data_6qk5_residue ############################ # Computer software used # ############################ 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 6qk5 _Structure_validation_residue.Date_analyzed 2019-12-13 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 ' 9' ' ' LYS . . . . . . . . . . . . . 92.7 mttt . . . . . 0 N--CA 1.451 -0.413 0 CA-C-O 121.454 0.645 . . . . 0.0 109.479 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.556 ' SG ' ' HB2' ' A' ' 27' ' ' CYS . 76.4 m -85.34 150.46 24.73 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.093 -178.255 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.9 t -81.22 166.94 20.13 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.565 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.2 m -54.52 -39.09 67.28 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.589 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.69 -45.62 89.07 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.253 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.619 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 44.6 t -69.38 -34.08 74.01 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.226 0.536 . . . . 0.0 110.373 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 77.5 mtp180 -84.46 14.82 4.13 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.716 -0.675 . . . . 0.0 112.043 -178.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.6 m -100.99 164.39 11.84 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.557 0.218 . . . . 0.0 110.636 178.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.4 mp0 -121.49 110.85 33.62 Favored Pre-proline 0 C--N 1.327 -0.384 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 177.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -78.23 172.12 63.14 Favored 'Cis proline' 0 C--O 1.237 0.47 0 C-N-CA 123.72 -1.367 . . . . 0.0 111.74 0.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.623 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 43.3 t -62.34 134.62 56.73 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 121.127 0.489 . . . . 0.0 110.571 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -113.34 23.78 12.91 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.933 -178.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.658 ' SG ' ' HA ' ' A' ' 25' ' ' CYS . 0.7 OUTLIER -73.97 -25.7 60.08 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 -178.908 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 59.45 -145.06 45.22 Favored Glycine 0 N--CA 1.443 -0.889 0 CA-C-N 115.172 -0.922 . . . . 0.0 113.24 177.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -95.03 -9.9 32.45 Favored 'General case' 0 N--CA 1.438 -1.038 0 CA-C-O 120.92 0.39 . . . . 0.0 110.164 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.41 ' HA ' ' CE ' ' A' ' 24' ' ' LYS . 5.4 mmpt? -72.94 -42.05 63.83 Favored 'General case' 0 CA--C 1.511 -0.555 0 N-CA-C 109.244 -0.651 . . . . 0.0 109.244 178.338 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.658 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 2.6 t 53.83 79.42 0.13 Allowed 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.861 175.05 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -99.91 16.67 23.06 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.749 -178.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.556 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 23.9 p -87.63 -163.57 0.96 Allowed 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.48 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -111.83 153.04 17.54 Favored Glycine 0 N--CA 1.441 -0.998 0 C-N-CA 120.554 -0.832 . . . . 0.0 112.485 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -71.98 120.2 17.23 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 120.807 0.337 . . . . 0.0 110.324 178.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 135.79 -3.35 3.83 Favored Glycine 0 N--CA 1.441 -1.021 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.601 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.527 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 9.1 p -89.31 -31.92 17.6 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.698 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 42.9 p 50.87 38.81 20.97 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.229 0.611 . . . . 0.0 111.306 -176.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.527 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 6.9 t -59.72 136.12 57.9 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.011 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.01 23.52 0.7 Allowed 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -174.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -125.7 -50.8 1.6 Allowed 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.134 0.493 . . . . 0.0 110.117 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.613 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 3.2 p -94.73 -43.1 8.41 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.621 179.063 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.446 ' HE3' ' OG ' ' A' ' 62' ' ' SER . 13.4 mptt -83.53 63.08 7.16 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.468 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.4 t -112.2 175.62 5.36 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.574 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 43.2 t -134.27 135.66 43.04 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -100.95 7.66 43.46 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.484 -175.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.45 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 62.8 m -82.85 134.87 35.08 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.637 178.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 53.2 p -101.91 167.91 9.76 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.165 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.3 m -69.75 -20.36 63.5 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.016 0.436 . . . . 0.0 110.289 178.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -74.64 -38.33 62.54 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.621 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -164.53 135.31 3.69 Favored Glycine 0 N--CA 1.428 -1.864 0 C-N-CA 120.455 -0.879 . . . . 0.0 112.285 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.2 t -73.23 129.55 38.29 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 179.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.45 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 75.1 mmtt -86.74 -25.51 24.67 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 112.068 0.395 . . . . 0.0 112.068 -176.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.437 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 19.1 p -97.77 -36.58 10.17 Favored 'General case' 0 C--N 1.313 -1.007 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.345 179.226 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 107.7 5.28 33.87 Favored Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.974 178.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.437 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 74.9 mmtt -83.96 -2.2 56.09 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-O 121.019 0.438 . . . . 0.0 110.542 178.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 67.16 23.91 9.41 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.721 177.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.4 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 1.7 p -73.78 -45.68 50.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.94 177.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 46.0 p 52.75 33.67 14.55 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.036 0.934 . . . . 0.0 113.375 176.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 156.74 144.13 3.85 Favored Glycine 0 N--CA 1.441 -1.032 0 C-N-CA 120.25 -0.976 . . . . 0.0 112.047 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -63.18 -36.51 57.39 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.653 2.236 . . . . 0.0 112.406 -178.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -69.23 -14.93 63.24 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.938 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.6 m -125.47 22.56 7.66 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.038 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.4 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 4.6 t -83.33 137.98 33.73 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.298 -177.24 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 86.1 mttt -123.93 -4.83 8.02 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.384 -176.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.6 p -103.94 156.3 17.96 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 120.934 0.397 . . . . 0.0 111.911 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -71.34 -177.04 25.66 Favored Glycine 0 CA--C 1.52 0.361 0 CA-C-N 115.759 -0.655 . . . . 0.0 114.263 -176.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.446 ' OG ' ' HE3' ' A' ' 37' ' ' LYS . 41.3 m -78.21 -10.27 59.58 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -176.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 30.6 m -89.63 19.19 4.78 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.067 0.461 . . . . 0.0 110.365 178.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 29.6 t -96.97 166.44 11.61 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.825 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 49.3 m -66.32 -29.66 69.9 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -177.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.529 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 25.2 p -80.34 4.65 17.18 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.795 0.331 . . . . 0.0 111.383 -178.493 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.529 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 9.9 mmtp . . . . . 0 C--O 1.264 1.854 0 CA-C-O 117.939 -1.029 . . . . 0.0 110.832 -177.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt . . . . . 0 C--O 1.227 -0.098 0 CA-C-O 120.995 0.426 . . . . 0.0 110.929 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.712 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 96.3 m -92.36 139.71 30.32 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-O 121.387 0.613 . . . . 0.0 111.932 -179.302 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 80.9 p -93.26 179.51 5.39 Favored 'General case' 0 N--CA 1.429 -1.479 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.459 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.1 m -64.23 -26.03 68.33 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.234 -178.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.43 -44.22 83.51 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.828 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.525 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 42.4 t -75.12 -32.87 61.49 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.231 0.539 . . . . 0.0 110.977 -179.12 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 36.4 ttm-85 -80.36 0.56 32.59 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.178 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.2 t -89.0 162.27 16.13 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -134.12 117.41 13.65 Favored Pre-proline 0 C--N 1.318 -0.802 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -68.5 166.64 69.03 Favored 'Cis proline' 0 N--CA 1.477 0.507 0 C-N-CA 123.498 -1.459 . . . . 0.0 112.555 0.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.41 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 4.4 t -62.47 133.0 54.38 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.425 -178.026 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 80.2 mm-40 -112.93 18.7 17.93 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -174.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.525 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 1.2 m -65.49 -30.49 71.27 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 120.239 -0.584 . . . . 0.0 111.358 179.459 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 58.99 -136.88 50.93 Favored Glycine 0 CA--C 1.52 0.363 0 CA-C-N 115.961 -0.563 . . . . 0.0 114.15 176.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.0 m -93.32 -8.17 42.8 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.866 0.365 . . . . 0.0 111.165 -177.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -88.01 -49.88 6.77 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.134 179.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t 59.96 92.61 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.074 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -85.14 -7.6 59.0 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.164 -0.925 . . . . 0.0 112.78 -174.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.554 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 22.6 p -101.07 -176.47 3.17 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.255 0.55 . . . . 0.0 111.686 -177.562 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -100.38 -147.9 21.67 Favored Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.981 177.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -109.13 18.05 20.99 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 121.157 0.504 . . . . 0.0 110.491 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -83.17 -9.12 84.48 Favored Glycine 0 C--N 1.309 -0.935 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.489 -177.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.712 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 29.8 p -94.27 -30.61 14.47 Favored 'General case' 0 C--N 1.318 -0.795 0 O-C-N 122.769 -0.253 . . . . 0.0 111.468 -178.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 41.1 p 49.61 41.23 21.23 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-O 121.709 0.766 . . . . 0.0 109.854 -173.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.611 ' O ' ' HB2' ' A' ' 37' ' ' LYS . 0.3 OUTLIER -58.77 159.19 7.06 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 114.528 -1.215 . . . . 0.0 111.214 -177.606 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -104.59 12.93 32.48 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.627 -178.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -121.72 -64.43 1.22 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.054 -178.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 14.7 p -82.11 -25.35 34.53 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.958 0.408 . . . . 0.0 111.275 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.611 ' HB2' ' O ' ' A' ' 33' ' ' CYS . 1.4 mmpp? -93.32 58.38 2.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.79 0.329 . . . . 0.0 111.208 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.7 t -127.72 159.97 33.14 Favored 'General case' 0 C--N 1.313 -1.017 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.735 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.3 t -93.35 139.52 30.58 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -95.15 -0.16 53.59 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 120.862 0.363 . . . . 0.0 111.384 -177.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.547 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 62.8 m -81.31 135.29 35.69 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.219 -0.446 . . . . 0.0 109.949 177.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 69.5 p -101.3 166.47 10.74 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.758 -178.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.7 m -71.72 -15.2 62.19 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.532 179.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -80.66 -35.32 33.94 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.508 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -166.61 130.04 2.05 Favored Glycine 0 N--CA 1.439 -1.151 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.091 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 18.6 t -67.88 133.87 49.89 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 32.8 mmmt -92.41 -30.85 15.55 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -176.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.1 p -91.62 -39.61 11.77 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.611 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 114.41 4.74 21.72 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.817 -0.706 . . . . 0.0 113.028 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.504 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 75.3 mmtt -86.32 -2.99 58.89 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.982 0.391 . . . . 0.0 111.507 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 67.94 18.31 9.56 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.311 0.577 . . . . 0.0 111.284 177.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.493 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 0.9 OUTLIER -65.83 -49.55 67.8 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.008 178.108 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 46.5 p 53.05 46.47 26.65 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.042 -0.981 . . . . 0.0 113.111 177.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 135.13 153.1 6.67 Favored Glycine 0 N--CA 1.442 -0.951 0 C-N-CA 120.212 -0.994 . . . . 0.0 112.687 177.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.09 -18.34 30.92 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.752 2.302 . . . . 0.0 112.68 -178.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -82.16 -4.83 57.78 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.158 0.504 . . . . 0.0 110.729 -178.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 49.3 m -148.07 26.44 0.98 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.317 0.58 . . . . 0.0 110.209 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.493 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 12.2 t -84.21 138.2 33.1 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.988 -177.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -110.82 12.43 22.38 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.445 0.641 . . . . 0.0 109.406 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.504 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 19.3 m -108.66 151.25 26.41 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.456 -178.473 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -89.18 -106.7 1.11 Allowed Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 121.106 -0.569 . . . . 0.0 112.558 -178.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 61.7 p -129.32 -9.0 4.71 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-O 120.9 0.381 . . . . 0.0 111.142 -178.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.1 m -104.38 20.61 18.14 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.88 -175.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 35.3 t -102.13 170.48 8.08 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.669 179.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.6 t -65.93 -28.94 69.3 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.186 -178.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.547 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 17.3 p -80.52 1.81 27.96 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 120.845 0.355 . . . . 0.0 111.488 -178.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 23.5 mmtp . . . . . 0 C--O 1.258 1.525 0 CA-C-O 117.544 -1.217 . . . . 0.0 110.533 -179.104 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.476 ' N ' ' HD2' ' A' ' 9' ' ' LYS . 11.5 mptt . . . . . 0 N--CA 1.45 -0.459 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.844 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 79.7 m -100.35 146.33 27.09 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.271 -177.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.5 p -94.68 178.76 5.48 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.589 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.5 p -60.47 -29.35 68.99 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.385 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.27 -45.66 87.09 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.259 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.465 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 17.5 t -69.42 -35.27 75.57 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.006 0.432 . . . . 0.0 110.71 -178.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 15' ' ' ARG . 19.0 mtt180 -76.12 0.91 17.19 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.8 m -81.18 160.12 24.43 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.683 0.278 . . . . 0.0 111.064 -178.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -126.48 108.45 23.47 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.991 178.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -74.44 173.12 58.74 Favored 'Cis proline' 0 C--O 1.241 0.634 0 C-N-CA 123.554 -1.436 . . . . 0.0 112.145 -2.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.465 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 8.7 t -57.66 139.92 52.5 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.871 -177.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 86.1 mm-40 -119.01 16.49 13.34 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -175.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -62.86 -29.86 71.07 Favored 'General case' 0 C--O 1.241 0.619 0 C-N-CA 120.269 -0.572 . . . . 0.0 110.412 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 59.33 -139.5 48.62 Favored Glycine 0 N--CA 1.448 -0.562 0 CA-C-N 115.663 -0.699 . . . . 0.0 113.032 176.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -99.17 10.69 40.94 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.133 0.492 . . . . 0.0 110.647 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -98.61 -50.23 4.33 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 177.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 t 57.3 94.6 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.0 179.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -97.36 9.61 41.84 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.562 -175.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.569 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 31.7 p -107.63 173.59 6.26 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.947 -179.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -102.06 178.45 26.93 Favored Glycine 0 N--CA 1.445 -0.742 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.798 178.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -82.14 78.23 8.84 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.221 0.534 . . . . 0.0 111.284 -178.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -159.14 23.09 0.31 Allowed Glycine 0 N--CA 1.444 -0.821 0 N-CA-C 111.265 -0.734 . . . . 0.0 111.265 178.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.844 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 25.1 p -116.52 -19.79 9.91 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 -178.255 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 71.7 p 50.92 30.41 5.22 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-O 121.573 0.702 . . . . 0.0 110.543 -175.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.406 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 1.9 t -76.84 116.41 17.48 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.008 -177.204 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -88.1 16.94 5.44 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.37 0.605 . . . . 0.0 110.607 -176.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.38 -54.07 2.67 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.216 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 28.6 p -98.44 -30.48 12.52 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.122 178.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.542 ' HB2' ' NZ ' ' A' ' 37' ' ' LYS . 0.3 OUTLIER -106.52 80.18 1.45 Allowed 'General case' 0 N--CA 1.435 -1.193 0 CA-C-O 121.448 0.642 . . . . 0.0 111.796 -175.17 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.5 t -157.17 161.75 39.32 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.035 178.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.6 t -89.96 146.91 24.03 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 120.835 0.35 . . . . 0.0 110.736 -179.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 -114.51 2.76 14.69 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.098 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.557 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 57.2 m -79.71 148.11 31.67 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.235 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 44.8 p -114.25 162.24 16.82 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.698 -179.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.434 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 6.6 p -63.8 -25.75 68.32 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.021 0.438 . . . . 0.0 111.312 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -73.4 -35.09 65.82 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.299 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -164.24 131.07 2.33 Favored Glycine 0 N--CA 1.442 -0.949 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.032 -179.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 27.4 t -76.96 133.65 39.13 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 120.743 0.306 . . . . 0.0 110.483 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -86.41 -41.06 14.77 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -178.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.412 ' HA ' ' HB2' ' A' ' 65' ' ' SER . 19.2 p -83.37 -39.23 20.97 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.033 -177.411 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.64 5.82 25.57 Favored Glycine 0 N--CA 1.44 -1.071 0 C-N-CA 120.47 -0.871 . . . . 0.0 113.029 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -84.58 -0.51 53.48 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.075 0.464 . . . . 0.0 110.264 178.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 63.66 21.23 12.62 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.215 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.515 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 3.2 p -70.04 -47.53 61.67 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.956 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.434 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 73.5 p 55.35 25.68 7.84 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 114.956 -1.02 . . . . 0.0 113.032 177.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 152.02 155.22 6.93 Favored Glycine 0 N--CA 1.441 -1.025 0 C-N-CA 120.297 -0.954 . . . . 0.0 112.518 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -60.36 -26.64 83.18 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 123.258 2.639 . . . . 0.0 113.179 -179.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -70.74 -17.73 62.8 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.927 0.394 . . . . 0.0 111.656 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.1 m -135.43 25.15 3.48 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.008 0.432 . . . . 0.0 110.032 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.515 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 6.3 t -81.59 126.42 31.71 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.146 -176.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp -106.34 17.27 23.66 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.462 -178.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.3 m -109.5 159.38 17.11 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.197 -175.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -110.21 -77.04 0.91 Allowed Glycine 0 N--CA 1.439 -1.115 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.624 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 34.8 m -146.47 159.3 43.59 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 110.376 -0.231 . . . . 0.0 110.376 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.2 m 65.21 7.4 4.13 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 177.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 45.3 t -75.46 167.47 21.84 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 176.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.412 ' HB2' ' HA ' ' A' ' 48' ' ' CYS . 15.4 m -64.34 -16.56 62.46 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 120.771 0.319 . . . . 0.0 111.771 -177.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.557 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 25.5 p -101.15 1.92 39.64 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 120.571 0.224 . . . . 0.0 111.29 178.433 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.51 ' HE2' ' SG ' ' A' ' 66' ' ' CYS . 71.9 mmtt . . . . . 0 C--O 1.261 1.708 0 CA-C-O 117.843 -1.075 . . . . 0.0 111.049 -177.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.9 mttt . . . . . 0 CA--C 1.514 -0.412 0 CA-C-O 120.944 0.402 . . . . 0.0 110.119 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.551 ' SG ' ' HB2' ' A' ' 27' ' ' CYS . 78.6 m -95.86 147.86 23.21 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -176.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 74.8 p -100.51 179.6 4.39 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.805 -178.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.5 m -62.12 -20.07 63.68 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.31 -178.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.38 -50.14 48.94 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 120.956 0.408 . . . . 0.0 110.023 177.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 51.4 t -73.57 -35.68 65.48 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.009 178.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 27.7 mtm180 -69.35 -3.34 13.75 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.948 0.404 . . . . 0.0 111.649 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.5 t -83.62 163.97 20.01 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 176.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -132.86 111.43 13.37 Favored Pre-proline 0 C--N 1.306 -1.3 0 CA-C-O 120.884 0.373 . . . . 0.0 110.565 178.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -75.22 173.14 59.5 Favored 'Cis proline' 0 C--N 1.35 0.613 0 C-N-CA 123.444 -1.482 . . . . 0.0 112.238 -0.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 71.2 m -59.86 140.68 56.44 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.075 0.464 . . . . 0.0 111.164 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 28.7 mm-40 -114.29 21.1 14.99 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.004 -177.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.424 ' HB3' ' HA ' ' A' ' 25' ' ' CYS . 11.0 m -66.1 -33.14 75.1 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.84 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 79.75 -114.85 3.95 Favored Glycine 0 N--CA 1.438 -1.17 0 C-N-CA 120.775 -0.726 . . . . 0.0 111.445 -178.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.9 t -129.29 -3.27 4.97 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.043 0.449 . . . . 