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.23 12.66 55.96 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.983 -0.627 . . . . 0.0 112.346 177.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.401 ' HB3' ' HZ3' ' A' ' 31' ' ' TRP . 4.0 mmp_? -81.0 144.83 31.51 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 179.216 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.7 m -98.9 120.5 39.44 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.438 178.696 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 39.0 p90 -124.58 148.31 47.92 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 176.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.602 ' HD1' HD11 ' A' ' 5' ' ' LEU . 58.0 m-85 -105.33 122.08 45.21 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.633 0.73 . . . . 0.0 110.683 -174.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.661 HG11 ' HD2' ' A' ' 12' ' ' ARG . 2.5 p -115.92 113.86 44.5 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.976 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.099 -177.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.42 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 37.7 t-20 -89.48 117.35 28.33 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.147 178.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 78.9 m-70 -83.93 -20.79 32.35 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.362 -174.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -84.67 -41.78 15.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.081 0.467 . . . . 0.0 110.434 -179.037 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.0 t30 -95.75 -1.21 50.29 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.96 -178.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 56.21 40.77 29.93 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.906 -0.588 . . . . 0.0 111.701 177.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.67 141.82 47.7 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.858 0.361 . . . . 0.0 111.352 -176.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.42 109.75 14.26 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.255 178.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 2.6 t -127.62 151.46 48.9 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.017 0.437 . . . . 0.0 110.987 -177.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.401 ' HZ3' ' HB3' ' A' ' 18' ' ' ARG . 47.2 m95 -103.19 12.93 35.08 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -109.24 158.76 17.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.576 -178.127 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.438 HH11 ' HD3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -85.21 116.69 66.54 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-O 120.769 0.318 . . . . 0.0 111.161 178.209 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -82.5 132.27 6.75 Favored 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 122.639 2.226 . . . . 0.0 111.55 175.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -117.37 15.35 7.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 121.79 0.805 . . . . 0.0 110.551 -177.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.308 -1.211 0 CA-C-N 114.462 -1.245 . . . . 0.0 109.296 178.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.652 0 N-CA-C 111.865 -0.494 . . . . 0.0 111.865 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.1 m -115.45 91.7 29.89 Favored Pre-proline 0 C--N 1.323 -0.558 0 CA-C-O 121.027 0.441 . . . . 0.0 110.53 179.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -68.95 104.66 1.22 Allowed 'Trans proline' 0 C--O 1.235 0.343 0 C-N-CA 122.857 2.371 . . . . 0.0 112.104 -177.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 71.89 26.47 72.58 Favored Glycine 0 N--CA 1.447 -0.609 0 CA-C-N 115.86 -0.609 . . . . 0.0 112.44 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.613 HD11 ' HD1' ' A' ' 21' ' ' TYR . 20.6 mt -138.65 155.13 73.6 Favored Pre-proline 0 N--CA 1.451 -0.405 0 CA-C-O 120.749 0.309 . . . . 0.0 111.102 -179.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.798 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 74.2 Cg_exo -56.8 162.65 8.4 Favored 'Trans proline' 0 C--O 1.233 0.261 0 C-N-CA 122.922 2.415 . . . . 0.0 111.274 169.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -58.95 -14.61 9.69 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.594 0.59 . . . . 0.0 112.594 -176.002 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -108.48 -1.98 32.94 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.424 -0.894 . . . . 0.0 113.406 -177.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.798 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 80.0 m95 -104.34 138.61 40.51 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-N 117.932 0.866 . . . . 0.0 110.676 -176.402 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 14.0 tt0 -121.48 133.94 55.05 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.839 -0.619 . . . . 0.0 109.43 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.06 120.15 32.42 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 121.159 0.504 . . . . 0.0 110.374 -179.139 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.568 ' HG3' HG11 ' A' ' 22' ' ' VAL . 0.8 OUTLIER -115.61 165.63 12.82 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.842 -0.617 . . . . 0.0 109.691 177.203 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -114.28 135.76 53.72 Favored 'General case' 0 C--N 1.311 -1.077 0 CA-C-N 115.917 -0.583 . . . . 0.0 109.861 -177.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.407 ' O ' ' HB2' ' A' ' 15' ' ' ALA . 0.0 OUTLIER -66.91 -57.71 6.41 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.104 -0.498 . . . . 0.0 109.952 178.9 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.407 ' HB2' ' O ' ' A' ' 14' ' ' ASP . . . 168.07 -48.64 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.296 0 O-C-N 123.958 0.786 . . . . 0.0 109.583 -178.432 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.59 45.9 1.0 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.686 0.755 . . . . 0.0 110.901 -175.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 82.26 -17.46 18.29 Favored Glycine 0 C--N 1.317 -0.5 0 CA-C-N 114.816 -1.084 . . . . 0.0 113.227 176.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -65.02 118.14 8.68 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.931 0.396 . . . . 0.0 110.664 -178.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -102.89 130.61 49.99 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.496 -179.521 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 37.6 p90 -124.13 161.73 25.04 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.129 0.49 . . . . 0.0 110.322 176.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.613 ' HD1' HD11 ' A' ' 5' ' ' LEU . 33.6 m-85 -108.47 117.52 34.38 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.43 -174.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.568 HG11 ' HG3' ' A' ' 12' ' ' ARG . 3.7 p -115.53 115.65 50.01 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 CA-C-O 121.822 0.82 . . . . 0.0 109.695 -179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 29.3 t-20 -90.22 108.45 19.76 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.771 -177.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -88.25 38.68 0.87 Allowed 'General case' 0 N--CA 1.466 0.349 0 CA-C-O 121.179 0.514 . . . . 0.0 111.042 -176.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.8 t30 -137.3 -47.76 0.58 Allowed 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.087 -0.709 . . . . 0.0 109.087 178.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -92.54 -8.35 44.68 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.115 174.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.93 56.8 2.75 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.678 177.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -127.61 155.35 44.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.168 0.509 . . . . 0.0 111.192 177.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.44 102.94 8.58 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.879 -1.055 . . . . 0.0 109.151 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.667 ' HB ' ' HZ3' ' A' ' 9' ' ' TRP . 0.9 OUTLIER -120.17 136.88 54.47 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.826 -0.625 . . . . 0.0 111.198 -169.519 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 58.0 m95 -101.99 -19.32 15.26 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.052 0.453 . . . . 0.0 110.238 178.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.467 HG22 HG23 ' A' ' 30' ' ' THR . 1.4 t -79.63 163.0 24.94 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.731 179.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.44 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 8.2 mpt_? -78.06 120.92 83.07 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 110.245 -0.28 . . . . 0.0 110.245 176.