0.0 110.248 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -88.22 -40.81 13.39 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.086 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.534 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 0.6 OUTLIER 66.72 104.39 0.04 OUTLIER 'General case' 0 CA--C 1.505 -0.772 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.848 -179.615 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -88.3 -14.88 37.2 Favored 'General case' 0 C--N 1.305 -1.346 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.009 177.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.551 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 26.6 p -84.19 170.86 13.33 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.194 178.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.12 -126.68 2.87 Favored Glycine 0 N--CA 1.441 -0.987 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.29 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -137.36 77.41 1.64 Allowed 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 121.635 0.731 . . . . 0.0 110.556 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -172.36 43.21 0.17 Allowed Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.844 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.573 ' SG ' ' HE2' ' A' ' 37' ' ' LYS . 12.0 p -130.88 -28.63 1.97 Allowed 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 120.6 0.238 . . . . 0.0 111.178 -178.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.8 p 50.04 45.66 25.18 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 123.466 0.706 . . . . 0.0 112.8 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.621 ' O ' ' HB2' ' A' ' 37' ' ' LYS . 59.1 m -74.6 170.95 14.74 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.503 178.164 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -109.41 3.54 21.54 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.27 0.557 . . . . 0.0 110.08 178.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -104.62 -69.09 0.82 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.389 -178.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.534 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 25.3 p -88.68 0.23 56.63 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.139 -179.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.621 ' HB2' ' O ' ' A' ' 33' ' ' CYS . 34.1 mmtm -120.39 37.67 4.2 Favored 'General case' 0 CA--C 1.503 -0.832 0 CA-C-O 121.568 0.699 . . . . 0.0 111.454 -179.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.5 t -113.81 165.42 12.59 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.558 177.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 27.9 t -102.73 136.43 42.57 Favored 'General case' 0 C--N 1.307 -1.255 0 C-N-CA 120.633 -0.427 . . . . 0.0 109.922 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -87.31 -5.26 58.97 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.041 0.448 . . . . 0.0 110.806 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.415 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 69.3 m -80.03 136.01 36.49 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.176 178.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 61.1 p -92.59 152.91 19.34 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.448 -178.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.488 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 45.5 m -66.52 -13.0 60.35 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-O 121.215 0.531 . . . . 0.0 110.795 178.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -86.01 -19.81 29.8 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.248 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 178.2 134.8 2.15 Favored Glycine 0 N--CA 1.438 -1.17 0 C-N-CA 120.976 -0.63 . . . . 0.0 112.033 -178.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 30.9 t -69.03 142.24 54.62 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -112.18 -10.32 13.86 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.502 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 14.5 p -103.67 -39.48 6.67 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.121 -0.632 . . . . 0.0 109.962 177.158 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 122.9 -1.62 9.96 Favored Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.81 -0.709 . . . . 0.0 113.437 177.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.799 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 35.2 mmtp -84.71 -4.12 58.88 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 117.136 0.468 . . . . 0.0 111.526 -178.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 67.85 19.58 9.51 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.273 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.542 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.2 p -69.06 -44.29 72.88 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.132 -179.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.488 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 67.0 p 53.65 27.75 7.17 Favored 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 176.142 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.97 158.62 7.66 Favored Glycine 0 N--CA 1.443 -0.882 0 C-N-CA 120.095 -1.05 . . . . 0.0 112.151 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.91 -26.51 81.3 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 123.159 2.572 . . . . 0.0 113.065 -178.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -60.29 -50.25 74.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.873 0.368 . . . . 0.0 111.467 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.0 m -107.21 19.38 20.45 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.237 -177.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.542 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 41.8 t -84.87 135.47 34.06 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 121.183 0.516 . . . . 0.0 111.509 -178.27 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -122.28 13.19 10.31 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.154 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.799 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 3.7 m -99.71 116.72 32.46 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 178.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -106.37 89.38 0.6 Allowed Glycine 0 C--N 1.298 -1.549 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.916 -175.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 39.7 m 66.14 164.72 0.18 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.17 0.588 . . . . 0.0 111.339 -179.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.9 m 69.31 -14.32 0.33 Allowed 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 25.5 t -86.22 165.37 16.56 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 119.873 -0.731 . . . . 0.0 110.932 -178.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.8 m -64.2 -22.69 67.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.738 -178.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.473 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 27.4 p -90.29 4.22 51.36 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.81 178.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.473 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 0.3 OUTLIER . . . . . 0 C--O 1.256 1.403 0 CA-C-O 118.078 -0.963 . . . . 0.0 110.474 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 50.4 mtpt . . . . . 0 C--O 1.235 0.3 0 CA-C-O 121.437 0.637 . . . . 0.0 111.341 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.625 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 71.7 m -92.93 139.4 30.57 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.218 177.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 64.4 p -88.08 -179.06 6.11 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.758 -177.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.0 p -62.74 -30.59 71.55 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.196 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.45 -49.43 76.86 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.695 179.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.416 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 43.2 t -67.97 -29.29 68.3 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.431 0.634 . . . . 0.0 110.423 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.4 mmt180 -84.38 15.94 3.36 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.975 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.6 m -107.81 161.09 15.22 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 175.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -123.35 110.87 30.36 Favored Pre-proline 0 C--N 1.315 -0.908 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.724 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -79.17 171.27 65.69 Favored 'Cis proline' 0 C--O 1.239 0.544 0 C-N-CA 123.483 -1.465 . . . . 0.0 111.852 -0.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 95.9 m -55.31 129.06 37.01 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.391 0.615 . . . . 0.0 111.215 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 31.4 mm-40 -94.75 8.89 41.03 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.034 -178.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.534 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 7.4 m -62.26 -37.02 83.85 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.093 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 64.59 -144.56 48.52 Favored Glycine 0 N--CA 1.441 -1.011 0 CA-C-N 115.687 -0.688 . . . . 0.0 113.105 178.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.7 m -88.58 -8.51 54.59 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -178.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -86.66 -54.13 4.56 Favored 'General case' 0 CA--C 1.491 -1.29 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 178.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.68 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 8.6 t 63.48 101.18 0.03 OUTLIER 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 114.358 -1.292 . . . . 0.0 112.467 175.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -97.18 12.15 33.82 Favored 'General case' 0 C--N 1.308 -1.197 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -178.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.625 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 21.8 p -104.12 166.05 10.65 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 119.754 -0.779 . . . . 0.0 111.24 176.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -79.41 -112.49 0.24 Allowed Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.225 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -139.84 -173.34 3.61 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -179.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.96 -33.8 5.67 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.472 -0.87 . . . . 0.0 113.095 177.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 18.5 p -69.37 -36.88 77.26 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.738 0.304 . . . . 0.0 110.814 -179.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 46.9 p 49.59 43.96 24.2 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.634 -179.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 72.3 m -64.81 172.38 2.85 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.926 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.39 3.29 23.17 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.539 0.685 . . . . 0.0 109.619 177.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -106.45 -72.06 0.73 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.542 -178.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.68 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 7.8 p -80.25 -23.43 40.83 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.183 0.516 . . . . 0.0 111.275 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.524 ' NZ ' ' SG ' ' A' ' 27' ' ' CYS . 11.2 mptt -95.36 105.52 17.48 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-O 121.473 0.654 . . . . 0.0 111.691 179.226 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.4 t -171.7 -173.04 1.11 Allowed 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 114.891 -1.049 . . . . 0.0 108.348 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . 0.441 ' SG ' ' HB2' ' A' ' 41' ' ' CYS . 46.4 t -136.98 127.18 26.26 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 177.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 41.4 m-80 -72.48 -20.28 61.4 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.972 0.415 . . . . 0.0 110.705 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.453 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 49.5 m -68.59 137.15 54.04 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.712 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 77.9 p -117.9 173.38 6.8 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.434 -177.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.1 m -62.08 -20.27 63.84 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 121.04 0.448 . . . . 0.0 110.947 178.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -68.09 -39.59 82.83 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.391 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 176.22 146.51 6.01 Favored Glycine 0 N--CA 1.428 -1.855 0 C-N-CA 120.848 -0.691 . . . . 0.0 111.853 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 45.1 t -63.91 129.7 41.14 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 178.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.453 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 30.8 mmmt -96.23 -12.69 24.23 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -176.261 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.479 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 18.7 p -99.97 -41.4 7.21 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 119.654 -0.818 . . . . 0.0 109.928 177.123 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.46 15.82 9.3 Favored Glycine 0 N--CA 1.433 -1.531 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.816 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.479 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 75.7 mmtt -94.64 6.06 50.01 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 176.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 67.99 37.98 2.88 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.694 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.578 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 26.6 p -113.14 141.9 46.38 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.327 176.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.2 p -136.55 106.4 6.24 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.624 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 90.8 147.86 19.84 Favored Glycine 0 N--CA 1.437 -1.234 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.312 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -59.37 -30.26 92.28 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.327 2.018 . . . . 0.0 111.918 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -63.63 -47.01 83.1 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.565 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.4 m -101.52 19.62 17.59 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.257 -178.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.578 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 44.6 t -75.24 126.63 31.41 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 120.874 0.369 . . . . 0.0 110.375 179.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -99.58 -5.11 29.65 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.366 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.401 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 15.2 m -89.0 142.18 27.85 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.017 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -116.27 73.08 0.27 Allowed Glycine 0 C--N 1.316 -0.575 0 C-N-CA 120.808 -0.711 . . . . 0.0 113.074 -176.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.44 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 9.7 t 65.65 166.39 0.19 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.18 0.592 . . . . 0.0 111.355 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.3 t 70.21 -16.57 0.3 Allowed 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.411 0.684 . . . . 0.0 112.759 177.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . 0.406 ' H ' ' C ' ' A' ' 62' ' ' SER . 20.1 t -76.88 165.16 25.06 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 110.354 -0.239 . . . . 0.0 110.354 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 6.7 m -64.24 -24.59 67.72 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.87 -177.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.433 ' SG ' ' HE2' ' A' ' 67' ' ' LYS . 20.8 p -75.92 -4.09 39.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.922 0.392 . . . . 0.0 111.01 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.44 ' HG3' ' HA ' ' A' ' 62' ' ' SER . 18.0 mmtt . . . . . 0 C--O 1.258 1.517 0 CA-C-O 117.485 -1.245 . . . . 0.0 110.34 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt . . . . . 0 C--O 1.241 0.637 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.632 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 59.4 m -91.34 156.49 17.74 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.659 -1.155 . . . . 0.0 112.617 -176.224 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.3 p -94.16 177.76 5.86 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.465 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.7 m -57.75 -37.74 74.14 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.782 0.29 . . . . 0.0 111.782 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.97 -42.28 98.96 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 120.942 0.401 . . . . 0.0 111.517 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.523 ' HB3' ' HB3' ' A' ' 10' ' ' CYS . 11.7 t -73.83 -25.46 60.1 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.365 0.603 . . . . 0.0 109.635 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 15' ' ' ARG . 42.2 mtt180 -89.78 12.83 15.98 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.411 178.341 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.6 m -89.05 177.71 6.58 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 179.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.468 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 3.4 tm-20 -131.84 111.08 14.61 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-O 120.707 0.289 . . . . 0.0 110.507 178.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.468 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 72.0 Cg_endo -77.94 -170.55 8.85 Favored 'Cis proline' 0 C--N 1.347 0.481 0 C-N-CA 122.926 -1.697 . . . . 0.0 110.924 -2.264 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.7 t -59.46 122.95 15.27 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 120.898 0.38 . . . . 0.0 110.575 -179.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 84.5 mm-40 -110.17 15.73 22.22 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.007 -177.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.853 ' SG ' ' HA ' ' A' ' 25' ' ' CYS . 3.4 t -65.62 -27.88 68.71 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 50.75 -139.01 23.94 Favored Glycine 0 C--N 1.341 0.826 0 CA-C-N 114.704 -1.135 . . . . 0.0 115.345 173.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.2 m -84.03 -15.39 47.74 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.101 -0.549 . . . . 0.0 111.293 -177.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.8 mmmt -73.95 -48.75 28.42 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.186 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.853 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 8.2 t 53.59 81.9 0.09 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.74 -179.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -86.61 -11.2 52.12 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.869 -175.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.632 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 30.8 p -82.92 175.52 10.0 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.0 0.428 . . . . 0.0 111.176 -178.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -123.04 -135.57 4.62 Favored Glycine 0 N--CA 1.437 -1.253 0 C-N-CA 120.474 -0.87 . . . . 0.0 112.499 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -74.58 152.29 39.31 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 122.899 0.48 . . . . 0.0 111.071 -179.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 94.84 15.92 43.89 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.021 -0.609 . . . . 0.0 112.944 178.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.695 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 16.1 t -114.77 -62.61 1.58 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.103 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 76.3 p 52.38 35.48 17.46 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.124 0.569 . . . . 0.0 111.8 -177.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.695 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -58.35 142.44 48.21 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.339 179.757 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -93.28 18.31 9.78 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 121.392 0.615 . . . . 0.0 109.681 178.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -120.71 -53.55 2.08 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.531 -177.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.581 ' CB ' ' HB3' ' A' ' 21' ' ' CYS . 29.8 p -98.24 -38.93 9.09 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.735 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 11.1 ttmm -107.18 36.01 2.84 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.471 0.653 . . . . 0.0 111.104 -174.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.407 ' O ' ' HD3' ' A' ' 67' ' ' LYS . 14.7 t -96.86 171.27 8.62 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.729 -177.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -99.8 148.59 24.25 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.663 178.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -110.28 3.89 20.36 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.656 -178.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 64.8 m -80.08 155.79 27.38 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-O 120.827 0.346 . . . . 0.0 110.712 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 54.7 p -122.87 159.15 28.79 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.403 -178.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.5 m -65.03 -27.97 69.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.148 0.499 . . . . 0.0 110.241 179.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -66.52 -32.18 73.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.896 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -174.44 128.36 1.44 Allowed Glycine 0 N--CA 1.437 -1.253 0 C-N-CA 120.89 -0.671 . . . . 0.0 111.759 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.9 t -63.31 144.23 57.12 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 178.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm -104.9 -21.58 13.29 Favored 'General case' 0 C--N 1.317 -0.848 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -175.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 25.7 p -98.12 -41.69 7.81 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.75 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.93 -2.38 19.54 Favored Glycine 0 N--CA 1.443 -0.893 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.094 -178.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.598 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 30.4 mmmt -79.65 -3.33 46.77 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.691 0.281 . . . . 0.0 110.405 178.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 70.16 17.06 7.3 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.513 176.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.55 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 3.4 p -69.5 -37.5 77.24 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.798 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.439 ' HG1' ' C ' ' A' ' 52' ' ' CYS . 44.1 p 52.09 37.39 21.39 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.715 0.806 . . . . 0.0 112.797 177.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 134.44 159.59 8.88 Favored Glycine 0 N--CA 1.439 -1.129 0 C-N-CA 120.148 -1.025 . . . . 0.0 112.296 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.26 -25.52 76.79 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.968 2.445 . . . . 0.0 112.798 -178.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -62.01 -40.08 94.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.692 -178.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 40.2 m -115.53 18.35 15.95 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 121.035 0.445 . . . . 0.0 110.626 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.55 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 48.6 t -79.06 120.77 24.1 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.21 0.529 . . . . 0.0 111.067 -178.645 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -108.49 7.48 26.88 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.81 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.598 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 26.5 m -80.77 142.75 33.46 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.656 178.386 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -127.2 82.37 0.35 Allowed Glycine 0 C--N 1.311 -0.842 0 C-N-CA 120.925 -0.655 . . . . 0.0 111.771 -178.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 52.0 m 62.99 171.99 0.15 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.722 0.409 . . . . 0.0 110.992 -178.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 31.6 m 62.81 3.53 1.21 Allowed 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 176.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 33.1 t -101.74 167.26 10.21 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 122.032 -0.417 . . . . 0.0 110.376 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.9 t -68.46 -27.84 66.51 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.748 -177.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 25.6 p -82.55 -0.86 48.73 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.138 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.407 ' HD3' ' O ' ' A' ' 38' ' ' THR . 70.8 mmtt . . . . . 0 C--O 1.263 1.814 0 CA-C-O 117.676 -1.154 . . . . 0.0 110.786 -178.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.8 mptt . . . . . 0 N--CA 1.446 -0.659 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.504 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 85.9 m -88.5 139.1 30.82 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.016 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' THR . . . . . 0.409 ' OG1' ' HB2' ' A' ' 26' ' ' GLN . 73.4 p -89.42 -177.62 5.39 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.396 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 11.3 m -64.13 -22.77 67.07 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.064 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.86 -49.39 58.73 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 120.837 0.351 . . . . 0.0 110.737 179.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 36.3 t -73.48 -31.16 63.6 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.002 0.43 . . . . 0.0 110.536 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.553 ' HA ' ' NE ' ' A' ' 15' ' ' ARG . 1.7 mmp_? -74.17 -11.39 60.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.857 179.252 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.9 t -82.11 165.27 20.71 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.439 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 8.0 pt-20 -126.37 115.08 23.36 Favored Pre-proline 0 C--N 1.316 -0.85 0 CA-C-O 120.81 0.338 . . . . 0.0 110.997 -179.294 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.439 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 1.8 Cg_endo -81.27 -174.07 13.4 Favored 'Cis proline' 0 C--N 1.348 0.514 0 C-N-CA 123.58 -1.425 . . . . 0.0 111.722 -0.163 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.5 m -56.63 126.56 27.25 Favored 'General case' 0 CA--C 1.504 -0.814 0 CA-C-O 121.644 0.735 . . . . 0.0 112.55 -178.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -101.92 12.82 36.33 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.738 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 15.1 m -60.99 -28.77 69.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.269 177.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 59.58 -112.6 4.45 Favored Glycine 0 C--N 1.34 0.791 0 CA-C-N 115.74 -0.663 . . . . 0.0 112.028 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 70.3 m -121.43 17.75 11.35 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.147 0.498 . . . . 0.0 110.211 177.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -102.31 -45.83 4.99 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.836 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 55.9 90.94 0.03 OUTLIER 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.608 0.718 . . . . 0.0 110.601 -176.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.409 ' HB2' ' OG1' ' A' ' 11' ' ' THR . 49.4 mt-30 -92.9 -6.08 49.44 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.298 -174.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.504 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 26.3 p -88.27 174.06 8.41 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-O 121.101 0.477 . . . . 0.0 111.501 -177.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -118.12 -134.29 5.05 Favored Glycine 0 N--CA 1.443 -0.892 0 C-N-CA 120.936 -0.649 . . . . 0.0 113.242 -179.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -74.25 176.8 6.31 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 123.189 0.595 . . . . 0.0 112.027 -177.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 62.46 31.7 80.49 Favored Glycine 0 CA--C 1.502 -0.76 0 CA-C-N 115.283 -0.871 . . . . 0.0 112.158 178.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 49.3 t -124.9 -76.7 0.59 Allowed 'General case' 0 N--CA 1.423 -1.823 0 C-N-CA 120.651 -0.419 . . . . 0.0 111.909 -177.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 75.1 p 48.73 41.12 17.42 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.548 0.689 . . . . 0.0 110.906 -178.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -54.48 157.41 2.88 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 114.753 -1.112 . . . . 0.0 112.445 -178.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -95.57 21.03 8.75 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.341 0.591 . . . . 0.0 110.386 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -131.55 -63.81 0.82 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.371 -179.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 27.4 p -82.91 -45.2 14.49 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.705 -0.679 . . . . 0.0 112.16 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.0 ttmt -118.79 50.94 1.15 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.192 0.52 . . . . 0.0 112.162 -170.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.7 t -97.62 162.66 13.18 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.707 179.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . 0.428 ' SG ' ' HB2' ' A' ' 41' ' ' CYS . 51.6 t -94.96 140.56 29.78 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -99.64 0.61 42.4 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.837 -179.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.428 ' HB2' ' SG ' ' A' ' 39' ' ' CYS . 62.1 m -82.93 141.09 32.42 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.727 177.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 59.3 p -100.39 164.89 11.72 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 -178.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.435 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 7.9 m -69.55 -9.68 54.97 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 121.299 0.571 . . . . 0.0 110.539 178.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -99.44 -32.77 10.97 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.005 179.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -150.2 128.42 2.67 Favored Glycine 0 N--CA 1.438 -1.187 0 C-N-CA 120.289 -0.958 . . . . 0.0 112.843 -177.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.0 t -80.57 133.73 35.82 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -98.84 -24.78 14.86 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -176.005 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 23.2 p -93.43 -35.41 13.0 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.221 -0.592 . . . . 0.0 110.579 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 110.37 -2.24 29.51 Favored Glycine 0 N--CA 1.438 -1.204 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.932 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -78.4 -7.16 57.04 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.034 0.445 . . . . 0.0 110.47 179.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 64.16 33.6 11.72 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.173 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.448 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 3.1 p -75.1 -49.12 20.69 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.139 178.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.435 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 53.4 p 50.45 76.27 0.15 Allowed 'General case' 0 C--O 1.237 0.423 0 C-N-CA 123.941 0.896 . . . . 0.0 112.432 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 113.84 138.92 7.06 Favored Glycine 0 N--CA 1.436 -1.324 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.714 179.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.437 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 21.8 Cg_endo -62.12 -27.98 79.43 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.783 2.322 . . . . 0.0 112.524 -178.318 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -62.84 -39.51 94.58 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.106 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.4 m -107.05 24.23 13.14 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.487 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.448 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 0.5 OUTLIER -76.04 131.42 39.49 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.772 -178.272 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -106.73 3.77 26.98 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.219 0.533 . . . . 0.0 109.607 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 4.3 m -96.24 167.3 11.28 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.877 -175.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -98.59 -106.63 2.62 Favored Glycine 0 N--CA 1.442 -0.959 0 CA-C-N 115.815 -0.63 . . . . 0.0 112.222 179.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.9 m -131.43 -12.74 3.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.73 0.3 . . . . 0.0 111.591 -178.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 17.4 m -103.0 20.51 17.43 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -175.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 38.2 t -96.75 165.69 12.0 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.838 0.351 . . . . 0.0 110.963 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.6 m -64.18 -25.32 68.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.291 -178.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.502 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 26.7 p -89.84 13.53 14.26 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.725 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.502 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 39.5 mmtm . . . . . 0 C--O 1.264 1.822 0 CA-C-O 117.875 -1.059 . . . . 0.0 110.437 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 47.8 mtmt . . . . . 0 CA--C 1.511 -0.55 0 CA-C-O 121.36 0.6 . . . . 0.0 110.511 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.515 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 78.1 m -80.53 134.9 36.01 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.682 178.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 61.2 p -80.87 177.32 9.12 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.126 -178.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.9 p -58.15 -37.16 74.15 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.211 178.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.02 -47.53 82.7 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.862 0.363 . . . . 0.0 110.839 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 47.4 t -68.13 -38.61 82.38 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.163 0.506 . . . . 0.0 110.406 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 29.3 ttt180 -73.05 -9.36 58.65 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.874 -179.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.2 m -71.99 164.57 25.88 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 122.107 -0.37 . . . . 0.0 110.594 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.402 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -125.23 114.08 25.99 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.654 178.442 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.73 174.34 53.36 Favored 'Cis proline' 0 C--O 1.237 0.438 0 C-N-CA 123.394 -1.503 . . . . 0.0 112.066 -1.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.57 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 49.6 t -57.9 132.88 54.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.228 -178.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 79.5 mm-40 -117.59 17.35 14.47 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.958 -179.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.663 ' SG ' ' HA ' ' A' ' 25' ' ' CYS . 3.8 t -60.11 -29.23 68.47 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.966 -179.588 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 81.13 -153.1 33.58 Favored Glycine 0 N--CA 1.431 -1.66 0 CA-C-N 115.463 -0.79 . . . . 0.0 112.195 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.5 m -107.33 11.82 28.73 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -102.53 -30.58 10.89 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.862 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.663 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 1.1 m 65.59 103.78 0.04 OUTLIER 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.568 0.699 . . . . 0.0 112.799 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -95.48 -5.57 42.63 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 115.38 -0.827 . . . . 0.0 108.861 176.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.515 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 22.8 p -92.89 160.12 15.05 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.184 -178.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -79.96 162.15 46.35 Favored Glycine 0 N--CA 1.44 -1.049 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 174.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.24 163.04 23.69 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 117.529 0.664 . . . . 0.0 111.307 -178.283 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 98.19 0.88 58.31 Favored Glycine 0 N--CA 1.439 -1.151 0 N-CA-C 110.311 -1.116 . . . . 0.0 110.311 -175.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 43.2 t -75.46 142.19 42.99 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 75.7 p -103.8 14.18 31.45 Favored 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -175.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.7 m -67.33 133.03 48.86 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.032 175.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -99.69 12.91 35.35 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.645 0.736 . . . . 0.0 109.035 177.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.8 -57.01 2.12 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.403 -178.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.581 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 28.4 p -82.6 -43.62 16.79 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.746 177.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.2 ttpm? -101.8 81.15 2.1 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.519 178.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.3 t -121.73 155.41 35.3 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 -179.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . 0.409 ' SG ' ' HB2' ' A' ' 41' ' ' CYS . 53.6 t -92.83 135.05 34.48 Favored 'General case' 0 N--CA 1.444 -0.725 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.044 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -92.85 1.34 57.34 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 121.1 0.476 . . . . 0.0 110.881 -178.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.507 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 56.3 m -88.81 133.7 34.17 Favored 'General case' 0 N--CA 1.437 -1.12 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.338 179.197 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 1.6 t -108.69 164.77 12.08 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.337 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.527 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 44.4 m -70.58 -9.88 57.94 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.707 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -88.33 -19.69 26.35 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.432 177.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -179.65 131.11 1.61 Allowed Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.058 -179.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.6 t -76.9 147.84 36.78 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -109.71 -30.89 7.66 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 112.324 0.491 . . . . 0.0 112.324 -177.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.514 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 29.1 p -87.89 -34.18 18.26 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.188 -0.605 . . . . 0.0 111.397 -177.574 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.28 -1.38 31.14 Favored Glycine 0 N--CA 1.445 -0.765 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.507 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.551 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 75.1 mmtt -80.58 -8.64 59.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.029 0.442 . . . . 0.0 109.902 178.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 67.82 30.87 6.08 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.062 -0.972 . . . . 0.0 111.144 178.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.412 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.6 p -72.66 -44.05 62.36 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.157 177.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.527 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 77.7 p 50.78 41.0 25.83 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.72 0.808 . . . . 0.0 112.859 177.146 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 147.4 136.38 2.8 Favored Glycine 0 N--CA 1.437 -1.276 0 C-N-CA 120.384 -0.912 . . . . 0.0 111.731 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -57.2 -24.6 59.97 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.122 2.548 . . . . 0.0 113.621 -178.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -74.22 -35.86 63.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.923 0.392 . . . . 0.0 111.197 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 37.0 t -101.2 10.92 40.29 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.524 0.678 . . . . 0.0 109.746 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.412 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 13.8 t -79.87 110.27 15.07 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.69 -178.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -108.24 -6.95 16.11 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.725 -177.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.551 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.8 p -85.36 157.92 20.4 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.157 -0.617 . . . . 0.0 111.707 -179.165 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -64.6 175.34 12.41 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 115.234 0.854 . . . . 0.0 115.234 -174.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.487 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 14.2 m -77.94 -10.63 59.68 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 123.697 0.799 . . . . 0.0 111.121 -178.698 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.7 m -93.95 9.81 35.95 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.96 0.41 . . . . 0.0 110.676 179.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 44.2 t -81.35 169.63 17.01 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.205 -178.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.8 t -69.97 -24.76 63.37 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.956 -177.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.507 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 22.0 p -82.5 -3.87 56.57 Favored 'General case' 0 CA--C 1.512 -0.515 0 C-N-CA 120.466 -0.493 . . . . 0.0 110.815 -179.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.487 ' HG3' ' HA ' ' A' ' 62' ' ' SER . 38.5 mmtm . . . . . 0 C--O 1.26 1.657 0 CA-C-O 117.533 -1.222 . . . . 0.0 110.449 -177.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.9 mptt . . . . . 0 CA--C 1.503 -0.854 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.633 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 80.9 m -64.23 150.62 45.52 Favored 'General case' 0 N--CA 1.431 -1.408 0 CA-C-N 114.621 -1.172 . . . . 0.0 112.885 -176.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 65.2 p -109.76 -174.1 2.41 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.116 -179.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.9 t -67.19 -30.05 69.89 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.673 0.273 . . . . 0.0 110.809 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.87 -49.03 79.11 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 120.751 0.31 . . . . 0.0 110.667 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 42.6 t -64.07 -38.81 92.42 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.151 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 26.6 mtp180 -80.55 18.54 0.92 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.3 m -106.06 159.83 15.77 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 173.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -120.09 115.77 32.95 Favored Pre-proline 0 C--N 1.321 -0.661 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.633 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -77.61 169.2 74.37 Favored 'Cis proline' 0 C--N 1.346 0.41 0 C-N-CA 123.115 -1.619 . . . . 0.0 111.033 -2.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 74.6 m -54.02 122.33 9.91 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.088 0.471 . . . . 0.0 110.646 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 32.3 mm-40 -88.89 16.78 6.39 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.987 -175.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.485 ' HB3' ' HA ' ' A' ' 25' ' ' CYS . 2.3 m -64.53 -29.73 70.76 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.953 178.343 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 62.97 -138.86 44.35 Favored Glycine 0 N--CA 1.444 -0.802 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.838 -179.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.6 m -98.86 12.01 37.05 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 121.028 0.442 . . . . 0.0 110.233 178.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -97.51 -53.18 3.52 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.638 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 0.1 OUTLIER 64.84 99.36 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.916 -1.038 . . . . 0.0 112.355 178.23 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -90.65 -14.3 32.57 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.666 -178.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.633 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 31.6 p -87.68 -175.1 5.06 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.029 0.443 . . . . 0.0 111.698 -177.078 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.23 -110.01 0.6 Allowed Glycine 0 N--CA 1.442 -0.915 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.43 179.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -160.77 0.0 0.06 Allowed 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -176.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -86.76 -6.96 79.17 Favored Glycine 0 C--N 1.301 -1.377 0 C-N-CA 121.077 -0.583 . . . . 0.0 113.719 -175.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.513 ' SG ' ' HE2' ' A' ' 37' ' ' LYS . 3.8 p -75.71 -29.67 59.03 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 120.837 0.351 . . . . 0.0 110.917 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 63.6 p 50.06 42.12 24.4 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.492 0.717 . . . . 0.0 112.251 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.436 ' SG ' ' HB2' ' A' ' 31' ' ' CYS . 58.3 m -66.62 177.31 1.62 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.881 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -111.7 -0.27 16.07 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 121.243 0.544 . . . . 0.0 110.222 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.49 -67.23 0.88 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.569 -178.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.638 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 7.9 p -85.05 -13.45 50.37 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.222 0.534 . . . . 0.0 110.942 179.528 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.584 ' NZ ' ' SG ' ' A' ' 27' ' ' CYS . 11.2 mptt -105.71 45.19 0.98 Allowed 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 121.585 0.707 . . . . 0.0 110.982 178.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 8.8 t -91.31 128.44 37.14 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.595 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.9 t -92.27 135.28 34.14 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -89.06 -6.57 57.02 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-O 121.143 0.497 . . . . 0.0 110.704 -178.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.529 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 36.8 m -81.43 133.24 35.38 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.658 178.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 74.9 p -109.42 170.73 7.87 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.161 -177.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.9 m -71.75 -9.93 59.02 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.164 0.506 . . . . 0.0 110.403 178.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -80.43 -40.36 26.49 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.968 178.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -169.18 139.39 5.6 Favored Glycine 0 N--CA 1.437 -1.287 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.767 -179.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 19.1 t -79.97 129.75 34.74 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 120.702 0.287 . . . . 0.0 110.431 179.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -87.99 -39.7 14.48 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.473 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 16.6 p -78.01 -33.13 51.33 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 119.97 -0.692 . . . . 0.0 110.264 -178.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 104.72 0.22 42.55 Favored Glycine 0 N--CA 1.438 -1.192 0 C-N-CA 120.79 -0.719 . . . . 0.0 113.262 177.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.473 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 28.5 mmtp -82.4 -1.69 50.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 117.15 0.475 . . . . 0.0 110.991 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 68.88 23.07 6.91 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.44 176.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.8 p -70.74 -47.2 60.93 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.919 177.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 47.6 p 51.43 31.63 7.58 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.876 0.87 . . . . 0.0 112.864 177.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 159.16 145.84 4.37 Favored Glycine 0 N--CA 1.436 -1.343 0 C-N-CA 120.534 -0.841 . . . . 0.0 111.897 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.56 -30.87 51.53 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.903 2.402 . . . . 0.0 113.302 -177.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -76.16 -17.67 59.45 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.287 0.565 . . . . 0.0 110.485 -178.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.8 m -117.17 18.52 14.51 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.095 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -73.11 130.26 39.89 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.645 -178.523 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.44 ' HB3' ' HZ1' ' A' ' 59' ' ' LYS . 1.0 OUTLIER -113.65 6.4 16.9 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.616 -177.905 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -122.9 159.07 29.0 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.754 -177.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -77.33 -164.82 22.88 Favored Glycine 0 C--N 1.332 0.327 0 CA-C-N 115.983 -0.553 . . . . 0.0 113.761 -177.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.463 ' OG ' ' HE3' ' A' ' 37' ' ' LYS . 4.0 m -85.7 -10.39 55.73 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 122.923 0.489 . . . . 0.0 111.753 -176.644 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.0 m -89.2 13.08 14.12 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.147 0.499 . . . . 0.0 110.353 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 11.5 t -90.68 170.06 10.46 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.355 -178.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.9 p -76.31 -16.18 59.83 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -176.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.552 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 21.6 p -87.15 2.66 49.2 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.988 0.423 . . . . 0.0 110.723 178.497 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.552 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 11.3 mmtp . . . . . 0 C--O 1.265 1.884 0 CA-C-O 117.686 -1.15 . . . . 0.0 110.91 -176.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt . . . . . 0 C--O 1.233 0.223 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.692 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 93.6 m -82.09 143.66 31.33 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-O 121.191 0.52 . . . . 0.0 111.522 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 67.1 p -93.52 -179.28 4.98 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.348 -179.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.9 m -66.38 -21.39 66.23 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.959 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.57 -45.95 67.5 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-O 120.829 0.347 . . . . 0.0 111.042 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.412 ' HB2' ' HB3' ' A' ' 27' ' ' CYS . 22.6 t -68.1 -31.49 71.13 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.233 0.539 . . . . 0.0 110.226 -179.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 31.5 mmt180 -90.57 9.57 28.97 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.007 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.1 t -83.76 169.55 15.1 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.459 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 33.5 mm-40 -119.34 105.69 43.85 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.713 -0.222 . . . . 0.0 111.083 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.459 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 1.6 Cg_endo -83.85 -173.33 10.72 Favored 'Cis proline' 0 N--CA 1.456 -0.685 0 C-N-CA 123.888 -1.297 . . . . 0.0 111.314 -1.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 15.1 t -56.42 123.3 14.25 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.015 0.436 . . . . 0.0 110.54 -178.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -108.75 20.59 18.31 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.717 -176.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.67 -35.74 77.01 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 120.78 0.324 . . . . 0.0 111.205 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.26 -169.97 54.67 Favored Glycine 0 N--CA 1.44 -1.049 0 C-N-CA 121.131 -0.557 . . . . 0.0 112.83 178.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 24.5 m -77.53 -11.82 59.9 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.688 0.28 . . . . 0.0 111.301 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -86.55 -31.74 21.07 Favored 'General case' 0 CA--C 1.507 -0.688 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.0 t 66.54 105.83 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.805 -176.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -110.4 28.49 8.59 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.818 -173.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.565 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 9.1 p -124.25 -164.81 1.29 Allowed 'General case' 0 C--N 1.312 -1.062 0 CA-C-O 120.665 0.269 . . . . 0.0 110.555 178.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -114.25 153.95 17.28 Favored Glycine 0 N--CA 1.442 -0.91 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -79.09 84.07 5.11 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.489 0.662 . . . . 0.0 111.269 -176.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -168.82 23.89 0.1 Allowed Glycine 0 C--N 1.301 -1.373 0 N-CA-C 110.634 -0.986 . . . . 0.0 110.634 177.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.701 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 28.6 p -112.95 -21.29 11.19 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.682 -0.259 . . . . 0.0 111.572 -177.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 38.4 p 49.08 39.14 14.39 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.464 0.649 . . . . 0.0 109.951 -173.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.701 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 1.8 t -66.73 149.91 49.85 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.555 -176.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -104.52 22.61 14.67 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.148 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -126.17 -58.17 1.37 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.069 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 7.8 p -83.74 -44.45 14.42 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.318 0.58 . . . . 0.0 110.034 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -86.24 82.79 7.9 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.148 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.444 ' O ' ' HD3' ' A' ' 67' ' ' LYS . 14.1 t -142.88 174.28 10.8 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.83 -179.412 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . 0.501 ' SG ' ' HB2' ' A' ' 66' ' ' CYS . 48.7 t -114.01 145.19 41.9 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.1 0.476 . . . . 0.0 110.939 -178.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -102.26 -4.79 25.14 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.87 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.607 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 61.7 m -77.98 151.07 33.81 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.798 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 63.2 p -121.23 169.47 10.53 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.453 -178.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.47 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 14.4 m -68.97 -27.07 65.39 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.172 0.51 . . . . 0.0 110.574 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -81.17 -34.4 32.4 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.28 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -153.84 131.86 3.38 Favored Glycine 0 N--CA 1.436 -1.304 0 C-N-CA 120.323 -0.942 . . . . 0.0 112.511 -177.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 4.4 t -86.27 135.86 33.38 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -93.47 -28.02 16.35 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -176.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 21.7 p -92.97 -30.68 15.23 Favored 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.829 -178.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.5 9.6 52.65 Favored Glycine 0 N--CA 1.444 -0.831 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.883 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -90.64 -4.6 56.68 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.956 0.407 . . . . 0.0 110.303 178.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 65.67 26.55 11.46 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.213 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.554 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 4.4 p -66.82 -46.94 73.59 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 176.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.47 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 52.0 p 50.78 72.79 0.32 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 114.915 -1.038 . . . . 0.0 113.184 176.051 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 111.96 140.26 8.0 Favored Glycine 0 N--CA 1.444 -0.816 0 C-N-CA 120.713 -0.756 . . . . 0.0 111.876 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.71 -29.61 86.2 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.103 2.536 . . . . 0.0 112.846 -177.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -64.16 -39.23 93.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.979 0.419 . . . . 0.0 111.229 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.6 t -106.16 17.34 23.66 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.288 0.565 . . . . 0.0 109.941 -179.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.554 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 19.3 t -86.64 111.01 20.24 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.124 -178.481 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -106.3 -2.5 22.24 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.716 -177.