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 16.1 Cg_exo -67.01 126.47 15.25 Favored 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.769 2.313 . . . . 0.0 111.773 179.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 3.5 mm -84.69 68.16 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 121.8 0.81 . . . . 0.0 110.44 -178.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.466 ' HG2' ' HB3' ' A' ' 6' ' ' PRO . 0.7 OUTLIER . . . . . 0 C--N 1.31 -1.138 0 CA-C-N 114.92 -1.036 . . . . 0.0 109.291 178.267 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.703 0 N-CA-C 111.952 -0.459 . . . . 0.0 111.952 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.467 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.3 OUTLIER -69.44 133.28 89.15 Favored Pre-proline 0 C--N 1.328 -0.366 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 177.859 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 2' ' ' SER . 2.7 Cg_exo -75.65 62.93 6.48 Favored 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 123.13 2.553 . . . . 0.0 112.116 179.271 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -79.71 127.7 8.12 Favored Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 110.92 -0.872 . . . . 0.0 110.92 176.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.832 HD13 ' HB3' ' A' ' 9' ' ' TRP . 7.4 mt -63.98 148.16 95.45 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-O 120.816 0.341 . . . . 0.0 110.859 -176.537 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.878 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 50.9 Cg_exo -61.02 -161.47 0.03 OUTLIER 'Trans proline' 0 N--CA 1.474 0.33 0 C-N-CA 124.034 3.156 . . . . 0.0 114.016 -179.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.9 94.2 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 114.945 -1.025 . . . . 0.0 112.55 -174.703 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 77.66 18.43 77.47 Favored Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 121.003 -0.618 . . . . 0.0 113.727 173.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.878 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 74.6 m95 -82.63 129.19 34.9 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 176.549 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -132.38 136.76 47.03 Favored 'General case' 0 C--N 1.317 -0.822 0 C-N-CA 121.174 -0.21 . . . . 0.0 110.659 -179.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.405 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . 1.6 pt-20 -90.34 117.27 28.93 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.456 0.646 . . . . 0.0 109.602 174.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.493 ' O ' ' HA ' ' A' ' 19' ' ' THR . 0.0 OUTLIER -110.17 -174.84 2.58 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.543 -179.614 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.33 130.19 26.22 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.618 -178.16 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.693 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . 35.0 t70 -81.47 55.01 2.48 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.221 177.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 67.77 -58.19 0.44 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.845 0.858 . . . . 0.0 112.656 178.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.63 30.01 0.66 Allowed 'General case' 0 C--N 1.325 -0.466 0 C-N-CA 122.611 0.365 . . . . 0.0 111.708 -174.666 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 77.17 7.89 86.87 Favored Glycine 0 CA--C 1.518 0.243 0 C-N-CA 120.959 -0.639 . . . . 0.0 113.079 177.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.693 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 0.1 OUTLIER -74.06 99.06 3.23 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.668 0.271 . . . . 0.0 110.315 178.613 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.493 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 30.3 m -72.86 121.68 20.37 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.329 0.585 . . . . 0.0 112.168 -177.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.486 ' HB3' ' CE3' ' A' ' 31' ' ' TRP . 28.3 p90 -126.85 142.76 51.46 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.39 -0.823 . . . . 0.0 108.796 171.125 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.605 ' HD2' HD11 ' A' ' 5' ' ' LEU . 74.2 m-85 -98.39 120.59 39.08 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.695 0.76 . . . . 0.0 110.21 -176.659 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.3 p -111.98 117.0 54.1 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.842 0 CA-C-N 114.657 -1.156 . . . . 0.0 110.276 -177.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -89.04 120.03 30.09 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-N 115.472 -0.785 . . . . 0.0 108.963 177.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.6 m-70 -82.32 -22.24 35.69 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.78 -173.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -76.88 -47.82 20.1 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.251 -174.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -107.59 7.49 28.7 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.928 0.394 . . . . 0.0 110.726 178.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 54.03 45.2 28.08 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.399 178.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.88 135.0 35.66 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.305 178.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -123.77 108.7 12.8 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.629 -179.464 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 12.4 t -127.51 149.61 50.05 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-O 121.126 0.488 . . . . 0.0 110.701 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.486 ' CE3' ' HB3' ' A' ' 20' ' ' TYR . 49.1 m95 -102.77 21.51 15.36 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.569 0.7 . . . . 0.0 109.203 177.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -118.9 160.71 21.44 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 114.911 -1.041 . . . . 0.0 109.367 175.247 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.462 ' HG3' ' CE1' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -78.43 120.97 83.05 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-O 120.681 0.277 . . . . 0.0 110.288 179.101 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 36.8 Cg_endo -66.67 120.22 7.31 Favored 'Trans proline' 0 N--CA 1.461 -0.391 0 C-N-CA 122.65 2.233 . . . . 0.0 112.332 -178.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -106.1 33.06 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 122.063 0.935 . . . . 0.0 109.184 174.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.432 ' O ' ' HG2' ' A' ' 6' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.121 0 CA-C-N 113.703 -1.589 . . . . 0.0 108.1 -178.134 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.744 0 N-CA-C 111.375 -0.69 . . . . 0.0 111.375 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.455 ' CB ' ' HD3' ' A' ' 3' ' ' PRO . 0.1 OUTLIER -71.31 -52.44 8.96 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 174.116 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.455 ' HD3' ' CB ' ' A' ' 2' ' ' SER . 4.2 Cg_exo -78.71 161.26 27.7 Favored 'Trans proline' 0 C--N 1.354 0.82 0 C-N-CA 122.098 1.866 . . . . 0.0 110.731 169.256 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -112.53 168.1 12.56 Favored Glycine 0 N--CA 1.446 -0.649 0 C-N-CA 120.567 -0.825 . . . . 0.0 111.924 -178.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.73 HD11 ' HD1' ' A' ' 21' ' ' TYR . 17.9 mt -114.75 151.42 45.37 Favored Pre-proline 0 C--N 1.322 -0.621 0 CA-C-O 120.723 0.297 . . . . 0.0 110.856 179.71 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.788 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 83.6 Cg_exo -53.7 144.34 54.05 Favored 'Trans proline' 0 CA--C 1.52 -0.198 0 C-N-CA 122.901 2.401 . . . . 0.0 110.774 170.744 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.0 m -58.12 92.38 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 121.29 0.567 . . . . 0.0 110.214 178.148 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.47 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 145.75 -29.21 1.72 Allowed Glycine 0 N--CA 1.438 -1.204 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.515 -173.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.788 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 93.2 m95 -90.64 131.07 36.55 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 108.374 -0.973 . . . . 0.0 108.374 176.639 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 24.7 tt0 -124.04 117.44 24.73 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 110.1 -0.333 . . . . 0.0 110.1 -179.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -81.8 103.55 11.56 Favored 'General case' 0 N--CA 1.445 -0.675 0 CA-C-O 121.66 0.743 . . . . 0.0 110.098 176.