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.9 m -71.72 154.63 41.21 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.636 -179.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . 0.526 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -74.53 -179.56 41.92 Favored Glycine 0 N--CA 1.443 -0.875 0 C-N-CA 120.477 -0.868 . . . . 0.0 111.258 176.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.6 m -80.31 4.28 18.3 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.893 0.377 . . . . 0.0 111.88 -178.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.0 m -109.98 12.7 23.62 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.917 0.389 . . . . 0.0 110.587 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 22.2 t -86.59 166.88 15.06 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.559 -178.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.5 m -62.62 -26.52 68.66 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -177.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.607 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 6.1 p -81.18 -6.71 59.15 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.779 0.323 . . . . 0.0 111.8 -178.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.526 ' HG3' ' O ' ' A' ' 61' ' ' GLY . 13.2 mmtp . . . . . 0 C--O 1.261 1.659 0 CA-C-O 117.955 -1.021 . . . . 0.0 111.326 -177.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? . . . . . 0 CA--C 1.514 -0.416 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.577 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 88.5 m -57.82 139.81 53.23 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.481 -0.782 . . . . 0.0 111.217 178.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.8 p -80.69 174.22 11.83 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.793 -178.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.8 p -61.84 -28.55 69.57 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.126 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.85 -43.45 75.44 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.547 179.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.743 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 18.3 t -69.97 -36.33 75.14 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.033 -178.213 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.9 ttt180 -79.84 -9.24 59.64 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.437 -177.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.9 t -80.16 161.86 25.02 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.552 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 9.4 pt-20 -136.31 123.77 14.58 Favored Pre-proline 0 C--N 1.316 -0.886 0 CA-C-O 120.784 0.326 . . . . 0.0 111.437 -179.408 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.552 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 40.6 Cg_endo -64.36 157.9 71.89 Favored 'Cis proline' 0 C--N 1.348 0.525 0 C-N-CA 123.158 -1.601 . . . . 0.0 112.038 0.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.648 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 44.4 t -60.9 130.36 46.06 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.948 -177.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 78.3 mm-40 -101.94 13.75 33.9 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.897 -177.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.743 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -70.45 -16.49 62.94 Favored 'General case' 0 C--O 1.209 -1.043 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.057 -179.314 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.79 -30.26 56.3 Favored Glycine 0 CA--C 1.525 0.664 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.69 -179.243 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 53.1 p -64.64 -48.5 74.61 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -130.49 -46.18 1.08 Allowed 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 120.664 0.269 . . . . 0.0 111.384 -178.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.626 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 8.3 t 64.06 82.29 0.19 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.362 -179.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -117.51 20.07 13.7 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.491 -177.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.574 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 24.5 p -75.46 163.06 27.79 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.042 178.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -103.12 25.25 27.85 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.183 -1.008 . . . . 0.0 111.549 177.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.421 ' CD ' ' H ' ' A' ' 30' ' ' GLY . 0.0 OUTLIER 66.14 -175.19 0.19 Allowed 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.337 0.655 . . . . 0.0 110.444 -177.676 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.421 ' H ' ' CD ' ' A' ' 29' ' ' GLU . . . 87.28 10.29 71.44 Favored Glycine 0 N--CA 1.434 -1.442 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 -176.371 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.577 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 7.3 p -100.49 -26.45 13.85 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 114.651 -0.775 . . . . 0.0 109.685 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.413 ' HG1' ' C ' ' A' ' 31' ' ' CYS . 46.6 p 53.06 36.43 22.18 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.945 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 62.6 m -66.14 167.34 10.22 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.701 179.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -117.91 11.87 13.59 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.316 -0.857 . . . . 0.0 108.841 176.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -110.68 -67.74 0.97 Allowed 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.467 -178.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.626 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 28.2 p -77.91 -44.62 26.43 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-O 121.368 0.604 . . . . 0.0 109.443 178.677 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 58.4 tttp -84.17 108.64 17.19 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.098 178.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.0 t -179.26 164.16 1.34 Allowed 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 178.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.6 t -96.21 143.69 27.08 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -103.17 5.44 37.78 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.892 0.377 . . . . 0.0 111.48 -177.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.433 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 60.9 m -85.61 146.7 26.75 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.014 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 60.2 p -120.66 161.52 21.24 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.485 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 35.4 m -63.03 -27.76 69.63 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.091 0.472 . . . . 0.0 110.413 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.93 -36.01 79.42 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.952 178.433 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -164.01 128.98 1.91 Allowed Glycine 0 N--CA 1.437 -1.27 0 C-N-CA 120.351 -0.928 . . . . 0.0 112.73 -179.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 6.8 t -79.18 124.41 28.32 Favored 'General case' 0 N--CA 1.439 -1.005 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.428 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 33.4 mmtp -76.35 -42.82 43.48 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.719 -176.09 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 19.8 p -84.21 -38.3 20.76 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 120.901 0.381 . . . . 0.0 110.749 -177.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.12 3.44 27.88 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.819 -0.705 . . . . 0.0 113.107 179.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.636 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 73.5 mmtt -81.55 -3.9 54.52 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.981 0.391 . . . . 0.0 111.008 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 65.34 24.98 12.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.962 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.485 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.3 p -71.7 -47.63 52.75 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 176.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.485 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 82.5 p 51.94 28.92 5.56 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 115.135 -0.939 . . . . 0.0 113.472 175.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 164.09 140.77 2.95 Favored Glycine 0 N--CA 1.436 -1.325 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -56.36 -37.31 97.24 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.976 2.451 . . . . 0.0 113.532 -177.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -67.4 -40.88 85.66 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.848 0.356 . . . . 0.0 111.019 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 40.7 m -94.37 15.34 17.86 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.601 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.485 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 24.5 t -85.4 135.07 34.03 Favored 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.15 -179.082 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -113.15 -6.28 13.66 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.218 -179.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.636 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 13.9 m -77.52 157.51 30.36 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.836 -178.185 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -86.05 -108.99 0.76 Allowed Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.377 -179.024 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.2 m -135.16 -2.39 2.54 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 120.543 0.211 . . . . 0.0 111.414 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 18.6 m -106.27 5.11 29.47 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.941 0.401 . . . . 0.0 111.457 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 29.9 t -82.8 167.0 18.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.333 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.7 t -70.61 -16.33 62.83 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.798 -177.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.433 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 24.7 p -88.72 2.11 53.95 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.366 -0.533 . . . . 0.0 111.322 179.396 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 25.2 mmtp . . . . . 0 C--O 1.261 1.704 0 CA-C-O 117.67 -1.157 . . . . 0.0 110.866 -179.107 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt . . . . . 0 N--CA 1.468 0.468 0 CA-C-O 121.044 0.449 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.569 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 91.5 m -85.65 152.87 22.76 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-O 121.371 0.605 . . . . 0.0 111.838 -179.591 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 81.3 p -92.02 176.27 6.57 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.81 -177.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.9 m -67.16 -21.73 65.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.148 0.499 . . . . 0.0 110.079 178.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.0 -47.56 36.26 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.32 178.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.632 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 10.2 t -66.44 -33.56 75.97 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.382 0.611 . . . . 0.0 109.667 179.478 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.7 mmt180 -91.22 21.27 4.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.844 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.6 t -94.45 -178.55 4.61 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 178.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -131.09 101.93 16.18 Favored Pre-proline 0 CA--C 1.543 0.687 0 CA-C-O 120.709 0.29 . . . . 0.0 111.292 -178.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -81.41 -174.94 14.79 Favored 'Cis proline' 0 N--CA 1.461 -0.416 0 C-N-CA 123.625 -1.406 . . . . 0.0 111.072 -0.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.714 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 48.6 t -59.49 127.9 34.35 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.038 0.447 . . . . 0.0 110.829 -179.653 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -112.04 17.62 19.46 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 -179.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.714 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 0.5 OUTLIER -64.86 -23.15 67.15 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.348 -177.341 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.71 -12.04 9.18 Favored Glycine 0 CA--C 1.528 0.883 0 C-N-CA 121.303 -0.475 . . . . 0.0 113.723 -177.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.4 m -68.6 -35.58 77.53 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 122.727 -0.278 . . . . 0.0 110.992 179.078 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 69.3 mttm -146.19 -43.28 0.2 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 122.899 0.48 . . . . 0.0 110.323 178.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.659 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 10.5 t 67.24 74.12 0.32 Allowed 'General case' 0 CA--C 1.504 -0.8 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.051 -179.133 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -104.82 10.55 34.44 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 114.572 -1.195 . . . . 0.0 110.84 -175.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.538 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 21.0 p -75.75 -178.71 4.36 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.155 0.502 . . . . 0.0 111.072 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.92 -141.36 10.57 Favored Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 115.789 -0.642 . . . . 0.0 111.915 177.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.44 ' HA ' ' HE2' ' A' ' 37' ' ' LYS . 8.2 mp0 -123.77 13.65 9.28 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.168 0.508 . . . . 0.0 110.734 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -84.48 -30.79 26.43 Favored Glycine 0 C--N 1.306 -1.112 0 C-N-CA 120.819 -0.705 . . . . 0.0 113.183 -177.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.772 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 20.3 p -67.96 -34.13 75.97 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -176.288 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 58.9 p 53.1 33.7 15.64 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.8 0.809 . . . . 0.0 109.994 -173.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.772 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -62.56 117.04 5.68 Favored 'General case' 0 C--O 1.222 -0.365 0 CA-C-N 114.276 -1.329 . . . . 0.0 110.37 -178.655 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -86.11 20.25 2.37 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.385 0.612 . . . . 0.0 110.831 -177.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -109.42 -48.92 3.17 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.029 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.572 ' SG ' ' HG3' ' A' ' 37' ' ' LYS . 26.2 p -94.24 -41.5 9.44 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.569 177.673 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.572 ' HG3' ' SG ' ' A' ' 36' ' ' CYS . 26.3 mtpp -99.26 88.86 4.03 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.837 -178.508 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 12.3 t -144.83 172.2 13.35 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.738 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . 0.476 ' HA ' ' O ' ' A' ' 66' ' ' CYS . 35.8 t -92.17 133.9 35.36 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -83.9 -17.7 39.89 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.155 0.502 . . . . 0.0 110.224 -177.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.404 ' HB3' ' HA ' ' A' ' 46' ' ' CYS . 37.4 m -69.57 136.34 51.17 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.001 -176.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 82.3 p -99.64 166.26 11.21 Favored 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 178.106 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.455 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 46.9 m -64.03 -26.79 68.72 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.922 0.392 . . . . 0.0 111.8 -178.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -88.47 -30.7 19.2 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.717 -179.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -143.34 119.29 1.32 Allowed Glycine 0 N--CA 1.445 -0.753 0 C-N-CA 119.784 -1.198 . . . . 0.0 113.697 -175.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.404 ' HA ' ' HB3' ' A' ' 41' ' ' CYS . 17.5 t -78.07 126.99 31.62 Favored 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 177.419 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.468 ' HZ2' ' HB3' ' A' ' 47' ' ' LYS . 3.2 mmmp? -82.05 -36.57 27.56 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -176.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.487 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 21.5 p -91.95 -37.93 12.56 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.897 -177.474 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.2 11.36 13.74 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 120.739 -0.743 . . . . 0.0 113.816 178.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.744 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 32.4 mmtp -88.23 -3.2 58.9 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 117.331 0.565 . . . . 0.0 110.985 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 65.61 17.49 10.92 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.139 -177.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.541 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.2 p -64.57 -47.29 79.26 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 177.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.461 ' HG1' ' C ' ' A' ' 52' ' ' CYS . 53.2 p 49.88 44.54 25.23 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.189 -0.914 . . . . 0.0 113.063 174.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.412 ' O ' ' HB2' ' A' ' 58' ' ' CYS . . . 135.1 150.28 6.02 Favored Glycine 0 N--CA 1.438 -1.206 0 C-N-CA 120.624 -0.798 . . . . 0.0 111.587 179.738 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -61.81 -22.53 74.56 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.845 2.363 . . . . 0.0 112.559 -177.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -63.12 -52.56 62.07 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.645 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.1 m -104.12 20.73 17.74 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.788 -177.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.541 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 48.8 t -86.91 137.58 32.26 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-O 121.213 0.53 . . . . 0.0 111.229 -178.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -118.67 3.26 11.71 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.569 -179.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.744 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 5.5 m -91.15 117.43 29.61 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 -179.664 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -97.56 82.4 0.69 Allowed Glycine 0 C--N 1.303 -1.257 0 CA-C-N 115.517 -0.765 . . . . 0.0 112.578 -175.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.8 m 63.77 170.28 0.16 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.016 0.526 . . . . 0.0 111.386 -178.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.4 m 70.87 -25.16 0.17 Allowed 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 176.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 38.0 t -72.05 167.73 19.58 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 121.919 -0.488 . . . . 0.0 111.288 -176.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 32.3 t -62.59 -27.44 69.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.592 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.476 ' O ' ' HA ' ' A' ' 39' ' ' CYS . 32.1 p -85.87 8.44 20.16 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.018 179.56 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.436 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 1.0 OUTLIER . . . . . 0 C--O 1.262 1.727 0 CA-C-O 118.037 -0.982 . . . . 0.0 111.064 -178.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt . . . . . 0 CA--C 1.519 -0.246 0 CA-C-O 120.963 0.411 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.808 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 57.4 m -88.49 145.04 25.98 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-O 121.298 0.57 . . . . 0.0 112.27 -176.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.3 p -77.16 176.05 9.09 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.775 -178.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.8 m -62.45 -32.8 73.73 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.135 178.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.9 -52.22 64.97 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.271 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.658 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 43.5 t -67.15 -28.67 68.31 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.571 0.7 . . . . 0.0 110.81 -179.366 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.1 ttm180 -79.66 -5.13 54.49 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.371 -177.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.9 m -85.44 167.48 15.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.086 0.47 . . . . 0.0 111.924 -177.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -127.59 108.72 20.78 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.683 177.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -76.15 169.67 73.86 Favored 'Cis proline' 0 C--O 1.237 0.458 0 C-N-CA 123.457 -1.476 . . . . 0.0 112.157 0.055 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.658 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 41.7 t -61.03 140.36 57.86 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.004 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 -117.28 19.81 13.95 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.296 -177.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.535 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.1 OUTLIER -67.46 -31.25 71.29 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.981 0.419 . . . . 0.0 109.922 179.899 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 72.58 -168.03 53.18 Favored Glycine 0 N--CA 1.442 -0.924 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.633 178.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.8 p -80.22 -11.98 59.68 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.825 0.345 . . . . 0.0 110.675 178.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -77.51 -42.08 36.92 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 178.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 8.7 t 65.53 99.22 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.516 -1.22 . . . . 0.0 111.296 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -100.83 -0.8 36.32 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.375 -0.829 . . . . 0.0 112.513 -176.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.558 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 7.3 p -91.94 164.13 13.76 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 120.837 0.351 . . . . 0.0 111.677 -176.408 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -86.21 148.33 22.17 Favored Glycine 0 N--CA 1.441 -1.014 0 N-CA-C 109.101 -1.6 . . . . 0.0 109.101 172.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -77.72 89.57 3.99 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 117.769 0.785 . . . . 0.0 112.163 -174.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -158.17 25.25 0.4 Allowed Glycine 0 N--CA 1.435 -1.383 0 N-CA-C 110.022 -1.231 . . . . 0.0 110.022 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.808 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 26.2 p -115.12 -28.73 6.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.143 -0.528 . . . . 0.0 112.121 -175.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 57.4 p 54.27 29.07 10.07 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.4 0.619 . . . . 0.0 110.015 -171.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.582 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 2.1 t -57.64 140.25 51.62 Favored 'General case' 0 C--N 1.346 0.453 0 CA-C-N 114.744 -1.116 . . . . 0.0 110.273 -177.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -93.8 16.8 13.24 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 120.922 0.391 . . . . 0.0 111.171 -176.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -116.53 -57.02 2.23 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.561 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.535 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 6.1 p -89.41 -43.15 11.08 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.717 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -84.39 74.21 10.39 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 121.683 0.754 . . . . 0.0 109.825 178.097 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.9 t -125.77 149.74 48.32 Favored 'General case' 0 N--CA 1.431 -1.412 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.988 -179.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.1 t -100.58 128.99 46.46 Favored 'General case' 0 N--CA 1.442 -0.869 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 177.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -90.99 -1.52 57.81 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.487 -178.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.559 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 61.6 m -75.93 136.68 40.07 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.637 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 61.0 p -102.74 165.01 11.3 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.091 -178.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.1 m -71.23 -10.35 59.61 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.182 0.515 . . . . 0.0 110.356 177.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -89.86 -32.31 16.95 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.745 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -164.71 132.82 2.79 Favored Glycine 0 N--CA 1.435 -1.399 0 C-N-CA 120.796 -0.716 . . . . 0.0 111.991 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 4.7 t -72.73 136.37 45.51 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 179.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -95.97 -22.35 17.45 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 111.938 0.348 . . . . 0.0 111.938 -176.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.465 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 21.8 p -99.69 -39.97 8.0 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.499 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.65 3.62 25.24 Favored Glycine 0 N--CA 1.437 -1.258 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.948 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.465 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 46.3 mmtm -81.37 -6.04 58.5 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 120.964 0.411 . . . . 0.0 110.251 178.318 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 68.94 20.91 7.71 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.664 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.483 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 4.7 p -71.2 -41.57 70.11 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.418 178.756 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.1 p 52.93 29.48 7.89 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.857 0.863 . . . . 0.0 113.297 177.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 149.32 159.18 8.46 Favored Glycine 0 N--CA 1.44 -1.1 0 C-N-CA 119.887 -1.149 . . . . 0.0 112.838 178.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -69.64 -11.95 32.09 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 123.113 2.542 . . . . 0.0 112.779 -178.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -84.08 -10.07 58.11 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.029 0.442 . . . . 0.0 110.835 -178.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.8 m -142.58 26.36 1.77 Allowed 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.146 0.498 . . . . 0.0 110.112 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.483 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 0.5 OUTLIER -71.11 122.76 20.69 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.998 -177.919 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -100.05 4.28 44.59 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.936 -178.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.432 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.2 p -137.91 157.45 46.38 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.05 -174.353 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -150.15 171.89 30.05 Favored Glycine 0 N--CA 1.439 -1.101 0 C-N-CA 120.022 -1.085 . . . . 0.0 113.563 -178.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.5 m 63.53 -84.79 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 124.489 1.116 . . . . 0.0 113.855 177.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.2 m -117.4 66.33 0.73 Allowed 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -174.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 41.3 t -112.84 166.61 11.22 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 173.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.409 ' HB2' ' HA ' ' A' ' 48' ' ' CYS . 7.4 m -64.61 -9.39 19.05 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 122.719 0.407 . . . . 0.0 112.028 -177.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.559 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 25.0 p -104.62 -11.02 17.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.722 0.296 . . . . 0.0 111.227 177.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.477 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 3.5 mmpp? . . . . . 0 C--O 1.251 1.164 0 CA-C-O 117.317 -1.325 . . . . 0.0 110.156 -178.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 42.7 mtmt . . . . . 0 CA--C 1.515 -0.4 0 CA-C-O 121.251 0.548 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.456 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 85.6 m -98.68 130.91 45.19 Favored 'General case' 0 C--N 1.301 -1.503 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.003 178.065 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.6 p -76.35 178.09 6.79 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.085 0.469 . . . . 0.0 111.871 -176.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.468 ' HA ' ' HG2' ' A' ' 15' ' ' ARG . 16.6 m -57.37 -33.23 67.58 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.143 -179.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.5 -44.86 81.44 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.331 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.4 ' HB3' ' HB3' ' A' ' 10' ' ' CYS . 37.4 t -69.97 -34.49 73.46 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.096 0.474 . . . . 0.0 111.208 -177.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.468 ' HG2' ' HA ' ' A' ' 12' ' ' SER . 9.2 ptm85 -78.36 -6.81 56.24 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.519 -0.472 . . . . 0.0 111.475 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.3 m -79.5 153.43 29.58 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 179.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -126.41 119.75 23.29 Favored Pre-proline 0 C--N 1.312 -1.028 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.295 179.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -69.61 160.89 86.83 Favored 'Cis proline' 0 C--O 1.243 0.748 0 C-N-CA 123.438 -1.484 . . . . 0.0 111.966 -0.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -51.82 130.78 29.77 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.935 -177.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -105.52 8.7 33.49 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.602 -177.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.02 -35.89 79.91 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.846 0.355 . . . . 0.0 110.635 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 62.12 -135.83 45.8 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.792 178.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.0 m -100.18 -6.75 25.66 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 120.648 0.261 . . . . 0.0 111.061 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -79.03 -45.3 20.47 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 178.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER 58.47 91.96 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.643 177.314 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -88.74 -12.96 40.74 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.908 -175.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.456 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 30.6 p -79.07 159.67 27.44 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.513 -0.475 . . . . 0.0 111.548 -177.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -87.45 -155.4 28.28 Favored Glycine 0 N--CA 1.448 -0.527 0 CA-C-N 115.913 -0.585 . . . . 0.0 112.673 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -83.21 157.89 22.53 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.962 0.411 . . . . 0.0 111.15 -178.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 94.38 9.58 58.96 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.386 178.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.469 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 17.1 t -97.35 -61.64 1.37 Allowed 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.805 -179.401 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 81.6 p 49.41 39.09 15.64 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.239 0.616 . . . . 0.0 111.661 -177.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.469 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -54.73 147.73 14.2 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.723 178.921 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -85.58 28.44 0.76 Allowed 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.616 0.722 . . . . 0.0 110.205 -178.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -140.51 -61.06 0.51 Allowed 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.457 -179.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 20.7 p -88.27 -40.41 13.66 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -177.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.1 ttmt -116.75 53.99 0.87 Allowed 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.281 0.562 . . . . 0.0 111.741 -172.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.463 ' O ' ' HD3' ' A' ' 67' ' ' LYS . 13.9 t -121.5 179.32 4.48 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.772 178.512 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . 0.469 ' HA ' ' HZ2' ' A' ' 67' ' ' LYS . 35.1 t -93.52 156.89 16.48 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.2 0.524 . . . . 0.0 111.061 -178.578 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -117.33 0.18 12.16 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.481 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.446 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 69.1 m -80.6 149.48 29.87 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.118 179.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 68.0 p -118.87 168.52 10.69 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.346 -178.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.6 m -65.81 -25.73 67.36 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.221 0.534 . . . . 0.0 110.278 178.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -72.38 -36.24 68.67 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.361 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -166.65 135.47 3.69 Favored Glycine 0 N--CA 1.433 -1.535 0 C-N-CA 120.205 -0.997 . . . . 0.0 112.75 -178.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 5.1 t -77.6 124.64 28.19 Favored 'General case' 0 C--N 1.313 -1.02 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 177.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -84.35 -29.4 26.31 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -176.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.493 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 20.2 p -89.91 -39.88 12.74 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 120.191 -0.603 . . . . 0.0 110.273 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.99 0.34 30.14 Favored Glycine 0 N--CA 1.443 -0.877 0 C-N-CA 120.913 -0.66 . . . . 0.0 112.762 178.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.493 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 30.0 mmtp -81.31 -0.26 40.2 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.292 0.568 . . . . 0.0 110.188 179.43 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 64.41 36.57 8.86 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 114.647 -1.161 . . . . 0.0 112.131 176.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.472 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 0.8 OUTLIER -81.4 -46.61 14.38 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.088 176.271 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 48.2 p 52.94 34.65 17.28 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 177.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.469 ' O ' ' HB2' ' A' ' 58' ' ' CYS . . . 166.21 161.6 15.67 Favored Glycine 0 N--CA 1.425 -2.034 0 C-N-CA 120.339 -0.934 . . . . 0.0 111.653 178.341 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -75.55 -44.47 0.3 Allowed 'Trans proline' 0 N--CA 1.46 -0.451 0 C-N-CA 122.679 2.252 . . . . 0.0 112.683 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -77.38 -16.32 58.92 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.162 0.506 . . . . 0.0 110.553 -178.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 40.1 m -106.6 13.03 28.74 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.481 177.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.472 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 47.1 t -86.69 135.54 33.36 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.552 -179.277 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 32.0 mtmt -109.39 -7.85 15.15 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.04 -178.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 34.5 m -77.47 157.32 30.52 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.166 -177.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -90.59 -85.2 1.39 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.971 -0.633 . . . . 0.0 113.368 -178.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 54.3 p -147.42 -30.14 0.33 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -177.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 35.8 m -92.4 47.16 1.29 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.102 0.477 . . . . 0.0 111.637 -177.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 16.1 t -124.22 165.23 17.98 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 178.033 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 8.8 m -66.62 -19.7 65.83 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.885 -177.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.446 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 27.7 p -93.72 22.09 5.85 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.811 0.338 . . . . 0.0 111.03 -179.413 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.469 ' HZ2' ' HA ' ' A' ' 39' ' ' CYS . 36.2 mmtm . . . . . 0 C--O 1.262 1.711 0 CA-C-O 117.285 -1.34 . . . . 0.0 110.598 -178.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp . . . . . 0 N--CA 1.455 -0.207 0 CA-C-O 120.797 0.332 . . . . 0.0 111.817 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.563 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 87.9 m -98.47 139.1 34.71 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 120.985 0.421 . . . . 0.0 111.722 179.414 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.2 p -89.66 -178.33 5.51 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.618 -179.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.3 m -64.33 -28.66 69.86 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.804 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.0 -44.86 91.38 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.882 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.551 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 48.9 t -77.21 -31.23 55.1 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.662 -179.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.656 ' HA ' ' NE ' ' A' ' 15' ' ' ARG . 1.8 mmp_? -74.25 -9.17 58.34 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.129 -0.487 . . . . 0.0 112.178 -179.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 52.7 m -88.23 159.28 18.2 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 177.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -126.54 119.13 22.98 Favored Pre-proline 0 C--N 1.309 -1.191 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -77.09 -178.19 23.4 Favored 'Cis proline' 0 C--N 1.348 0.529 0 C-N-CA 123.191 -1.587 . . . . 0.0 112.126 1.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.5 m -65.57 139.62 58.46 Favored 'General case' 0 CA--C 1.503 -0.861 0 CA-C-O 121.535 0.683 . . . . 0.0 111.941 -178.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 -114.26 15.75 18.06 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.835 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.571 ' HB3' ' HA ' ' A' ' 25' ' ' CYS . 1.9 m -63.08 -31.53 72.69 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.843 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 72.17 -148.19 42.23 Favored Glycine 0 N--CA 1.438 -1.21 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.791 177.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.5 m -88.42 -18.53 28.14 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-O 120.922 0.391 . . . . 0.0 110.082 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -77.66 -48.19 17.39 Favored 'General case' 0 CA--C 1.499 -1.0 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.943 -179.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.618 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 1.3 t 72.42 98.17 0.07 Allowed 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 114.614 -1.175 . . . . 0.0 110.119 -176.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -80.69 -24.04 39.15 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.771 -1.104 . . . . 0.0 112.544 -175.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.563 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 18.6 p -79.28 156.23 28.17 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 119.929 -0.709 . . . . 0.0 110.477 -179.704 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -83.95 -66.77 1.47 Allowed Glycine 0 N--CA 1.433 -1.508 0 C-N-CA 120.215 -0.993 . . . . 0.0 111.442 179.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -169.88 168.16 8.87 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 -178.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 101.93 32.45 5.02 Favored Glycine 0 N--CA 1.441 -0.983 0 C-N-CA 120.579 -0.819 . . . . 0.0 113.557 177.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.415 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 30.1 p -139.72 -37.58 0.49 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 117.323 0.561 . . . . 0.0 111.767 178.093 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 46.3 p 49.65 46.43 23.74 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 121.226 0.536 . . . . 0.0 111.285 -178.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 68.4 m -63.98 168.66 4.99 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.781 -179.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.408 ' HA ' ' HB ' ' A' ' 38' ' ' THR . . . -102.82 16.81 25.49 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.443 177.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -124.85 -70.34 0.76 Allowed 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.698 -178.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.618 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 29.4 p -86.49 -38.65 17.05 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.222 0.534 . . . . 0.0 111.637 -178.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.08 41.03 1.54 Allowed 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.514 -173.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.408 ' HB ' ' HA ' ' A' ' 34' ' ' ALA . 7.8 t -114.67 163.27 15.68 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.488 -175.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 51.3 t -109.07 140.64 42.34 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 176.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -98.76 3.6 47.57 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 120.704 0.288 . . . . 0.0 111.498 -177.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.491 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 85.0 m -80.02 164.25 23.58 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-O 120.928 0.394 . . . . 0.0 110.954 178.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 29.7 p -131.22 162.47 29.9 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.516 -179.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.9 m -69.37 -22.18 63.75 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.948 0.404 . . . . 0.0 110.922 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -86.63 -2.24 58.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.388 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 169.65 128.52 1.02 Allowed Glycine 0 N--CA 1.44 -1.08 0 C-N-CA 120.301 -0.952 . . . . 0.0 112.529 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.8 t -78.59 128.08 33.02 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.491 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 32.1 mmmt -87.82 -30.5 20.17 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -175.117 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.441 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 19.6 p -88.79 -36.79 15.88 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.285 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 110.66 -0.51 29.06 Favored Glycine 0 N--CA 1.442 -0.923 0 C-N-CA 120.833 -0.699 . . . . 0.0 113.056 178.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.441 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 72.2 mmtt -80.24 -2.05 43.32 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 117.065 0.432 . . . . 0.0 110.907 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 67.88 21.93 8.85 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.131 177.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.516 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 3.0 p -72.54 -44.88 61.54 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.18 178.01 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.406 ' HG1' ' C ' ' A' ' 52' ' ' CYS . 67.2 p 53.49 26.51 5.6 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.988 0.915 . . . . 0.0 113.114 176.526 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.453 ' O ' ' HB2' ' A' ' 58' ' ' CYS . . . 158.09 160.59 10.35 Favored Glycine 0 N--CA 1.439 -1.149 0 C-N-CA 120.76 -0.734 . . . . 0.0 111.335 -179.527 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -69.04 -12.27 33.84 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.667 2.245 . . . . 0.0 113.533 -177.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -79.41 -50.73 10.36 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.864 0.364 . . . . 0.0 111.084 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 24.1 t -90.78 7.75 38.17 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 120.953 0.406 . . . . 0.0 110.1 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.516 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 4.5 t -70.13 109.49 4.63 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.82 179.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -110.28 1.42 18.56 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.452 -177.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.2 p -98.08 152.06 19.72 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.663 178.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . 0.439 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -67.31 -177.6 10.12 Favored Glycine 0 CA--C 1.523 0.554 0 CA-C-N 116.082 -0.508 . . . . 0.0 114.239 -175.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 20.1 m -82.14 6.22 17.18 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 123.074 0.55 . . . . 0.0 111.76 -177.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.9 m -107.52 11.3 28.88 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.961 0.41 . . . . 0.0 110.34 178.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . 0.472 ' SG ' ' N ' ' A' ' 65' ' ' SER . 53.4 t -84.38 173.93 10.51 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.954 -179.288 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.472 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 8.9 m -64.82 -31.85 73.27 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.426 -179.163 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.555 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 26.0 p -81.6 10.63 5.67 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-O 120.843 0.354 . . . . 0.0 111.233 -179.288 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.555 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 15.0 mmtp . . . . . 0 C--O 1.266 1.934 0 CA-C-O 117.88 -1.057 . . . . 0.0 110.828 -177.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . 0.438 ' HB2' ' HA3' ' A' ' 28' ' ' GLY . 31.5 mmmt . . . . . 0 N--CA 1.471 0.602 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.544 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 91.5 m -77.08 130.93 38.05 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 121.288 0.566 . . . . 0.0 112.16 -178.7 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 35.8 p -87.19 177.57 7.14 Favored 'General case' 0 N--CA 1.431 -1.393 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.253 -179.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.5 m -58.98 -27.02 64.99 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.753 -179.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.34 -45.0 77.68 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 120.856 0.36 . . . . 0.0 110.814 178.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.649 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 5.4 t -78.07 -26.0 47.97 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.065 0.46 . . . . 0.0 110.534 -178.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 32.7 mmt180 -74.66 -17.88 60.62 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.052 179.076 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.3 t -62.6 159.64 15.57 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.61 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -132.32 107.07 13.38 Favored Pre-proline 0 C--N 1.308 -1.2 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.887 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.18 170.96 69.41 Favored 'Cis proline' 0 C--O 1.243 0.732 0 C-N-CA 123.517 -1.451 . . . . 0.0 112.476 0.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.614 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 21.5 t -55.98 143.67 31.36 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.867 -178.688 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -120.79 15.24 11.77 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.468 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.649 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 0.5 OUTLIER -70.8 -4.01 21.81 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.054 0.454 . . . . 0.0 110.94 179.535 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.77 -15.37 73.6 Favored Glycine 0 CA--C 1.521 0.454 0 C-N-CA 121.158 -0.544 . . . . 0.0 112.583 178.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 t -73.18 -47.51 43.12 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.649 -0.324 . . . . 0.0 110.76 179.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -140.91 -43.57 0.39 Allowed 'General case' 0 C--O 1.237 0.43 0 CA-C-N 116.66 -0.245 . . . . 0.0 111.247 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 16.0 t 74.02 100.84 0.07 Allowed 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.99 0.806 . . . . 0.0 110.988 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -125.52 13.14 8.12 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.894 -177.709 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.544 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 15.1 p -84.11 -175.53 5.84 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.254 0.549 . . . . 0.0 110.858 -178.204 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.493 ' C ' ' H ' ' A' ' 30' ' ' GLY . . . -88.59 130.92 10.39 Favored Glycine 0 N--CA 1.425 -2.085 0 N-CA-C 109.431 -1.468 . . . . 0.0 109.431 173.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.0 18.82 0.08 Allowed 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -176.249 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . 0.493 ' H ' ' C ' ' A' ' 28' ' ' GLY . . . -110.63 11.13 30.33 Favored Glycine 0 N--CA 1.436 -1.356 0 N-CA-C 111.151 -0.78 . . . . 0.0 111.151 177.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.812 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 15.4 p -80.49 -15.44 56.72 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 120.644 0.259 . . . . 0.0 110.415 179.552 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 82.8 p 57.34 26.53 12.54 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.868 0.867 . . . . 0.0 111.627 -177.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.812 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 6.6 t -62.86 127.9 33.38 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.822 179.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -92.15 32.18 1.19 Allowed 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.393 -177.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -128.65 -50.71 1.26 Allowed 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.174 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.471 ' CB ' ' HB3' ' A' ' 21' ' ' CYS . 25.3 p -98.09 -39.56 8.85 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.112 179.649 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -84.55 115.57 22.67 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-O 121.107 0.479 . . . . 0.0 110.891 -179.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.0 t -177.76 -178.34 0.71 Allowed 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 178.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -98.23 135.05 40.42 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 109.524 -0.546 . . . . 0.0 109.524 177.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -86.71 -6.01 58.96 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.208 -178.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 59.9 m -80.63 135.18 36.0 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.769 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 71.5 p -105.87 172.68 6.67 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.618 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 34.0 p -75.12 -10.0 59.07 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.167 0.508 . . . . 0.0 110.197 178.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -76.36 -40.99 49.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.971 177.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -169.01 136.96 4.3 Favored Glycine 0 N--CA 1.431 -1.659 0 C-N-CA 120.887 -0.673 . . . . 0.0 111.824 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 17.8 t -69.32 128.18 35.68 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.8 mmpt? -82.23 -40.03 22.21 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 -177.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.502 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 19.2 p -86.99 -36.5 18.21 Favored 'General case' 0 C--N 1.318 -0.804 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.908 -177.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 106.72 15.16 17.57 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.185 178.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.502 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 74.4 mmtt -94.75 1.59 55.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.954 0.407 . . . . 0.0 110.54 178.294 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 62.4 33.38 16.33 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.09 178.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.573 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.4 p -82.6 -47.35 12.19 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.985 177.407 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.45 ' HG1' ' C ' ' A' ' 52' ' ' CYS . 51.3 p 52.69 37.74 24.39 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.942 0.897 . . . . 0.0 113.131 176.614 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 141.56 157.31 7.12 Favored Glycine 0 N--CA 1.437 -1.284 0 C-N-CA 120.161 -1.019 . . . . 0.0 112.302 178.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -61.24 -27.07 83.02 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.874 2.383 . . . . 0.0 112.709 -178.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -62.19 -54.58 38.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.84 0.352 . . . . 0.0 111.219 -179.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.7 m -99.69 20.12 14.65 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.291 -178.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.573 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 4.5 t -74.32 105.55 5.54 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-O 121.059 0.457 . . . . 0.0 110.514 -179.169 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -83.33 -22.05 33.0 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.92 -177.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.2 p -93.02 133.38 36.22 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 120.678 -0.409 . . . . 0.0 109.987 179.182 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -120.71 114.97 2.77 Favored Glycine 0 N--CA 1.439 -1.143 0 C-N-CA 120.602 -0.808 . . . . 0.0 112.126 -175.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 63.7 m 64.13 163.89 0.13 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 122.941 0.497 . . . . 0.0 112.163 -179.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.5 m 66.88 -24.37 0.11 Allowed 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 174.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 37.9 t -73.41 163.72 27.66 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 118.273 0.488 . . . . 0.0 111.414 -177.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.0 p -66.21 -26.7 67.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.03 -0.532 . . . . 0.0 112.048 -178.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.497 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 30.4 p -81.08 0.39 36.24 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.71 178.808 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.497 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 5.2 mmpp? . . . . . 0 C--O 1.262 1.743 0 CA-C-O 118.249 -0.882 . . . . 0.0 110.494 -179.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 50.3 mtpt . . . . . 0 N--CA 1.454 -0.238 0 CA-C-O 121.319 0.58 . . . . 0.0 109.49 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.564 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 67.8 m -122.07 160.77 24.32 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.742 -177.064 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 20.9 p -85.63 174.06 9.69 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.222 -179.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.7 m -57.61 -36.78 72.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.337 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.92 -46.06 89.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.416 -179.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.461 ' HB3' ' HB3' ' A' ' 10' ' ' CYS . 26.4 t -68.96 -30.29 68.7 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.101 0.477 . . . . 0.0 110.005 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 28.5 mmm180 -78.35 -2.82 40.05 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.551 178.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.8 m -84.06 165.57 18.43 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.664 0.269 . . . . 0.0 110.766 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -133.2 116.63 14.36 Favored Pre-proline 0 C--N 1.318 -0.767 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -70.81 173.29 48.99 Favored 'Cis proline' 0 C--O 1.235 0.327 0 C-N-CA 123.153 -1.603 . . . . 0.0 112.253 0.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.7 t -57.23 116.55 3.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.362 -178.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -102.39 13.56 34.26 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.001 0.429 . . . . 0.0 111.108 -176.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.64 ' SG ' ' HA ' ' A' ' 25' ' ' CYS . 4.7 t -70.4 -20.36 62.94 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.595 -179.41 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 59.02 -152.62 32.18 Favored Glycine 0 C--N 1.343 0.964 0 CA-C-N 115.284 -0.871 . . . . 0.0 113.04 177.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 67.1 m -95.69 -3.58 45.78 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-O 120.658 0.266 . . . . 0.0 110.464 177.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -71.6 -44.25 64.77 Favored 'General case' 0 CA--C 1.495 -1.136 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 176.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.64 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 4.8 t 55.58 92.82 0.03 OUTLIER 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 114.415 -1.266 . . . . 