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.567 ' HD2' HG11 ' A' ' 22' ' ' VAL . 9.2 mtt-85 -107.94 174.88 5.68 Favored 'General case' 0 C--N 1.312 -1.051 0 CA-C-N 114.638 -1.164 . . . . 0.0 109.105 -178.358 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -118.91 128.77 54.73 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 120.937 0.398 . . . . 0.0 110.467 -176.073 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -99.46 -2.97 34.66 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.609 0.719 . . . . 0.0 109.416 -179.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.628 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . . . -159.76 -156.41 0.5 Allowed 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.909 -1.041 . . . . 0.0 109.915 -179.18 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.57 32.58 0.65 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.239 0.543 . . . . 0.0 111.188 -174.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 149.63 -6.81 0.78 Allowed Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.23 -177.624 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.628 ' HB2' ' HB3' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -79.16 101.44 7.93 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 175.533 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.53 134.87 36.61 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.124 -176.904 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 28.1 p90 -134.36 155.92 49.42 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.412 176.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.73 ' HD1' HD11 ' A' ' 5' ' ' LEU . 24.8 m-85 -106.45 113.71 27.39 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 121.352 0.596 . . . . 0.0 110.622 -175.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.567 HG11 ' HD2' ' A' ' 12' ' ' ARG . 2.3 p -108.55 111.17 34.83 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.958 0 CA-C-N 115.285 -0.871 . . . . 0.0 110.208 -179.58 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.47 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 23.8 t-20 -82.21 121.77 27.06 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 178.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 59.8 m-70 -84.19 -17.86 38.54 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 -169.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.7 p30 -95.34 -37.69 10.85 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.269 -0.572 . . . . 0.0 110.874 -179.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 19.5 t30 -93.75 -2.81 53.23 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.537 -0.302 . . . . 0.0 110.625 178.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 26.4 mtm180 55.58 45.89 23.97 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.461 176.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.04 131.61 56.31 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.108 0.48 . . . . 0.0 111.22 -178.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -111.35 96.34 6.06 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.955 -178.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.494 HG22 ' HZ3' ' A' ' 9' ' ' TRP . 1.8 t -116.46 145.38 43.33 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 121.238 0.542 . . . . 0.0 111.434 -175.22 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 31.8 m95 -99.85 7.9 44.58 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 171.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -97.2 144.57 26.89 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.522 -177.626 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.454 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 8.9 mmm180 -67.99 119.54 67.75 Favored Pre-proline 0 C--N 1.326 -0.44 0 CA-C-O 120.74 0.305 . . . . 0.0 111.213 177.776 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 6.7 Cg_exo -72.82 66.83 3.95 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 123.428 2.752 . . . . 0.0 112.518 178.068 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 11.4 mt 72.66 -60.92 0.27 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.707 -179.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 4.6 ttm . . . . . 0 C--N 1.305 -1.351 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.668 -177.583 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.819 0 N-CA-C 111.595 -0.602 . . . . 0.0 111.595 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -58.57 -54.94 51.05 Favored Pre-proline 0 CA--C 1.537 0.474 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -177.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -65.25 -19.56 62.29 Favored 'Trans proline' 0 C--N 1.359 1.123 0 C-N-CA 121.72 1.613 . . . . 0.0 112.273 178.299 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 81.14 -64.19 4.19 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 115.852 -0.613 . . . . 0.0 112.201 -178.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.821 HD11 ' HD1' ' A' ' 21' ' ' TYR . 28.3 mt -140.48 173.83 4.58 Favored Pre-proline 0 C--N 1.323 -0.544 0 CA-C-O 119.544 -0.265 . . . . 0.0 110.364 -176.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.746 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 87.3 Cg_exo -58.41 42.16 0.05 OUTLIER 'Trans proline' 0 N--CA 1.489 1.229 0 C-N-CA 124.627 3.552 . . . . 0.0 115.749 176.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.8 m 66.43 -59.45 0.34 Allowed 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.993 0.917 . . . . 0.0 112.752 177.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -73.46 -19.59 79.7 Favored Glycine 0 N--CA 1.449 -0.468 0 C-N-CA 121.194 -0.527 . . . . 0.0 112.163 -179.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.8 ' HB3' HD13 ' A' ' 5' ' ' LEU . 93.6 m95 -87.58 137.81 32.02 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 179.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -128.23 122.4 31.7 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.926 179.012 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -82.66 117.9 22.94 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.135 0.493 . . . . 0.0 110.021 178.462 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.501 ' O ' ' HA ' ' A' ' 19' ' ' THR . 39.0 mtt180 -122.77 -176.47 3.4 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.887 -178.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -133.48 137.84 45.86 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.065 -179.024 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -77.85 -175.9 4.18 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.667 -179.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.07 -28.53 69.67 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.726 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 10.8 mmtt -82.28 -27.37 32.4 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.874 0.369 . . . . 0.0 110.665 177.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 113.14 13.5 10.81 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.686 -0.769 . . . . 0.0 113.136 176.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.493 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.3 OUTLIER -84.95 142.04 29.93 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.848 0.356 . . . . 0.0 110.492 179.258 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.501 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 0.7 OUTLIER -79.11 125.09 28.96 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.339 -178.909 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 46.3 p90 -127.75 161.3 29.28 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 172.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.821 ' HD1' HD11 ' A' ' 5' ' ' LEU . 50.6 m-85 -112.89 111.28 21.92 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-O 121.535 0.683 . . . . 0.0 110.712 -173.313 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.486 HG11 ' HD2' ' A' ' 12' ' ' ARG . 3.0 p -108.51 107.64 23.32 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.035 0 CA-C-N 115.107 -0.951 . . . . 0.0 110.455 -178.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.482 ' HB3' ' OG1' ' A' ' 28' ' ' THR . 54.3 t-20 -82.1 112.8 19.47 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.037 178.139 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 96.9 m-70 -82.15 -17.31 46.79 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.068 0.461 . . . . 0.0 110.368 -176.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -81.44 -41.13 22.29 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.582 -0.736 . . . . 0.0 110.279 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 57.7 m-20 -97.99 -3.25 38.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.042 -178.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 57.76 52.31 8.27 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.982 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.482 ' OG1' ' HB3' ' A' ' 23' ' ' ASN . 