0.0 112.625 174.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -102.88 3.61 36.75 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.352 -179.492 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.456 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 29.1 p -87.89 174.92 8.05 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.697 179.292 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -98.07 -102.97 2.26 Favored Glycine 0 N--CA 1.44 -1.093 0 C-N-CA 120.607 -0.806 . . . . 0.0 111.359 178.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -139.66 161.73 36.83 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.89 28.05 7.57 Favored Glycine 0 N--CA 1.436 -1.344 0 C-N-CA 120.353 -0.927 . . . . 0.0 112.928 178.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.564 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 15.0 p -115.63 -23.89 8.53 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 117.044 0.422 . . . . 0.0 110.225 177.831 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 38.6 p 51.49 36.05 15.89 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.59 0.756 . . . . 0.0 112.281 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 74.2 m -75.21 171.9 13.35 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 121.083 0.468 . . . . 0.0 110.904 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -135.4 9.5 3.44 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 175.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.32 -58.87 1.8 Allowed 'General case' 0 CA--C 1.507 -0.69 0 CA-C-N 114.801 -1.09 . . . . 0.0 109.943 -178.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.613 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 31.8 p -86.41 -47.36 9.39 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -95.38 92.07 6.53 Favored 'General case' 0 N--CA 1.424 -1.756 0 CA-C-N 114.754 -1.112 . . . . 0.0 109.549 177.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.8 t -137.36 162.18 34.28 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 13.1 t -107.31 133.28 52.09 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 120.932 0.396 . . . . 0.0 110.057 -179.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -89.95 -6.32 55.8 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.16 0.505 . . . . 0.0 110.38 -177.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 38.0 m -79.3 145.1 33.68 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.97 -177.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 64.9 p -115.09 170.0 8.69 Favored 'General case' 0 N--CA 1.438 -1.058 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 178.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.429 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 2.8 p -73.62 -11.01 60.29 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.06 0.457 . . . . 0.0 111.151 178.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -90.59 -33.05 16.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.838 179.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -158.45 127.25 1.84 Allowed Glycine 0 N--CA 1.434 -1.499 0 C-N-CA 120.348 -0.929 . . . . 0.0 112.364 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 6.7 t -76.09 134.72 39.96 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp -96.15 -16.53 21.45 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -175.059 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.405 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 32.1 p -103.1 -39.34 6.92 Favored 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.277 178.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.36 5.34 26.48 Favored Glycine 0 N--CA 1.438 -1.176 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.74 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -84.74 -2.25 57.36 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 120.935 0.398 . . . . 0.0 110.455 178.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 63.68 24.11 13.77 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.052 0.941 . . . . 0.0 111.179 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.468 ' O ' ' HB2' ' A' ' 57' ' ' SER . 3.9 p -70.77 -43.65 68.32 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 178.397 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.466 ' HG1' ' C ' ' A' ' 52' ' ' CYS . 64.3 p 51.26 39.9 24.93 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.808 0.843 . . . . 0.0 112.899 176.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 145.04 149.37 5.01 Favored Glycine 0 N--CA 1.439 -1.162 0 C-N-CA 120.255 -0.974 . . . . 0.0 112.071 179.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -61.98 -26.13 78.4 Favored 'Trans proline' 0 CA--C 1.532 0.395 0 C-N-CA 123.021 2.481 . . . . 0.0 112.758 -177.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -71.28 -24.04 62.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.398 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.468 ' HB2' ' O ' ' A' ' 52' ' ' CYS . 23.6 m -119.14 15.99 13.22 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.226 0.536 . . . . 0.0 110.04 179.322 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.411 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 13.3 t -83.44 106.07 14.9 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.734 -176.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -95.8 -13.32 24.16 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.224 -177.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.2 p -89.58 148.93 23.08 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.915 -179.219 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -79.52 -167.08 33.65 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.934 -0.651 . . . . 0.0 113.837 -175.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.429 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 16.1 m -73.31 -13.45 61.12 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 123.299 0.64 . . . . 0.0 111.792 -177.567 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 45.4 m -86.62 18.37 3.4 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.777 0.323 . . . . 0.0 111.158 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 13.0 t -100.06 172.19 7.35 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 178.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 25.2 m -81.43 -11.04 59.38 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -176.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.427 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 25.9 p -93.29 15.97 14.32 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.835 0.35 . . . . 0.0 110.789 179.373 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.429 ' HG3' ' HA ' ' A' ' 62' ' ' SER . 9.0 mmtp . . . . . 0 C--O 1.263 1.782 0 CA-C-O 118.006 -0.997 . . . . 0.0 111.117 -177.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt . . . . . 0 N--CA 1.463 0.211 0 CA-C-O 120.951 0.405 . . . . 0.0 111.423 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.509 ' HB3' ' HB3' ' A' ' 14' ' ' CYS . 57.3 m -79.58 148.74 31.62 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.336 178.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.1 t -85.5 171.3 11.87 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.058 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.6 m -53.54 -32.08 49.12 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 123.205 0.602 . . . . 0.0 111.194 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.8 -45.35 94.24 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.429 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.701 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 29.4 t -75.23 -24.81 57.75 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.446 0.641 . . . . 0.0 110.256 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 77.5 mtp180 -84.62 4.99 29.76 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.72 -178.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.8 m -106.73 162.75 13.5 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.685 0.278 . . . . 0.0 110.725 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -126.87 117.98 22.34 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.184 178.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -74.1 178.06 35.24 Favored 'Cis proline' 0 C--O 1.239 0.553 0 C-N-CA 123.144 -1.607 . . . . 0.0 112.155 0.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.431 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 21.1 t -69.9 136.53 50.74 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.76 -176.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -112.36 6.91 19.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.49 -177.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.701 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 4.8 m -75.11 -11.2 60.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.661 0.267 . . . . 0.0 111.636 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.81 69.11 2.69 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.979 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.3 t -174.3 -61.72 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -115.13 -46.45 2.9 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.872 -0.603 . . . . 0.0 109.666 177.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.417 ' HB2' ' O ' ' A' ' 21' ' ' CYS . 38.3 t 60.96 100.41 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.163 -0.926 . . . . 0.0 112.466 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -100.56 23.78 9.89 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.212 178.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -63.27 148.29 48.64 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.94 178.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.27 163.09 37.23 Favored Glycine 0 N--CA 1.433 -1.549 0 N-CA-C 109.759 -1.336 . . . . 0.0 109.759 172.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -70.97 114.36 8.94 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 117.247 0.523 . . . . 0.0 110.09 -177.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 132.92 24.54 0.72 Allowed Glycine 0 N--CA 1.436 -1.321 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.269 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.4 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 45.9 t -91.68 146.42 23.79 Favored 'General case' 0 N--CA 1.439 -0.975 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 178.52 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.7 p -123.44 30.67 6.19 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.314 -179.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.4 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 21.0 t -68.76 163.9 23.03 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.258 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -117.17 25.27 10.59 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.022 0.439 . . . . 0.0 110.246 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -127.6 -59.42 1.21 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.439 -178.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 7.1 p -86.45 -39.58 16.19 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.007 0.432 . . . . 0.0 111.022 -179.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.2 tmtp? -104.21 91.68 4.03 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.025 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.6 t -173.96 -175.83 1.11 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.936 -179.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 39.2 t -113.82 137.44 51.65 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.916 0.388 . . . . 0.0 110.327 178.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 32.1 m-80 -93.97 -0.29 55.65 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.87 -178.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.447 ' HB3' ' HA ' ' A' ' 53' ' ' THR . 81.7 m -78.7 156.5 28.92 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.124 0.487 . . . . 0.0 111.525 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.3 p -137.81 169.55 17.59 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.261 178.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.0 m -67.9 -18.19 64.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.223 0.535 . . . . 0.0 110.469 178.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -68.22 -37.27 80.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.489 177.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -175.0 133.24 2.4 Favored Glycine 0 N--CA 1.434 -1.474 0 C-N-CA 120.85 -0.69 . . . . 0.0 111.912 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 4.8 t -72.63 116.29 12.93 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 178.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -74.43 -33.59 62.99 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.583 -174.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.551 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 28.2 p -86.8 -43.82 12.21 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.054 -0.659 . . . . 0.0 110.073 179.822 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.81 4.8 26.07 Favored Glycine 0 N--CA 1.436 -1.309 0 CA-C-N 115.74 -0.664 . . . . 0.0 112.432 -179.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.551 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 46.1 mmtm -79.51 -5.36 54.68 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.249 0.547 . . . . 0.0 109.696 177.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 68.76 30.41 4.86 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 114.772 -1.104 . . . . 0.0 110.884 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.496 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 5.3 p -80.3 -39.45 28.73 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.288 177.441 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.447 ' HA ' ' HB3' ' A' ' 41' ' ' CYS . 39.0 p 51.97 33.42 11.74 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 177.254 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 145.77 150.45 5.21 Favored Glycine 0 N--CA 1.441 -1.033 0 C-N-CA 120.168 -1.015 . . . . 0.0 112.268 178.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -55.98 -28.04 66.91 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.307 2.671 . . . . 0.0 113.407 -178.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -66.89 -34.44 77.8 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.759 0.314 . . . . 0.0 111.625 -178.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.452 ' HB2' ' O ' ' A' ' 52' ' ' CYS . 19.2 m -111.97 13.15 20.79 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.286 0.565 . . . . 0.0 110.264 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.496 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 28.0 t -78.42 119.53 21.86 Favored 'General case' 0 N--CA 1.438 -1.04 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.842 -179.208 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -115.77 1.11 13.38 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.584 -178.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.472 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 0.6 OUTLIER -97.2 110.01 22.65 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 176.864 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -99.11 114.66 5.09 Favored Glycine 0 CA--C 1.491 -1.422 0 C-N-CA 120.993 -0.623 . . . . 0.0 112.639 -173.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.435 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 43.6 t 61.89 161.63 0.07 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.065 0.546 . . . . 0.0 111.424 -179.057 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 19.1 t 73.14 -32.77 0.25 Allowed 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 175.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 33.3 t -67.98 162.75 23.71 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 119.736 -0.786 . . . . 0.0 111.801 -176.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.4 t -68.75 -21.75 64.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.832 -177.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.545 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 29.3 p -86.24 0.31 54.06 Favored 'General case' 0 C--O 1.219 -0.52 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.976 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.545 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 0.1 OUTLIER . . . . . 0 C--O 1.261 1.671 0 CA-C-O 117.998 -1.001 . . . . 0.0 111.051 -179.029 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt . . . . . 0 CA--C 1.514 -0.426 0 CA-C-O 121.03 0.443 . . . . 0.0 110.026 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.487 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 6.0 m -95.82 164.7 12.63 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-O 121.892 0.853 . . . . 0.0 112.726 -179.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.4 t -100.85 161.21 13.75 Favored 'General case' 0 N--CA 1.43 -1.453 0 CA-C-N 114.26 -1.336 . . . . 0.0 108.672 176.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.0 t -58.4 -30.62 66.99 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.94 0.4 . . . . 0.0 110.477 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.83 -35.01 79.07 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.124 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 10.4 t -86.44 -30.23 22.22 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.329 -176.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 42.2 ttp180 -77.38 -8.09 57.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.049 0.452 . . . . 0.0 110.281 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.9 t -89.26 161.84 16.19 Favored 'General case' 0 N--CA 1.435 -1.205 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 177.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.457 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 45.0 mt-10 -128.53 129.14 23.56 Favored Pre-proline 0 C--N 1.307 -1.259 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 -179.161 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . 0.457 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 56.0 Cg_endo -68.5 173.16 40.85 Favored 'Cis proline' 0 C--N 1.348 0.52 0 C-N-CA 123.55 -1.438 . . . . 0.0 113.099 1.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.0 t -62.69 115.73 4.57 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.957 -178.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -107.2 14.43 26.19 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.079 -177.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.614 ' SG ' ' HA ' ' A' ' 25' ' ' CYS . 4.5 t -68.47 -20.7 64.63 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 179.068 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 61.86 -154.04 40.33 Favored Glycine 0 C--N 1.339 0.713 0 CA-C-N 115.076 -0.965 . . . . 0.0 114.411 174.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.6 m -89.81 -10.22 46.26 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.343 -0.429 . . . . 0.0 110.194 179.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -76.0 -40.01 54.62 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 177.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.614 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 10.9 t 56.33 86.61 0.06 Allowed 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.61 176.721 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -89.74 -7.04 55.39 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.489 -177.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.487 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 14.6 p -85.19 162.17 19.31 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-O 121.089 0.471 . . . . 0.0 110.676 -179.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.83 -159.59 35.5 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.698 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.5 mp0 -78.69 168.91 19.06 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.817 0.342 . . . . 0.0 110.396 179.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 87.21 -0.99 86.18 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.659 178.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 32.0 t -84.55 -48.56 9.43 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 122.768 -0.254 . . . . 0.0 111.356 -179.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 60.4 p 53.0 43.31 31.9 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.587 0.755 . . . . 0.0 112.401 -179.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.92 165.12 20.64 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.424 178.181 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -113.35 11.14 18.5 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.29 0.567 . . . . 0.0 110.051 179.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -117.46 -64.43 1.3 Allowed 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.608 -179.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.587 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 25.5 p -74.43 -42.92 58.34 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-O 121.134 0.492 . . . . 0.0 109.701 178.337 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.456 ' NZ ' ' SG ' ' A' ' 27' ' ' CYS . 14.0 mptt -83.76 87.6 7.07 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.027 176.068 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.5 t -142.21 154.76 45.05 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 44.2 t -89.07 136.16 33.17 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -92.22 -3.75 55.1 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.116 -178.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 62.3 m -77.98 141.47 38.93 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.502 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 62.8 p -102.76 164.84 11.4 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.965 -177.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.4 m -67.93 -31.59 71.45 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.919 0.39 . . . . 0.0 110.681 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -71.67 -34.11 69.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.986 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -163.69 136.52 4.3 Favored Glycine 0 N--CA 1.435 -1.422 0 C-N-CA 120.284 -0.96 . . . . 0.0 112.705 -178.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 37.2 t -73.0 147.81 44.8 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 177.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.441 ' NZ ' ' HB3' ' A' ' 47' ' ' LYS . 8.3 mtpm? -112.05 -19.6 12.26 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -177.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.419 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 17.4 p -96.99 -37.71 10.07 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 119.993 -0.683 . . . . 0.0 110.793 -179.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.66 0.43 17.88 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.618 -0.801 . . . . 0.0 113.306 178.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.791 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 73.9 mmtt -84.6 -9.17 58.54 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 117.078 0.439 . . . . 0.0 110.703 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 66.4 27.94 9.81 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.16 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.515 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 0.8 OUTLIER -71.16 -47.46 57.58 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.312 178.197 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.5 p 55.89 35.99 26.47 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.182 0.993 . . . . 0.0 113.332 176.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 150.46 149.52 5.05 Favored Glycine 0 C--O 1.218 -0.899 0 C-N-CA 120.012 -1.09 . . . . 0.0 112.252 178.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -70.82 -23.24 26.21 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.875 2.383 . . . . 0.0 113.068 -178.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -82.68 -21.21 34.99 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.212 0.53 . . . . 0.0 109.878 -178.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.8 m -121.77 22.86 10.36 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.546 179.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.515 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 8.2 t -75.34 142.29 43.21 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.116 -177.508 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 45.1 mtpt -110.7 1.38 17.87 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.496 -176.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.791 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 4.7 m -101.17 143.88 30.73 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.798 -177.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -110.03 70.84 0.21 Allowed Glycine 0 CA--C 1.507 -0.45 0 N-CA-C 111.23 -0.748 . . . . 0.0 111.23 -178.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.6 t 60.59 -179.61 0.1 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.205 0.602 . . . . 0.0 110.323 -177.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.7 m 62.92 -0.28 0.61 Allowed 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 177.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 36.2 t -93.77 162.68 13.83 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.285 178.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 51.0 m -70.1 -12.02 61.3 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -177.26 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.645 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 24.8 p -86.91 0.34 55.2 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 120.027 -0.669 . . . . 0.0 110.531 177.024 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.645 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 23.5 mmtp . . . . . 0 C--O 1.25 1.123 0 CA-C-O 117.767 -1.111 . . . . 0.0 110.532 -179.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 60.8 mttm . . . . . 0 C--O 1.232 0.144 0 CA-C-O 121.082 0.468 . . . . 0.0 109.992 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.539 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 60.4 m -99.97 163.65 12.35 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.371 0.605 . . . . 0.0 112.603 -176.167 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.8 p -100.02 175.5 5.74 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.657 -178.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.4 m -62.16 -31.52 72.02 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.22 179.235 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.0 -44.07 81.3 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 120.919 0.39 . . . . 0.0 110.536 179.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 41.9 t -70.89 -43.07 69.13 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.93 -178.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.436 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 40.6 ttt180 -79.17 3.45 17.67 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.025 0.441 . . . . 0.0 111.307 -178.741 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.5 t -73.33 165.0 25.88 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 178.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -119.77 105.78 42.69 Favored Pre-proline 0 C--N 1.312 -1.05 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -179.121 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -82.45 -177.02 17.89 Favored 'Cis proline' 0 C--N 1.352 0.715 0 C-N-CA 124.026 -1.239 . . . . 0.0 111.939 -0.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 37.5 t -61.62 129.68 42.25 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 120.949 0.404 . . . . 0.0 111.179 -177.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 76.4 mm-40 -114.58 13.61 17.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.575 -178.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.583 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 1.8 t -68.68 -31.77 71.12 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -179.574 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 60.3 -162.4 18.94 Favored Glycine 0 C--N 1.34 0.759 0 CA-C-N 115.091 -0.959 . . . . 0.0 114.627 175.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.0 m -76.49 -7.23 54.71 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 120.97 0.414 . . . . 0.0 110.818 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -78.53 -45.02 22.89 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 177.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.508 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 5.0 t 59.99 95.25 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.877 176.465 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -102.56 2.03 35.68 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.668 -178.255 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.539 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 14.8 p -90.49 -158.69 0.56 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.202 0.525 . . . . 0.0 111.298 -178.318 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -140.86 157.18 25.79 Favored Glycine 0 N--CA 1.438 -1.204 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 177.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -59.71 93.99 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.517 0.675 . . . . 0.0 112.055 -177.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -165.53 6.44 0.06 OUTLIER Glycine 0 N--CA 1.434 -1.445 0 N-CA-C 110.574 -1.011 . . . . 0.0 110.574 179.003 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.496 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 31.7 p -120.22 178.2 4.73 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.03 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.3 p -129.09 33.21 4.61 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 121.306 0.574 . . . . 0.0 110.538 -178.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 83.4 m -63.35 146.83 52.71 Favored 'General case' 0 CA--C 1.506 -0.727 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -177.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.552 ' C ' ' HB ' ' A' ' 38' ' ' THR . . . -114.95 21.67 14.09 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-N 114.069 -1.423 . . . . 0.0 107.254 173.698 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -113.48 -63.28 1.47 Allowed 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.702 -1.135 . . . . 0.0 110.476 -178.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.583 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 29.2 p -89.19 -45.66 9.39 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 121.588 0.708 . . . . 0.0 109.845 179.044 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.413 ' HG3' ' OG ' ' A' ' 62' ' ' SER . 2.0 ttpm? -95.97 44.81 1.07 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.059 -178.255 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.552 ' HB ' ' C ' ' A' ' 34' ' ' ALA . 14.1 t -100.91 142.07 32.91 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.731 -178.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.5 t -80.53 137.17 36.4 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.655 178.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -106.54 7.28 30.73 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 120.919 0.39 . . . . 0.0 111.308 -178.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' CYS . . . . . 0.568 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 85.2 m -80.91 133.28 35.53 Favored 'General case' 0 N--CA 1.435 -1.188 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.181 178.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 55.8 p -88.61 156.34 19.1 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.583 -177.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.416 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 14.5 m -65.18 -29.73 70.58 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.645 0.736 . . . . 0.0 109.133 176.606 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -65.24 -42.77 93.01 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.696 -1.138 . . . . 0.0 110.744 178.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -159.88 135.77 4.26 Favored Glycine 0 N--CA 1.44 -1.083 0 C-N-CA 121.048 -0.596 . . . . 0.0 111.906 -178.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 12.7 t -71.89 147.98 46.55 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -108.02 -31.74 7.84 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -177.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.446 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 20.7 p -89.75 -39.03 13.41 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.136 -0.625 . . . . 0.0 111.416 -177.61 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 118.48 -5.13 14.98 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.495 -0.859 . . . . 0.0 112.885 -179.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.666 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 74.0 mmtt -76.22 -13.42 60.17 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 120.8 0.333 . . . . 0.0 110.604 179.171 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 71.3 28.07 3.05 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.704 -179.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' CYS . . . . . 0.52 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.8 p -74.33 -43.88 54.8 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.268 178.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.416 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 55.0 p 54.03 31.96 14.64 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.087 0.955 . . . . 0.0 113.106 177.574 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 144.01 154.77 6.22 Favored Glycine 0 N--CA 1.442 -0.922 0 C-N-CA 120.353 -0.927 . . . . 0.0 112.299 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -60.47 -28.46 86.76 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.02 2.48 . . . . 0.0 112.677 -177.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -63.05 -29.29 70.7 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.104 -178.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 13.6 t -126.48 22.75 6.98 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.471 -178.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . 0.52 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 17.8 t -82.71 137.0 34.57 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.078 0.466 . . . . 0.0 110.871 -178.798 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -117.31 10.54 13.74 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.157 -178.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.666 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 2.6 m -102.01 156.3 17.63 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.154 -176.028 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -85.58 -115.68 0.83 Allowed Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 121.002 -0.618 . . . . 0.0 112.8 -178.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' SER . . . . . 0.413 ' OG ' ' HG3' ' A' ' 37' ' ' LYS . 14.9 m -123.49 -13.46 7.56 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 120.832 0.349 . . . . 0.0 111.073 -177.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 58.3 m -107.33 24.24 13.17 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -177.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' CYS . . . . . 0.42 ' SG ' ' N ' ' A' ' 65' ' ' SER . 42.4 t -93.3 171.98 8.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 177.537 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.42 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 19.4 m -67.33 -23.01 65.58 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -177.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.568 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 20.6 p -90.9 4.65 51.31 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.794 -0.362 . . . . 0.0 111.647 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 22.1 mmtp . . . . . 0 C--O 1.26 1.626 0 CA-C-O 117.574 -1.203 . . . . 0.0 110.676 -178.76 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.156 0 N-CA-C 112.345 -0.302 . . . . 0.0 112.345 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.7 m -60.22 118.04 5.9 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 122.314 0.246 . . . . 0.0 110.558 179.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -67.14 90.02 0.17 Allowed Glycine 0 C--N 1.33 0.216 0 C-N-CA 121.226 -0.511 . . . . 0.0 112.773 -179.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 60.5 pttt -150.32 156.48 41.61 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -165.4 111.32 0.45 Allowed Glycine 0 N--CA 1.44 -1.092 0 C-N-CA 120.217 -0.992 . . . . 0.0 112.392 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.9 mttt -114.43 -179.9 3.76 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -81.36 69.15 3.33 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.655 -0.783 . . . . 0.0 111.848 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -80.57 95.46 6.53 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-O 121.066 0.46 . . . . 0.0 110.517 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -80.78 -17.83 49.6 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.479 178.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.556 ' SG ' ' HB2' ' A' ' 27' ' ' CYS . 76.4 m -85.34 150.46 24.73 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.093 -178.255 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.9 t -81.22 166.94 20.13 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.565 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.2 m -54.52 -39.09 67.28 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.589 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.69 -45.62 89.07 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.253 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.619 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 44.6 t -69.38 -34.08 74.01 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.226 0.536 . . . . 0.0 110.373 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 77.5 mtp180 -84.46 14.82 4.13 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.716 -0.675 . . . . 0.0 112.043 -178.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.6 m -100.99 164.39 11.84 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.557 0.218 . . . . 0.0 110.636 178.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.4 mp0 -121.49 110.85 33.62 Favored Pre-proline 0 C--N 1.327 -0.384 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 177.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -78.23 172.12 63.14 Favored 'Cis proline' 0 C--O 1.237 0.47 0 C-N-CA 123.72 -1.367 . . . . 0.0 111.74 0.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.623 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 43.3 t -62.34 134.62 56.73 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 121.127 0.489 . . . . 0.0 110.571 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -113.34 23.78 12.91 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.933 -178.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.658 ' SG ' ' HA ' ' A' ' 25' ' ' CYS . 0.7 OUTLIER -73.97 -25.7 60.08 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 -178.908 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 59.45 -145.06 45.22 Favored Glycine 0 N--CA 1.443 -0.889 0 CA-C-N 115.172 -0.922 . . . . 0.0 113.24 177.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -95.03 -9.9 32.45 Favored 'General case' 0 N--CA 1.438 -1.038 0 CA-C-O 120.92 0.39 . . . . 0.0 110.164 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.41 ' HA ' ' CE ' ' A' ' 24' ' ' LYS . 5.4 mmpt? -72.94 -42.05 63.83 Favored 'General case' 0 CA--C 1.511 -0.555 0 N-CA-C 109.244 -0.651 . . . . 0.0 109.244 178.338 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.658 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 2.6 t 53.83 79.42 0.13 Allowed 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.861 175.05 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -99.91 16.67 23.06 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.749 -178.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.556 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 23.9 p -87.63 -163.57 0.96 Allowed 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.48 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -111.83 153.04 17.54 Favored Glycine 0 N--CA 1.441 -0.998 0 C-N-CA 120.554 -0.832 . . . . 0.0 112.485 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -71.98 120.2 17.23 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 120.807 0.337 . . . . 0.0 110.324 178.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 135.79 -3.35 3.83 Favored Glycine 0 N--CA 1.441 -1.021 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.601 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.527 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 9.1 p -89.31 -31.92 17.6 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.698 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 42.9 p 50.87 38.81 20.97 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.229 0.611 . . . . 0.0 111.306 -176.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.527 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 6.9 t -59.72 136.12 57.9 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.011 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.01 23.52 0.7 Allowed 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -174.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -125.7 -50.8 1.6 Allowed 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.134 0.493 . . . . 0.0 110.117 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.607 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 3.2 p -94.73 -43.1 8.41 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.621 179.063 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.446 ' HE3' ' OG ' ' A' ' 62' ' ' SER . 13.4 mptt -83.53 63.08 7.16 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.468 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.4 t -112.2 175.62 5.36 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.574 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 43.2 t -134.27 135.66 43.04 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -100.95 7.66 43.46 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.484 -175.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.45 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 62.8 m -82.85 134.87 35.08 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.637 178.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 53.2 p -101.91 167.91 9.76 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.165 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.3 m -69.75 -20.36 63.5 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.016 0.436 . . . . 0.0 110.289 178.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -74.64 -38.33 62.54 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.621 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -164.53 135.31 3.69 Favored Glycine 0 N--CA 1.428 -1.864 0 C-N-CA 120.455 -0.879 . . . . 0.0 112.285 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.2 t -73.23 129.55 38.29 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 179.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.45 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 75.1 mmtt -86.74 -25.51 24.67 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 112.068 0.395 . . . . 0.0 112.068 -176.496 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.437 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 19.1 p -97.77 -36.58 10.17 Favored 'General case' 0 C--N 1.313 -1.007 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.345 179.226 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 107.7 5.28 33.87 Favored Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.974 178.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.437 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 74.9 mmtt -83.96 -2.2 56.09 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-O 121.019 0.438 . . . . 0.0 110.542 178.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 67.16 23.91 9.41 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.721 177.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.4 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 1.7 p -73.78 -45.68 50.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.94 177.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 46.0 p 52.75 33.67 14.55 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.036 0.934 . . . . 0.0 113.375 176.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 156.74 144.13 3.85 Favored Glycine 0 N--CA 1.441 -1.032 0 C-N-CA 120.25 -0.976 . . . . 0.0 112.047 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -63.18 -36.51 57.39 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.653 2.236 . . . . 0.0 112.406 -178.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -69.23 -14.93 63.24 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.938 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.6 m -125.47 22.56 7.66 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.038 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.4 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 4.6 t -83.33 137.98 33.73 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.298 -177.24 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 86.1 mttt -123.93 -4.83 8.02 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.384 -176.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.6 p -103.94 156.3 17.96 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 120.934 0.397 . . . . 0.0 111.911 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -71.34 -177.04 25.66 Favored Glycine 0 CA--C 1.52 0.361 0 CA-C-N 115.759 -0.655 . . . . 0.0 114.263 -176.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.446 ' OG ' ' HE3' ' A' ' 37' ' ' LYS . 41.3 m -78.21 -10.27 59.58 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -176.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 30.6 m -89.63 19.19 4.78 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.067 0.461 . . . . 0.0 110.365 178.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 29.6 t -96.97 166.44 11.61 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.825 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 49.3 m -66.32 -29.66 69.9 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -177.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.529 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 25.2 p -80.34 4.65 17.18 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.795 0.331 . . . . 0.0 111.383 -178.493 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.529 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 9.9 mmtp . . . . . 0 C--O 1.264 1.854 0 CA-C-O 117.939 -1.029 . . . . 0.0 110.832 -177.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 112.511 -0.236 . . . . 0.0 112.511 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.4 t -79.15 105.2 10.32 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.81 0.338 . . . . 0.0 110.553 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 69.17 42.18 77.15 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 121.028 -0.606 . . . . 0.0 112.317 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 36.2 mmtm -96.59 -179.46 4.61 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 120.854 0.359 . . . . 0.0 111.49 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -79.51 84.79 1.27 Allowed Glycine 0 N--CA 1.437 -1.275 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.865 -178.566 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -94.18 -9.81 35.12 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-O 121.412 0.625 . . . . 0.0 109.32 176.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.14 -98.46 2.45 Favored Glycine 0 N--CA 1.44 -1.086 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.849 178.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.539 ' HG2' ' SG ' ' A' ' 10' ' ' CYS . 28.8 tt0 -143.4 -67.0 0.36 Allowed 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.542 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt 59.14 33.75 22.94 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.929 -179.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.707 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 96.3 m -92.36 139.71 30.32 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-O 121.387 0.613 . . . . 0.0 111.932 -179.302 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 80.9 p -93.26 179.51 5.39 Favored 'General case' 0 N--CA 1.429 -1.479 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.459 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.1 m -64.23 -26.03 68.33 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.234 -178.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.43 -44.22 83.51 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.828 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.525 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 42.4 t -75.12 -32.87 61.49 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.231 0.539 . . . . 0.0 110.977 -179.12 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 36.4 ttm-85 -80.36 0.56 32.59 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.178 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.2 t -89.0 162.27 16.13 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -134.12 117.41 13.65 Favored Pre-proline 0 C--N 1.318 -0.802 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -68.5 166.64 69.03 Favored 'Cis proline' 0 N--CA 1.477 0.507 0 C-N-CA 123.498 -1.459 . . . . 0.0 112.555 0.467 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.41 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 4.4 t -62.47 133.0 54.38 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.425 -178.026 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 80.2 mm-40 -112.93 18.7 17.93 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -174.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.525 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 1.2 m -65.49 -30.49 71.27 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 120.239 -0.584 . . . . 0.0 111.358 179.459 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 58.99 -136.88 50.93 Favored Glycine 0 CA--C 1.52 0.363 0 CA-C-N 115.961 -0.563 . . . . 0.0 114.15 176.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.0 m -93.32 -8.17 42.8 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.866 0.365 . . . . 0.0 111.165 -177.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -88.01 -49.88 6.77 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.134 179.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 t 59.96 92.61 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.074 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -85.14 -7.6 59.0 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.164 -0.925 . . . . 0.0 112.78 -174.146 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.554 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 22.6 p -101.07 -176.47 3.17 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.255 0.55 . . . . 0.0 111.686 -177.562 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -100.38 -147.9 21.67 Favored Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.981 177.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -109.13 18.05 20.99 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 121.157 0.504 . . . . 0.0 110.491 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -83.17 -9.12 84.48 Favored Glycine 0 C--N 1.309 -0.935 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.489 -177.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.707 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 29.8 p -94.27 -30.61 14.47 Favored 'General case' 0 C--N 1.318 -0.795 0 O-C-N 122.769 -0.253 . . . . 0.0 111.468 -178.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 41.1 p 49.61 41.23 21.23 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-O 121.709 0.766 . . . . 0.0 109.854 -173.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.611 ' O ' ' HB2' ' A' ' 37' ' ' LYS . 0.3 OUTLIER -58.77 159.19 7.06 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 114.528 -1.215 . . . . 0.0 111.214 -177.606 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -104.59 12.93 32.48 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.627 -178.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -121.72 -64.43 1.22 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.054 -178.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 14.7 p -82.11 -25.35 34.53 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.958 0.408 . . . . 0.0 111.275 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.611 ' HB2' ' O ' ' A' ' 33' ' ' CYS . 1.4 mmpp? -93.32 58.38 2.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.79 0.329 . . . . 0.0 111.208 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.7 t -127.72 159.97 33.14 Favored 'General case' 0 C--N 1.313 -1.017 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.735 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.3 t -93.35 139.52 30.58 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -95.15 -0.16 53.59 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 120.862 0.363 . . . . 0.0 111.384 -177.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.547 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 62.8 m -81.31 135.29 35.69 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.219 -0.446 . . . . 0.0 109.949 177.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 69.5 p -101.3 166.47 10.74 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.758 -178.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.7 m -71.72 -15.2 62.19 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.532 179.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -80.66 -35.32 33.94 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.508 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -166.61 130.04 2.05 Favored Glycine 0 N--CA 1.439 -1.151 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.091 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 18.6 t -67.88 133.87 49.89 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 32.8 mmmt -92.41 -30.85 15.55 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -176.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.1 p -91.62 -39.61 11.77 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.611 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 114.41 4.74 21.72 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.817 -0.706 . . . . 0.0 113.028 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.504 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 75.3 mmtt -86.32 -2.99 58.89 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.982 0.391 . . . . 0.0 111.507 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 67.94 18.31 9.56 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.311 0.577 . . . . 0.0 111.284 177.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.493 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 0.9 OUTLIER -65.83 -49.55 67.8 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.008 178.108 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 46.5 p 53.05 46.47 26.65 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.042 -0.981 . . . . 0.0 113.111 177.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 135.13 153.1 6.67 Favored Glycine 0 N--CA 1.442 -0.951 0 C-N-CA 120.212 -0.994 . . . . 0.0 112.687 177.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.09 -18.34 30.92 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.752 2.302 . . . . 0.0 112.68 -178.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -82.16 -4.83 57.78 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.158 0.504 . . . . 0.0 110.729 -178.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 49.3 m -148.07 26.44 0.98 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.317 0.58 . . . . 0.0 110.209 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.493 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 12.2 t -84.21 138.2 33.1 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.988 -177.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -110.82 12.43 22.38 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.445 0.641 . . . . 0.0 109.406 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.504 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 19.3 m -108.66 151.25 26.41 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.456 -178.473 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -89.18 -106.7 1.11 Allowed Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 121.106 -0.569 . . . . 0.0 112.558 -178.058 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 61.7 p -129.32 -9.0 4.71 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-O 120.9 0.381 . . . . 0.0 111.142 -178.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.1 m -104.38 20.61 18.14 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.88 -175.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 35.3 t -102.13 170.48 8.08 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.669 179.334 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.6 t -65.93 -28.94 69.3 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.186 -178.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.547 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 17.3 p -80.52 1.81 27.96 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 120.845 0.355 . . . . 0.0 111.488 -178.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 23.5 mmtp . . . . . 0 C--O 1.258 1.525 0 CA-C-O 117.544 -1.217 . . . . 0.0 110.533 -179.104 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.225 0 N-CA-C 112.566 -0.213 . . . . 0.0 112.566 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.4 m -87.79 90.11 8.25 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.874 0.368 . . . . 0.0 110.367 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -66.31 149.82 51.6 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.772 -178.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -97.01 158.78 15.26 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.904 0.383 . . . . 0.0 110.414 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 176.65 70.95 0.06 OUTLIER Glycine 0 N--CA 1.436 -1.32 0 N-CA-C 111.252 -0.739 . . . . 0.0 111.252 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -86.81 179.14 6.8 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 110.419 -0.215 . . . . 0.0 110.419 -179.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -71.04 102.63 1.09 Allowed Glycine 0 N--CA 1.442 -0.955 0 C-N-CA 120.788 -0.72 . . . . 0.0 111.918 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -82.98 141.31 32.2 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 120.956 0.408 . . . . 0.0 110.563 -179.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.476 ' N ' ' HD2' ' A' ' 9' ' ' LYS . 11.5 mptt -99.25 13.02 34.55 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.091 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.844 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 79.7 m -100.35 146.33 27.09 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.271 -177.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.5 p -94.68 178.76 5.48 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.589 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.5 p -60.47 -29.35 68.99 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.385 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.27 -45.66 87.09 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.259 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.465 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 17.5 t -69.42 -35.27 75.57 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.006 0.432 . . . . 0.0 110.71 -178.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.404 HH11 ' HD3' ' A' ' 15' ' ' ARG . 19.0 mtt180 -76.12 0.91 17.19 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.8 m -81.18 160.12 24.43 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.683 0.278 . . . . 0.0 111.064 -178.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -126.48 108.45 23.47 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.991 178.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_endo -74.44 173.12 58.74 Favored 'Cis proline' 0 C--O 1.241 0.634 0 C-N-CA 123.554 -1.436 . . . . 0.0 112.145 -2.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.465 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 8.7 t -57.66 139.92 52.5 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.871 -177.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 86.1 mm-40 -119.01 16.49 13.34 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -175.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -62.86 -29.86 71.07 Favored 'General case' 0 C--O 1.241 0.619 0 C-N-CA 120.269 -0.572 . . . . 0.0 110.412 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 59.33 -139.5 48.62 Favored Glycine 0 N--CA 1.448 -0.562 0 CA-C-N 115.663 -0.699 . . . . 0.0 113.032 176.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -99.17 10.69 40.94 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.133 0.492 . . . . 0.0 110.647 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -98.61 -50.23 4.33 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 177.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 t 57.3 94.6 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.0 179.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -97.36 9.61 41.84 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.562 -175.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.569 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 31.7 p -107.63 173.59 6.26 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.947 -179.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -102.06 178.45 26.93 Favored Glycine 0 N--CA 1.445 -0.742 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.798 178.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -82.14 78.23 8.84 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.221 0.534 . . . . 0.0 111.284 -178.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -159.14 23.09 0.31 Allowed Glycine 0 N--CA 1.444 -0.821 0 N-CA-C 111.265 -0.734 . . . . 0.0 111.265 178.002 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.844 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 25.1 p -116.52 -19.79 9.91 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 -178.255 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 71.7 p 50.92 30.41 5.22 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-O 121.573 0.702 . . . . 0.0 110.543 -175.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.406 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 1.9 t -76.84 116.41 17.48 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.008 -177.204 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -88.1 16.94 5.44 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.37 0.605 . . . . 