33.8 p -124.25 132.15 53.57 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.995 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.67 78.87 1.61 Allowed 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 173.333 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.573 ' HB ' ' HZ3' ' A' ' 9' ' ' TRP . 0.9 OUTLIER -91.72 128.98 37.76 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.449 -169.043 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 39.5 m95 -101.61 58.97 0.86 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.27 0.557 . . . . 0.0 109.72 177.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -167.26 146.88 5.25 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.327 -176.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.469 ' HD2' ' OH ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -67.18 114.61 19.38 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-O 120.64 0.257 . . . . 0.0 110.659 177.562 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -73.88 157.23 47.67 Favored 'Trans proline' 0 N--CA 1.463 -0.277 0 C-N-CA 122.853 2.368 . . . . 0.0 112.688 -177.195 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -96.81 -20.76 5.61 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.949 0.881 . . . . 0.0 109.538 176.094 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 3.7 tpt . . . . . 0 C--O 1.25 1.121 0 CA-C-N 113.505 -1.679 . . . . 0.0 109.157 179.139 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.656 0 N-CA-C 111.676 -0.57 . . . . 0.0 111.676 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -70.11 144.06 92.14 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 175.508 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -76.68 37.91 0.6 Allowed 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 122.846 2.364 . . . . 0.0 113.281 -176.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 79.05 -56.9 4.35 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 121.218 -0.515 . . . . 0.0 112.35 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.804 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 10.5 mt -140.53 156.87 69.19 Favored Pre-proline 0 C--N 1.325 -0.486 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 -179.856 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.872 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 75.8 Cg_exo -54.35 163.74 3.34 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.855 2.37 . . . . 0.0 112.29 174.421 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.64 94.73 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.361 -177.321 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.416 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 128.38 -17.61 5.86 Favored Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.729 -0.748 . . . . 0.0 113.208 178.168 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.872 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 96.5 m95 -87.55 134.47 33.62 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 117.794 0.797 . . . . 0.0 110.165 -177.063 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 10.7 tt0 -125.8 132.66 52.23 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.055 -0.52 . . . . 0.0 109.753 177.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.445 ' H ' ' HG3' ' A' ' 11' ' ' GLU . 0.0 OUTLIER -88.42 117.74 27.57 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.274 0.559 . . . . 0.0 110.893 -178.998 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.6 ttp85 -121.68 -177.95 3.69 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.523 0.678 . . . . 0.0 110.32 177.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.45 129.3 23.2 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.445 -177.103 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -81.7 176.01 9.99 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 120.788 -0.365 . . . . 0.0 110.467 179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -62.16 -19.89 63.55 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.902 0.382 . . . . 0.0 111.269 -178.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.5 mttp -71.89 -28.15 63.32 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.548 176.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 112.07 -23.29 16.83 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.846 -0.692 . . . . 0.0 112.454 -178.468 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.77 144.3 52.74 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.975 0.417 . . . . 0.0 111.929 -176.15 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -85.19 138.48 32.34 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.632 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 49.0 p90 -141.1 162.75 34.75 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 172.645 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.629 ' HD1' HD11 ' A' ' 5' ' ' LEU . 8.9 m-85 -111.93 120.24 41.25 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.134 0.492 . . . . 0.0 110.839 -174.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.448 ' HB ' HG23 ' A' ' 29' ' ' THR . 2.5 p -109.22 114.4 46.81 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.01 179.034 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.431 ' HB2' ' CE3' ' A' ' 9' ' ' TRP . 57.5 t-20 -88.74 113.67 24.55 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.92 -179.535 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 95.4 m-70 -80.72 -16.14 54.69 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.769 -176.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -85.88 -32.96 21.38 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.486 -179.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -104.13 -11.0 17.55 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.2 -178.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 65.1 37.47 6.66 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.0 -179.131 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.64 141.23 51.96 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 120.953 0.406 . . . . 0.0 111.382 -178.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.448 HG23 ' HB ' ' A' ' 22' ' ' VAL . 0.2 OUTLIER -114.93 93.47 4.33 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.856 178.471 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.6 146.48 25.25 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.289 0.566 . . . . 0.0 111.335 -173.418 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 55.9 m95 -106.93 8.4 30.54 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.778 -0.646 . . . . 0.0 109.834 177.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.7 t -110.28 161.52 15.53 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.353 -0.84 . . . . 0.0 109.81 179.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.48 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 0.0 OUTLIER -77.03 121.71 85.16 Favored Pre-proline 0 C--N 1.321 -0.64 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 176.447 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.48 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 17.6 Cg_exo -65.44 170.7 10.5 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.883 2.389 . . . . 0.0 112.44 -177.036 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -80.87 67.98 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 121.487 0.661 . . . . 0.0 110.869 -178.421 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 2.2 ttp . . . . . 0 C--O 1.248 0.998 0 CA-C-N 115.355 -0.839 . . . . 0.0 109.784 177.837 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.742 0 N-CA-C 111.77 -0.532 . . . . 0.0 111.77 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.449 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.2 OUTLIER -134.92 143.64 47.03 Favored Pre-proline 0 C--N 1.325 -0.466 0 CA-C-O 120.599 0.238 . . . . 0.0 110.724 -179.709 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 2' ' ' SER . 5.0 Cg_exo -78.29 -117.84 0.01 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.471 0 C-N-CA 123.194 2.596 . . . . 0.0 111.537 175.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.439 ' H ' ' HB2' ' A' ' 3' ' ' PRO . . . 72.33 84.87 0.22 Allowed Glycine 0 C--N 1.329 0.174 0 C-N-CA 120.987 -0.625 . . . . 0.0 112.526 177.444 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.863 HD11 ' HD1' ' A' ' 21' ' ' TYR . 27.8 mt -100.93 157.44 33.67 Favored Pre-proline 0 C--N 1.324 -0.513 0 CA-C-O 120.803 0.335 . . . . 0.0 111.583 -177.439 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.674 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 86.4 Cg_exo -54.95 167.15 1.72 Allowed 'Trans proline' 0 C--O 1.233 0.245 0 C-N-CA 123.426 2.751 . . . . 0.0 111.815 170.493 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.97 -8.28 15.15 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.837 0.351 . . . . 0.0 111.655 -177.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -113.94 -0.56 24.16 Favored Glycine 0 N--CA 1.445 -0.705 0 C-N-CA 120.614 -0.803 . . . . 0.0 113.615 -179.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.674 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 84.2 m95 -109.35 131.18 55.31 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 117.793 0.796 . . . . 0.0 110.001 -178.519 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -114.21 133.17 55.8 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.526 ' HG2' HD12 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -87.19 118.47 26.62 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 109.88 -0.415 . . . . 0.0 109.88 178.85 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 -114.28 175.54 5.43 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.144 0.497 . . . . 0.0 110.133 179.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.41 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -140.3 132.3 27.81 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.933 -178.269 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -87.09 27.88 0.98 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.055 -179.153 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . 73.01 -34.63 0.3 Allowed 'General case' 0 N--CA 1.47 0.575 0 C-N-CA 123.546 0.738 . . . . 0.0 112.635 176.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 9.5 mttt -90.02 35.27 0.85 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.062 0.458 . . . . 0.0 111.027 -178.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 72.8 5.49 64.7 Favored Glycine 0 C--N 1.328 0.102 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.119 178.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.41 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -83.56 101.76 11.68 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 -177.001 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 4.7 m -90.36 122.25 33.08 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.075 178.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 37.5 p90 -129.24 158.43 39.07 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.054 0.454 . . . . 0.0 109.999 178.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.863 ' HD1' HD11 ' A' ' 5' ' ' LEU . 46.2 m-85 -105.7 117.7 34.69 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.385 -174.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.7 p -110.98 114.77 48.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.847 0 CA-C-O 121.626 0.726 . . . . 0.0 110.092 -179.276 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -84.41 126.21 33.04 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.43 -179.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 30.4 m-70 -84.89 -12.53 53.26 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 -171.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -83.32 -59.17 2.55 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.141 0.496 . . . . 0.0 110.042 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -87.89 -15.62 36.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.872 -176.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 69.46 34.73 2.74 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.271 179.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.5 134.47 33.67 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.702 178.017 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -103.5 91.66 4.14 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 176.356 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.613 HG23 HG22 ' A' ' 32' ' ' THR . 0.9 OUTLIER -105.85 122.38 45.99 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.354 -168.038 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 67.2 m95 -97.36 40.03 1.17 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.551 -179.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.613 HG22 HG23 ' A' ' 30' ' ' THR . 6.6 t -156.89 172.14 19.18 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.461 -0.79 . . . . 0.0 108.884 -177.44 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.548 ' HA ' ' HD2' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -74.13 134.38 77.47 Favored Pre-proline 0 C--N 1.318 -0.77 0 C-N-CA 120.3 -0.56 . . . . 0.0 110.569 177.911 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -51.64 -177.47 0.02 OUTLIER 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 123.422 2.748 . . . . 0.0 112.948 174.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 7.1 mm 58.64 43.23 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.457 -0.094 0 CA-C-O 122.364 1.078 . . . . 0.0 109.517 -167.247 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 30.4 ttm . . . . . 0 C--O 1.25 1.089 0 CA-C-N 114.159 -1.382 . . . . 0.0 108.808 178.252 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.785 0 N-CA-C 112.223 -0.351 . . . . 0.0 112.223 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.42 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 24.4 m -112.87 109.73 52.43 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-O 120.868 0.366 . . . . 0.0 110.861 179.21 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 2' ' ' SER . 10.8 Cg_exo -71.82 127.39 12.95 Favored 'Trans proline' 0 C--O 1.236 0.379 0 C-N-CA 122.94 2.426 . . . . 0.0 111.83 177.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -139.56 -86.12 0.13 Allowed Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.181 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.87 HD13 ' HB3' ' A' ' 9' ' ' TRP . 14.8 mt -103.71 169.96 6.73 Favored Pre-proline 0 C--N 1.322 -0.605 0 CA-C-N 115.982 -0.109 . . . . 0.0 110.823 -178.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.771 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 75.6 Cg_exo -59.32 -167.14 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 123.363 2.709 . . . . 0.0 113.458 174.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.18 -49.44 75.95 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.233 -0.894 . . . . 0.0 112.713 -174.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.55 ' HA3' ' OD1' ' A' ' 25' ' ' ASN . . . -116.34 19.59 13.01 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 119.968 -1.11 . . . . 0.0 114.309 -172.529 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.87 ' HB3' HD13 ' A' ' 5' ' ' LEU . 92.5 m95 -100.28 140.25 34.8 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 117.819 0.809 . . . . 0.0 110.125 -179.09 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.523 ' OE1' ' HD2' ' A' ' 12' ' ' ARG . 21.4 tt0 -133.51 125.13 28.25 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 177.438 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -85.2 119.55 25.7 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 120.941 0.4 . . . . 0.0 110.322 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.523 ' HD2' ' OE1' ' A' ' 10' ' ' GLU . 0.3 OUTLIER -116.6 -166.5 1.16 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.956 178.98 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.504 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.4 OUTLIER -135.1 149.1 49.99 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.634 -174.511 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -78.48 -164.99 0.63 Allowed 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.261 177.17 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -61.46 -20.41 63.1 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.312 0.486 . . . . 0.0 112.312 -178.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.419 ' HD3' ' HA ' ' A' ' 16' ' ' LYS . 61.5 mmtt -107.47 -50.6 3.05 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.757 0.313 . . . . 0.0 111.217 -178.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 152.97 21.48 0.05 OUTLIER Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.592 -0.813 . . . . 0.0 113.071 -179.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.504 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -77.63 128.82 34.74 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.748 -0.464 . . . . 0.0 109.748 177.397 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.441 ' HA ' ' O ' ' A' ' 12' ' ' ARG . 0.2 OUTLIER -80.59 113.02 18.49 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.031 0.443 . . . . 0.0 111.753 -176.468 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.8 p90 -120.97 156.86 31.18 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 173.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.781 ' HD1' HD11 ' A' ' 5' ' ' LEU . 20.8 m-85 -106.4 122.18 45.75 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-O 121.23 0.538 . . . . 0.0 110.929 -172.723 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.415 HG11 ' HD3' ' A' ' 12' ' ' ARG . 2.5 p -119.16 111.16 32.2 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.787 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.229 179.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 31.8 t-20 -77.71 128.17 33.62 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 177.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 65.7 m-70 -95.19 -15.07 23.55 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -168.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.55 ' OD1' ' HA3' ' A' ' 8' ' ' GLY . 10.6 p-10 -103.52 -20.21 14.11 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 120.654 -0.418 . . . . 0.0 110.95 179.621 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 16.8 t-20 -105.71 -16.06 14.79 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.087 0.47 . . . . 0.0 110.198 175.205 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.12 50.0 2.55 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.426 177.626 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -112.65 128.35 56.36 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.991 178.609 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.17 103.51 12.72 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.731 176.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.553 HG23 ' H ' ' A' ' 32' ' ' THR . 1.4 t -125.12 147.92 48.79 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 121.422 0.63 . . . . 0.0 111.667 -174.181 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 57.1 m95 -106.63 39.99 1.72 Allowed 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 174.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.553 ' H ' HG23 ' A' ' 30' ' ' THR . 0.5 OUTLIER -136.32 154.67 50.79 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.47 -178.102 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.434 HH11 ' HD3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -75.88 112.39 19.81 Favored Pre-proline 0 C--N 1.325 -0.463 0 CA-C-O 120.743 0.306 . . . . 0.0 110.8 -179.187 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 31.6 Cg_exo -62.19 150.78 85.56 Favored 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 123.26 2.64 . . . . 0.0 112.607 -179.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -114.75 -4.45 11.31 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-O 121.478 0.656 . . . . 0.0 111.325 -178.396 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 1.8 ptt? . . . . . 0 C--N 1.311 -1.095 0 CA-C-N 115.028 -0.987 . . . . 0.0 109.55 -177.277 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.667 0 N-CA-C 112.515 -0.234 . . . . 0.0 112.515 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.29 -51.54 0.65 Allowed Pre-proline 0 CA--C 1.54 0.56 0 CA-C-O 119.89 -0.1 . . . . 0.0 111.26 177.784 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -69.44 116.29 4.46 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 121.882 1.721 . . . . 0.0 111.913 177.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -83.11 -137.48 2.99 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.265 -179.281 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.748 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 39.1 mt -124.57 167.98 14.36 Favored Pre-proline 0 C--N 1.32 -0.675 0 CA-C-O 120.607 0.242 . . . . 0.0 110.642 -176.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.729 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 75.6 Cg_exo -56.67 164.13 6.21 Favored 'Trans proline' 0 C--O 1.235 0.337 0 C-N-CA 122.452 2.101 . . . . 0.0 110.839 166.856 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -66.69 -8.8 30.3 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 120.94 0.4 . . . . 0.0 111.374 -177.13 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -99.87 -21.47 13.98 Favored Glycine 0 N--CA 1.446 -0.659 0 C-N-CA 121.013 -0.613 . . . . 0.0 113.231 177.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.748 ' HB2' ' HB3' ' A' ' 5' ' ' LEU . 74.3 m95 -96.35 143.67 27.2 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 117.442 0.621 . . . . 0.0 110.097 -173.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -136.38 131.66 34.51 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.111 178.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -83.24 125.51 31.65 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.127 0.489 . . . . 0.0 110.095 178.261 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 2.6 ttt180 -121.69 -166.15 1.34 Allowed 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.912 179.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.615 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 28.6 mtpt -135.85 149.22 48.96 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.186 -179.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.438 ' CG ' ' H ' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -95.06 177.17 5.97 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.426 175.55 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.42 -28.02 67.94 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.821 0.343 . . . . 0.0 111.778 -177.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.438 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 2.6 mtmp? -88.1 -9.48 53.13 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.238 -178.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 100.67 11.99 39.18 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.752 -0.737 . . . . 0.0 113.158 176.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.615 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -77.04 161.2 28.51 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 117.082 0.441 . . . . 0.0 110.302 178.606 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -108.53 116.85 32.75 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.952 -178.806 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.8 p90 -125.12 157.94 35.12 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 109.817 -0.438 . . . . 0.0 109.817 175.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.619 ' CD1' HD11 ' A' ' 5' ' ' LEU . 31.5 m-85 -106.29 118.8 37.58 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.397 0.618 . . . . 0.0 110.804 -175.332 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.1 p -108.83 110.94 33.91 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.962 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.089 179.362 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.421 ' HB2' ' CD2' ' A' ' 9' ' ' TRP . 23.2 t30 -84.31 121.47 27.56 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.116 -0.947 . . . . 0.0 109.457 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 97.4 m-70 -82.05 -21.49 36.89 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.45 -174.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.96 -57.92 3.7 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.482 -0.327 . . . . 0.0 111.415 -177.184 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -101.2 1.81 39.38 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.624 -0.262 . . . . 0.0 111.343 -177.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.1 29.21 17.53 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 123.577 0.548 . . . . 0.0 111.64 -179.031 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.6 129.71 34.99 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 120.967 0.413 . . . . 0.0 110.353 177.213 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -118.96 107.28 13.35 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.203 -178.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.632 HG22 ' HZ3' ' A' ' 9' ' ' TRP . 6.5 t -127.56 149.24 50.24 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.208 0.528 . . . . 0.0 111.697 -175.588 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.436 ' HZ3' ' HB3' ' A' ' 18' ' ' ARG . 16.4 m95 -97.92 7.95 45.52 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 172.507 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -103.92 150.79 23.86 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 114.26 -1.336 . . . . 0.0 110.352 -176.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.502 ' HA ' ' HD2' ' A' ' 33' ' ' ARG . 11.0 mmm180 -72.68 121.32 84.64 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-O 120.762 0.315 . . . . 0.0 110.91 177.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 33' ' ' ARG . 21.9 Cg_exo -64.34 121.19 8.72 Favored 'Trans proline' 0 C--O 1.236 0.415 0 C-N-CA 122.906 2.404 . . . . 0.0 112.058 179.271 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.51 HD12 ' O ' ' A' ' 35' ' ' ILE . 1.4 pp -86.55 86.02 2.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-O 122.343 1.068 . . . . 0.0 110.823 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.092 0 CA-C-N 114.853 -1.067 . . . . 0.0 110.145 178.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.668 0 N-CA-C 112.182 -0.367 . . . . 0.0 112.182 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.1 m -131.52 98.1 18.6 Favored Pre-proline 0 C--N 1.322 -0.594 0 CA-C-O 120.849 0.356 . . . . 0.0 110.575 -178.263 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -88.75 172.97 4.45 Favored 'Trans proline' 0 N--CA 1.453 -0.888 0 C-N-CA 123.229 2.619 . . . . 0.0 111.837 176.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 84.65 -50.14 4.35 Favored Glycine 0 CA--C 1.517 0.214 0 C-N-CA 120.944 -0.646 . . . . 0.0 112.577 177.346 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.596 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 36.4 mt -106.99 155.43 39.2 Favored Pre-proline 0 C--N 1.326 -0.454 0 CA-C-O 120.718 0.294 . . . . 0.0 110.624 179.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.819 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 77.7 Cg_exo -57.27 156.08 26.98 Favored 'Trans proline' 0 C--O 1.236 0.417 0 C-N-CA 122.841 2.361 . . . . 0.0 111.23 170.561 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -64.42 90.06 0.07 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.104 0.478 . . . . 0.0 110.654 179.6 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 142.08 -15.72 2.57 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.417 -178.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.819 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 86.6 m95 -93.46 143.86 25.89 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 117.152 0.476 . . . . 0.0 109.841 179.654 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.3 tt0 -137.62 136.12 37.22 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.364 -177.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.83 124.79 34.0 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 120.778 0.323 . . . . 0.0 110.237 178.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 73.5 mtt180 -131.91 172.5 12.25 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.851 0.358 . . . . 0.0 110.33 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.449 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -117.88 161.39 19.83 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.107 -174.365 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.438 ' CG ' ' H ' ' A' ' 16' ' ' LYS . 1.1 p-10 -111.55 -171.93 1.94 Allowed 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.908 176.418 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.11 -13.19 60.21 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -178.203 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.438 ' H ' ' CG ' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -89.18 -35.15 16.39 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.636 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 118.94 20.92 3.97 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 121.07 -0.586 . . . . 0.0 112.121 179.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.449 ' O ' ' HA ' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -95.89 153.92 17.5 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 120.634 0.254 . . . . 0.0 110.488 -179.837 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.6 m -106.53 116.41 31.89 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.269 179.032 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -114.99 163.67 15.26 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 108.943 -0.762 . . . . 0.0 108.943 175.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.591 ' HD1' HD11 ' A' ' 5' ' ' LEU . 75.0 m-85 -110.28 122.84 48.62 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-O 121.504 0.668 . . . . 0.0 110.827 -177.518 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.4 p -115.31 118.37 58.58 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.032 -179.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -82.64 132.51 35.18 Favored 'General case' 0 C--N 1.315 -0.899 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 176.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 34.0 m-70 -87.59 -31.96 19.58 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -169.582 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -87.06 -35.03 18.96 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.107 0.479 . . . . 0.0 110.543 -179.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -85.46 -28.72 24.84 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.475 178.167 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 64.63 46.56 3.13 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.955 -177.287 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.92 132.91 53.61 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.331 177.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -111.92 101.48 9.79 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.09 0.471 . . . . 0.0 109.952 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 5.5 t -120.55 150.1 41.39 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.152 0.501 . . . . 0.0 110.815 -175.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -99.39 46.28 0.98 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.293 0.568 . . . . 0.0 109.646 179.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.9 t -153.98 141.49 19.79 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.227 -0.897 . . . . 0.0 108.793 -179.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.439 ' HA ' ' HD3' ' A' ' 34' ' ' PRO . 0.0 OUTLIER -88.08 112.81 51.73 Favored Pre-proline 0 C--N 1.32 -0.688 0 CA-C-O 121.623 0.725 . . . . 0.0 109.665 178.948 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.503 ' HG2' ' CE2' ' A' ' 9' ' ' TRP . 3.6 Cg_exo -74.44 127.56 11.2 Favored 'Trans proline' 0 N--CA 1.458 -0.595 0 C-N-CA 123.553 2.836 . . . . 0.0 112.628 -173.092 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 5.4 mm -85.66 71.41 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 121.329 0.585 . . . . 0.0 109.444 174.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.984 0 CA-C-N 114.513 -1.221 . . . . 0.0 110.669 -178.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.601 0 N-CA-C 112.341 -0.304 . . . . 0.0 112.341 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.456 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.0 OUTLIER -71.88 140.6 83.69 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-O 120.641 0.258 . . . . 0.0 110.821 179.163 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.456 ' HD3' ' HA ' ' A' ' 2' ' ' SER . 4.8 Cg_exo -78.3 44.93 1.71 Allowed 'Trans proline' 0 CA--C 1.529 0.256 0 C-N-CA 123.218 2.612 . . . . 0.0 112.202 179.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -166.03 152.29 21.38 Favored Glycine 0 N--CA 1.447 -0.573 0 N-CA-C 111.18 -0.768 . . . . 0.0 111.18 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.723 ' HB3' ' HB2' ' A' ' 9' ' ' TRP . 19.6 mt -97.76 158.88 32.22 Favored Pre-proline 0 C--N 1.319 -0.72 0 CA-C-N 117.018 0.409 . . . . 0.0 110.928 -177.456 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.892 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 52.2 Cg_exo -61.0 -179.47 0.3 Allowed 'Trans proline' 0 C--N 1.345 0.385 0 C-N-CA 123.352 2.701 . . . . 0.0 112.776 175.856 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.12 104.35 0.24 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.024 -177.28 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.511 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . 95.73 5.38 60.02 Favored Glycine 0 N--CA 1.446 -0.639 0 C-N-CA 120.998 -0.62 . . . . 0.0 113.744 173.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.892 ' HD1' ' HB2' ' A' ' 6' ' ' PRO . 82.1 m95 -91.67 130.8 37.4 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 117.804 0.802 . . . . 0.0 109.832 -179.49 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -132.14 145.85 51.65 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.66 -0.496 . . . . 0.0 109.66 178.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -98.95 137.54 37.35 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-O 121.319 0.581 . . . . 0.0 110.241 179.258 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.9 mtm180 -130.81 177.45 7.4 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 114.873 -1.058 . . . . 0.0 108.839 177.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.441 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -135.98 135.65 39.7 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.408 0.623 . . . . 0.0 111.356 -177.346 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.617 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . 12.3 t70 -67.81 159.99 29.19 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.151 -0.932 . . . . 0.0 108.8 172.011 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -57.1 -29.2 63.32 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.743 0.306 . . . . 0.0 111.811 -178.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 2.7 mttp -85.74 4.43 36.78 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.163 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 86.33 34.37 12.39 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.853 -0.689 . . . . 0.0 112.628 177.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.617 ' HB2' ' HB3' ' A' ' 14' ' ' ASP . 1.9 mtp180 -95.72 128.52 42.67 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 179.187 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 32.9 m -90.94 125.18 35.7 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.988 0.423 . . . . 0.0 111.361 -175.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 47.2 p90 -139.94 162.7 34.56 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 176.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.549 ' HD1' HD11 ' A' ' 5' ' ' LEU . 71.1 m-85 -113.72 125.86 54.59 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.154 0.502 . . . . 0.0 110.803 -175.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 2.8 p -116.23 110.38 31.38 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.174 -178.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.511 ' HA ' ' O ' ' A' ' 8' ' ' GLY . 33.5 t-20 -81.91 117.86 22.49 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 176.141 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 94.8 m-70 -78.07 -22.78 48.53 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.867 0.365 . . . . 0.0 110.95 -174.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -81.74 -43.66 18.11 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.522 -178.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.423 ' O ' ' HG2' ' A' ' 27' ' ' ARG . 43.4 t30 -100.54 6.21 44.19 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.733 -178.691 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.423 ' HG2' ' O ' ' A' ' 26' ' ' ASN . 7.9 ptp180 45.54 35.84 2.23 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.295 1.038 . . . . 0.0 112.638 -179.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -101.76 122.34 43.76 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 121.073 0.463 . . . . 0.0 111.24 -178.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -104.47 86.46 2.52 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.164 178.326 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.519 HG23 ' H ' ' A' ' 32' ' ' THR . 1.3 t -98.9 153.0 19.15 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.072 -174.604 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 57.2 m95 -107.42 24.34 13.02 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.471 0.653 . . . . 0.0 109.482 178.048 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.519 ' H ' HG23 ' A' ' 30' ' ' THR . 0.6 OUTLIER -123.74 159.26 29.83 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.162 -0.926 . . . . 0.0 110.252 -177.439 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.94 114.36 43.44 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 175.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -63.18 105.05 0.44 Allowed 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 122.946 2.431 . . . . 0.0 112.82 -179.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 3.3 mm -85.23 90.01 2.84 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 CA-C-O 121.108 0.48 . . . . 0.0 109.989 176.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.693 ' SD ' ' HB3' ' A' ' 6' ' ' PRO . 13.1 ttt . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.532 -0.747 . . . . 0.0 110.166 179.187 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.675 0 N-CA-C 111.844 -0.502 . . . . 0.0 111.844 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.436 ' HA ' ' HD3' ' A' ' 3' ' ' PRO . 0.4 OUTLIER -64.31 146.49 97.77 Favored Pre-proline 0 C--N 1.327 -0.392 0 CA-C-N 116.527 0.164 . . . . 0.0 110.828 178.785 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 2' ' ' SER . 39.1 Cg_exo -61.59 -21.22 71.47 Favored 'Trans proline' 0 C--N 1.348 0.504 0 C-N-CA 122.914 2.409 . . . . 0.0 112.512 -178.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 173.33 178.06 43.02 Favored Glycine 0 N--CA 1.442 -0.952 0 N-CA-C 110.665 -0.974 . . . . 0.0 110.665 178.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.788 HD11 ' HD1' ' A' ' 21' ' ' TYR . 59.3 mt 61.51 174.31 0.06 OUTLIER Pre-proline 0 N--CA 1.448 -0.55 0 N-CA-C 112.813 0.672 . . . . 0.0 112.813 178.105 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.702 ' HB2' ' HD1' ' A' ' 9' ' ' TRP . 72.9 Cg_exo -58.64 171.92 1.75 Allowed 'Trans proline' 0 C--N 1.346 0.418 0 C-N-CA 122.964 2.442 . . . . 0.0 112.159 171.474 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -70.79 7.37 1.15 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.18 -0.464 . . . . 0.0 112.129 -175.477 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . -137.73 6.65 3.53 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.999 178.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' TRP . . . . . 0.764 ' HB3' HD13 ' A' ' 5' ' ' LEU . 79.6 m95 -111.47 134.39 53.08 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 117.268 0.534 . . . . 0.0 109.577 -178.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.617 ' OE1' ' HD2' ' A' ' 12' ' ' ARG . 43.3 tt0 -120.08 121.51 39.02 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.044 -178.793 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -85.03 117.7 24.15 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.024 0.44 . . . . 0.0 109.839 177.211 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.617 ' HD2' ' OE1' ' A' ' 10' ' ' GLU . 2.3 mtp180 -115.18 -170.0 1.67 Allowed 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.912 -0.586 . . . . 0.0 110.36 -178.254 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.06 134.04 30.8 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.167 -175.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.416 ' HB3' ' HB2' ' A' ' 18' ' ' ARG . 5.8 t70 -76.82 164.82 25.48 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.523 173.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -63.76 -22.77 67.07 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.071 0.462 . . . . 0.0 111.261 -177.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.487 ' HG3' ' HG2' ' A' ' 18' ' ' ARG . 13.5 pttm -96.24 14.88 22.64 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.344 178.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 72.13 45.65 39.41 Favored Glycine 0 N--CA 1.45 -0.383 0 C-N-CA 120.829 -0.7 . . . . 0.0 112.499 178.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.487 ' HG2' ' HG3' ' A' ' 16' ' ' LYS . 6.6 mmt-85 -106.21 143.4 34.4 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 178.612 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 44.1 m -100.33 115.17 29.33 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.613 -175.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.1 p90 -133.84 161.67 34.11 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.998 -0.547 . . . . 0.0 109.828 175.171 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.788 ' HD1' HD11 ' A' ' 5' ' ' LEU . 35.7 m-85 -116.62 125.07 51.27 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.243 0.544 . . . . 0.0 110.673 -175.064 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.598 HG11 ' HD3' ' A' ' 12' ' ' ARG . 2.5 p -118.8 108.85 25.09 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 121.815 0.817 . . . . 0.0 110.574 -178.407 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -80.85 116.32 20.78 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.143 -0.935 . . . . 0.0 108.779 178.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 81.8 m-70 -86.4 -16.15 38.16 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.802 0.334 . . . . 0.0 111.375 -174.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -76.55 -36.07 57.86 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.936 0.398 . . . . 0.0 110.425 -179.193 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -113.12 -2.82 14.06 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.057 -179.098 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 57.74 52.76 7.78 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.678 -0.692 . . . . 0.0 111.045 -178.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.6 130.21 56.75 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.904 179.35 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.55 105.44 15.08 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.078 -0.51 . . . . 0.0 109.798 177.774 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.422 HG22 ' HZ3' ' A' ' 9' ' ' TRP . 0.7 OUTLIER -127.81 152.59 47.6 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 120.765 0.317 . . . . 0.0 110.926 -176.279 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 46.6 m95 -101.15 -3.18 29.63 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.917 0.865 . . . . 0.0 108.718 173.123 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.449 ' O ' ' HD3' ' A' ' 34' ' ' PRO . 1.8 m -74.52 136.91 42.18 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 114.334 -1.303 . . . . 0.0 110.339 177.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.08 110.86 11.18 Favored Pre-proline 0 C--N 1.328 -0.358 0 CA-C-O 120.637 0.256 . . . . 0.0 110.7 177.696 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.536 ' HG2' HD22 ' A' ' 5' ' ' LEU . 73.4 Cg_endo -84.51 99.17 0.74 Allowed 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.642 2.228 . . . . 0.0 112.642 -179.49 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 9.6 mm -105.04 -1.35 9.94 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.537 0 CA-C-O 122.059 0.933 . . . . 0.0 110.1 178.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 10.8 ttp . . . . . 0 C--O 1.251 1.148 0 CA-C-N 114.389 -1.278 . . . . 0.0 109.444 -178.918 . . . . . . . . 0 0 . 1 stop_ save_