0.0 110.607 -176.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.38 -54.07 2.67 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.216 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 28.6 p -98.44 -30.48 12.52 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.122 178.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.542 ' HB2' ' NZ ' ' A' ' 37' ' ' LYS . 0.3 OUTLIER -106.52 80.18 1.45 Allowed 'General case' 0 N--CA 1.435 -1.193 0 CA-C-O 121.448 0.642 . . . . 0.0 111.796 -175.17 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.5 t -157.17 161.75 39.32 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.035 178.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.6 t -89.96 146.91 24.03 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 120.835 0.35 . . . . 0.0 110.736 -179.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 -114.51 2.76 14.69 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.098 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.557 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 57.2 m -79.71 148.11 31.67 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.235 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 44.8 p -114.25 162.24 16.82 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.698 -179.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.434 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 6.6 p -63.8 -25.75 68.32 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.021 0.438 . . . . 0.0 111.312 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -73.4 -35.09 65.82 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.299 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -164.24 131.07 2.33 Favored Glycine 0 N--CA 1.442 -0.949 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.032 -179.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 27.4 t -76.96 133.65 39.13 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 120.743 0.306 . . . . 0.0 110.483 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -86.41 -41.06 14.77 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -178.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.412 ' HA ' ' HB2' ' A' ' 65' ' ' SER . 19.2 p -83.37 -39.23 20.97 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.033 -177.411 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.64 5.82 25.57 Favored Glycine 0 N--CA 1.44 -1.071 0 C-N-CA 120.47 -0.871 . . . . 0.0 113.029 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -84.58 -0.51 53.48 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.075 0.464 . . . . 0.0 110.264 178.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 63.66 21.23 12.62 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.215 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.515 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 3.2 p -70.04 -47.53 61.67 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.956 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.434 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 73.5 p 55.35 25.68 7.84 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 114.956 -1.02 . . . . 0.0 113.032 177.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 152.02 155.22 6.93 Favored Glycine 0 N--CA 1.441 -1.025 0 C-N-CA 120.297 -0.954 . . . . 0.0 112.518 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -60.36 -26.64 83.18 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 123.258 2.639 . . . . 0.0 113.179 -179.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -70.74 -17.73 62.8 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.927 0.394 . . . . 0.0 111.656 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.1 m -135.43 25.15 3.48 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.008 0.432 . . . . 0.0 110.032 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.515 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 6.3 t -81.59 126.42 31.71 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.146 -176.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp -106.34 17.27 23.66 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.462 -178.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.3 m -109.5 159.38 17.11 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.197 -175.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -110.21 -77.04 0.91 Allowed Glycine 0 N--CA 1.439 -1.115 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.624 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 34.8 m -146.47 159.3 43.59 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 110.376 -0.231 . . . . 0.0 110.376 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.2 m 65.21 7.4 4.13 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 177.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 45.3 t -75.46 167.47 21.84 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 176.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.412 ' HB2' ' HA ' ' A' ' 48' ' ' CYS . 15.4 m -64.34 -16.56 62.46 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 120.771 0.319 . . . . 0.0 111.771 -177.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.557 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 25.5 p -101.15 1.92 39.64 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 120.571 0.224 . . . . 0.0 111.29 178.433 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.51 ' HE2' ' SG ' ' A' ' 66' ' ' CYS . 71.9 mmtt . . . . . 0 C--O 1.261 1.708 0 CA-C-O 117.843 -1.075 . . . . 0.0 111.049 -177.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 N-CA-C 112.366 -0.294 . . . . 0.0 112.366 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.7 m -87.7 -21.18 25.37 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.776 0.322 . . . . 0.0 111.035 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 81.32 -129.84 9.31 Favored Glycine 0 N--CA 1.444 -0.804 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.174 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -121.12 170.17 9.81 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 128.33 109.15 1.46 Allowed Glycine 0 N--CA 1.442 -0.949 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.446 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -114.69 101.66 9.29 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.954 0.406 . . . . 0.0 110.627 179.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 79.62 -139.73 21.87 Favored Glycine 0 N--CA 1.443 -0.846 0 C-N-CA 120.73 -0.747 . . . . 0.0 111.603 -179.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -138.62 -82.39 0.3 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.061 0.458 . . . . 0.0 111.874 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -132.95 25.07 4.29 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.119 -177.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.538 ' SG ' ' HB2' ' A' ' 27' ' ' CYS . 78.6 m -95.86 147.86 23.21 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -176.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 74.8 p -100.51 179.6 4.39 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.805 -178.088 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.5 m -62.12 -20.07 63.68 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.31 -178.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.38 -50.14 48.94 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 120.956 0.408 . . . . 0.0 110.023 177.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 51.4 t -73.57 -35.68 65.48 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.009 178.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 27.7 mtm180 -69.35 -3.34 13.75 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.948 0.404 . . . . 0.0 111.649 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.5 t -83.62 163.97 20.01 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 176.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -132.86 111.43 13.37 Favored Pre-proline 0 C--N 1.306 -1.3 0 CA-C-O 120.884 0.373 . . . . 0.0 110.565 178.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -75.22 173.14 59.5 Favored 'Cis proline' 0 C--N 1.35 0.613 0 C-N-CA 123.444 -1.482 . . . . 0.0 112.238 -0.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 71.2 m -59.86 140.68 56.44 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.075 0.464 . . . . 0.0 111.164 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 28.7 mm-40 -114.29 21.1 14.99 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.004 -177.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.424 ' HB3' ' HA ' ' A' ' 25' ' ' CYS . 11.0 m -66.1 -33.14 75.1 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.84 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 79.75 -114.85 3.95 Favored Glycine 0 N--CA 1.438 -1.17 0 C-N-CA 120.775 -0.726 . . . . 0.0 111.445 -178.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.9 t -129.29 -3.27 4.97 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.043 0.449 . . . . 0.0 110.248 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -88.22 -40.81 13.39 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.086 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.534 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 0.6 OUTLIER 66.72 104.39 0.04 OUTLIER 'General case' 0 CA--C 1.505 -0.772 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.848 -179.615 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -88.3 -14.88 37.2 Favored 'General case' 0 C--N 1.305 -1.346 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.009 177.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.538 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 26.6 p -84.19 170.86 13.33 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.194 178.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.12 -126.68 2.87 Favored Glycine 0 N--CA 1.441 -0.987 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.29 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -137.36 77.41 1.64 Allowed 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 121.635 0.731 . . . . 0.0 110.556 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -172.36 43.21 0.17 Allowed Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.844 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.573 ' SG ' ' HE2' ' A' ' 37' ' ' LYS . 12.0 p -130.88 -28.63 1.97 Allowed 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 120.6 0.238 . . . . 0.0 111.178 -178.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.8 p 50.04 45.66 25.18 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 123.466 0.706 . . . . 0.0 112.8 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.621 ' O ' ' HB2' ' A' ' 37' ' ' LYS . 59.1 m -74.6 170.95 14.74 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.503 178.164 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -109.41 3.54 21.54 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.27 0.557 . . . . 0.0 110.08 178.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -104.62 -69.09 0.82 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.389 -178.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.534 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 25.3 p -88.68 0.23 56.63 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.139 -179.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.621 ' HB2' ' O ' ' A' ' 33' ' ' CYS . 34.1 mmtm -120.39 37.67 4.2 Favored 'General case' 0 CA--C 1.503 -0.832 0 CA-C-O 121.568 0.699 . . . . 0.0 111.454 -179.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.5 t -113.81 165.42 12.59 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.558 177.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 27.9 t -102.73 136.43 42.57 Favored 'General case' 0 C--N 1.307 -1.255 0 C-N-CA 120.633 -0.427 . . . . 0.0 109.922 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -87.31 -5.26 58.97 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.041 0.448 . . . . 0.0 110.806 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.415 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 69.3 m -80.03 136.01 36.49 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.176 178.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 61.1 p -92.59 152.91 19.34 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.448 -178.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.488 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 45.5 m -66.52 -13.0 60.35 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-O 121.215 0.531 . . . . 0.0 110.795 178.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -86.01 -19.81 29.8 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.248 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 178.2 134.8 2.15 Favored Glycine 0 N--CA 1.438 -1.17 0 C-N-CA 120.976 -0.63 . . . . 0.0 112.033 -178.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 30.9 t -69.03 142.24 54.62 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -112.18 -10.32 13.86 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.502 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 14.5 p -103.67 -39.48 6.67 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.121 -0.632 . . . . 0.0 109.962 177.158 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 122.9 -1.62 9.96 Favored Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.81 -0.709 . . . . 0.0 113.437 177.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.799 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 35.2 mmtp -84.71 -4.12 58.88 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 117.136 0.468 . . . . 0.0 111.526 -178.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 67.85 19.58 9.51 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.273 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.542 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.2 p -69.06 -44.29 72.88 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.132 -179.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.488 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 67.0 p 53.65 27.75 7.17 Favored 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 176.142 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.97 158.62 7.66 Favored Glycine 0 N--CA 1.443 -0.882 0 C-N-CA 120.095 -1.05 . . . . 0.0 112.151 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.91 -26.51 81.3 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 123.159 2.572 . . . . 0.0 113.065 -178.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -60.29 -50.25 74.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.873 0.368 . . . . 0.0 111.467 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.0 m -107.21 19.38 20.45 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.237 -177.271 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.542 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 41.8 t -84.87 135.47 34.06 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 121.183 0.516 . . . . 0.0 111.509 -178.27 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -122.28 13.19 10.31 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.154 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.799 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 3.7 m -99.71 116.72 32.46 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 178.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -106.37 89.38 0.6 Allowed Glycine 0 C--N 1.298 -1.549 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.916 -175.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 39.7 m 66.14 164.72 0.18 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.17 0.588 . . . . 0.0 111.339 -179.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.9 m 69.31 -14.32 0.33 Allowed 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 25.5 t -86.22 165.37 16.56 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 119.873 -0.731 . . . . 0.0 110.932 -178.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.8 m -64.2 -22.69 67.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.738 -178.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.473 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 27.4 p -90.29 4.22 51.36 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.81 178.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.473 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 0.3 OUTLIER . . . . . 0 C--O 1.256 1.403 0 CA-C-O 118.078 -0.963 . . . . 0.0 110.474 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.038 0 N-CA-C 112.168 -0.373 . . . . 0.0 112.168 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.9 t -106.54 148.99 27.58 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 179.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -72.52 -41.57 50.98 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.658 -179.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 51.2 mtmt -103.18 120.57 40.96 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.873 0.368 . . . . 0.0 111.881 -177.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.22 -39.83 2.65 Favored Glycine 0 N--CA 1.448 -0.545 0 CA-C-N 115.921 -0.582 . . . . 0.0 114.032 174.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.6 mptt 66.68 19.14 10.79 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 121.364 0.602 . . . . 0.0 109.982 -177.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -174.44 175.78 46.76 Favored Glycine 0 N--CA 1.433 -1.532 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.148 -179.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.484 ' HA ' ' O ' ' A' ' 29' ' ' GLU . 28.9 mt-10 -64.21 -53.42 49.48 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 120.67 0.271 . . . . 0.0 110.923 -179.367 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 50.4 mtpt 58.04 51.89 8.32 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.341 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.625 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 71.7 m -92.93 139.4 30.57 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.218 177.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 64.4 p -88.08 -179.06 6.11 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.758 -177.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.0 p -62.74 -30.59 71.55 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.196 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.45 -49.43 76.86 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.695 179.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.416 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 43.2 t -67.97 -29.29 68.3 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.431 0.634 . . . . 0.0 110.423 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.4 mmt180 -84.38 15.94 3.36 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.975 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.6 m -107.81 161.09 15.22 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 175.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -123.35 110.87 30.36 Favored Pre-proline 0 C--N 1.315 -0.908 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.724 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -79.17 171.27 65.69 Favored 'Cis proline' 0 C--O 1.239 0.544 0 C-N-CA 123.483 -1.465 . . . . 0.0 111.852 -0.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 95.9 m -55.31 129.06 37.01 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.391 0.615 . . . . 0.0 111.215 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 31.4 mm-40 -94.75 8.89 41.03 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.034 -178.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.534 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 7.4 m -62.26 -37.02 83.85 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.093 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 64.59 -144.56 48.52 Favored Glycine 0 N--CA 1.441 -1.011 0 CA-C-N 115.687 -0.688 . . . . 0.0 113.105 178.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.7 m -88.58 -8.51 54.59 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -178.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -86.66 -54.13 4.56 Favored 'General case' 0 CA--C 1.491 -1.29 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 178.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.68 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 8.6 t 63.48 101.18 0.03 OUTLIER 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 114.358 -1.292 . . . . 0.0 112.467 175.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -97.18 12.15 33.82 Favored 'General case' 0 C--N 1.308 -1.197 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -178.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.625 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 21.8 p -104.12 166.05 10.65 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 119.754 -0.779 . . . . 0.0 111.24 176.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -79.41 -112.49 0.24 Allowed Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.225 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.484 ' O ' ' HA ' ' A' ' 8' ' ' GLU . 46.8 mt-10 -139.84 -173.34 3.61 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -179.205 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.96 -33.8 5.67 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.472 -0.87 . . . . 0.0 113.095 177.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 18.5 p -69.37 -36.88 77.26 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.738 0.304 . . . . 0.0 110.814 -179.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 46.9 p 49.59 43.96 24.2 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.634 -179.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 72.3 m -64.81 172.38 2.85 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.926 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.39 3.29 23.17 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.539 0.685 . . . . 0.0 109.619 177.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -106.45 -72.06 0.73 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.542 -178.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.68 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 7.8 p -80.25 -23.43 40.83 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.183 0.516 . . . . 0.0 111.275 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.524 ' NZ ' ' SG ' ' A' ' 27' ' ' CYS . 11.2 mptt -95.36 105.52 17.48 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-O 121.473 0.654 . . . . 0.0 111.691 179.226 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.4 t -171.7 -173.04 1.11 Allowed 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 114.891 -1.049 . . . . 0.0 108.348 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.441 ' SG ' ' HB2' ' A' ' 41' ' ' CYS . 46.4 t -136.98 127.18 26.26 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 177.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 41.4 m-80 -72.48 -20.28 61.4 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.972 0.415 . . . . 0.0 110.705 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.453 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 49.5 m -68.59 137.15 54.04 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.712 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 77.9 p -117.9 173.38 6.8 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.434 -177.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.1 m -62.08 -20.27 63.84 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 121.04 0.448 . . . . 0.0 110.947 178.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -68.09 -39.59 82.83 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.391 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 176.22 146.51 6.01 Favored Glycine 0 N--CA 1.428 -1.855 0 C-N-CA 120.848 -0.691 . . . . 0.0 111.853 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 45.1 t -63.91 129.7 41.14 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 178.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.453 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 30.8 mmmt -96.23 -12.69 24.23 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -176.261 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.479 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 18.7 p -99.97 -41.4 7.21 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 119.654 -0.818 . . . . 0.0 109.928 177.123 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.46 15.82 9.3 Favored Glycine 0 N--CA 1.433 -1.531 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.816 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.479 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 75.7 mmtt -94.64 6.06 50.01 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 176.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 67.99 37.98 2.88 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.694 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.578 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 26.6 p -113.14 141.9 46.38 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.327 176.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.2 p -136.55 106.4 6.24 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.624 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 90.8 147.86 19.84 Favored Glycine 0 N--CA 1.437 -1.234 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.312 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -59.37 -30.26 92.28 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.327 2.018 . . . . 0.0 111.918 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -63.63 -47.01 83.1 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.565 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.4 m -101.52 19.62 17.59 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.257 -178.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.578 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 44.6 t -75.24 126.63 31.41 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 120.874 0.369 . . . . 0.0 110.375 179.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -99.58 -5.11 29.65 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.366 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.401 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 15.2 m -89.0 142.18 27.85 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.017 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -116.27 73.08 0.27 Allowed Glycine 0 C--N 1.316 -0.575 0 C-N-CA 120.808 -0.711 . . . . 0.0 113.074 -176.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.44 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 9.7 t 65.65 166.39 0.19 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.18 0.592 . . . . 0.0 111.355 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.3 t 70.21 -16.57 0.3 Allowed 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.411 0.684 . . . . 0.0 112.759 177.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . 0.406 ' H ' ' C ' ' A' ' 62' ' ' SER . 20.1 t -76.88 165.16 25.06 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 110.354 -0.239 . . . . 0.0 110.354 -179.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 6.7 m -64.24 -24.59 67.72 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.87 -177.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.433 ' SG ' ' HE2' ' A' ' 67' ' ' LYS . 20.8 p -75.92 -4.09 39.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.922 0.392 . . . . 0.0 111.01 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.44 ' HG3' ' HA ' ' A' ' 62' ' ' SER . 18.0 mmtt . . . . . 0 C--O 1.258 1.517 0 CA-C-O 117.485 -1.245 . . . . 0.0 110.34 -178.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.503 0 N-CA-C 112.333 -0.307 . . . . 0.0 112.333 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.3 p -65.26 -36.78 85.18 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.963 0.411 . . . . 0.0 111.173 179.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -104.91 36.51 4.35 Favored Glycine 0 N--CA 1.443 -0.859 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 179.035 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 61.4 tttm -78.99 108.19 12.29 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-O 121.043 0.449 . . . . 0.0 110.2 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 168.68 127.98 0.96 Allowed Glycine 0 N--CA 1.437 -1.293 0 N-CA-C 111.305 -0.718 . . . . 0.0 111.305 -179.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -119.99 146.85 45.46 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 120.603 0.239 . . . . 0.0 110.387 -179.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 150.49 -165.62 30.03 Favored Glycine 0 CA--C 1.49 -1.482 0 C-N-CA 120.918 -0.658 . . . . 0.0 111.955 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -137.89 179.76 6.24 Favored 'General case' 0 N--CA 1.427 -1.599 0 CA-C-O 121.41 0.624 . . . . 0.0 111.024 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -126.39 37.36 4.33 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 114.969 -1.014 . . . . 0.0 108.387 178.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.632 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 59.4 m -91.34 156.49 17.74 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.659 -1.155 . . . . 0.0 112.617 -176.224 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.3 p -94.16 177.76 5.86 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.465 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.7 m -57.75 -37.74 74.14 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.782 0.29 . . . . 0.0 111.782 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.97 -42.28 98.96 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 120.942 0.401 . . . . 0.0 111.517 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.523 ' HB3' ' HB3' ' A' ' 10' ' ' CYS . 11.7 t -73.83 -25.46 60.1 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.365 0.603 . . . . 0.0 109.635 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 15' ' ' ARG . 42.2 mtt180 -89.78 12.83 15.98 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.411 178.341 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.6 m -89.05 177.71 6.58 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 179.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.468 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 3.4 tm-20 -131.84 111.08 14.61 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-O 120.707 0.289 . . . . 0.0 110.507 178.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.468 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 72.0 Cg_endo -77.94 -170.55 8.85 Favored 'Cis proline' 0 C--N 1.347 0.481 0 C-N-CA 122.926 -1.697 . . . . 0.0 110.924 -2.264 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.7 t -59.46 122.95 15.27 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 120.898 0.38 . . . . 0.0 110.575 -179.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 84.5 mm-40 -110.17 15.73 22.22 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.007 -177.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.853 ' SG ' ' HA ' ' A' ' 25' ' ' CYS . 3.4 t -65.62 -27.88 68.71 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 50.75 -139.01 23.94 Favored Glycine 0 C--N 1.341 0.826 0 CA-C-N 114.704 -1.135 . . . . 0.0 115.345 173.323 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.2 m -84.03 -15.39 47.74 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.101 -0.549 . . . . 0.0 111.293 -177.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.8 mmmt -73.95 -48.75 28.42 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.186 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.853 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 8.2 t 53.59 81.9 0.09 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.74 -179.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -86.61 -11.2 52.12 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.869 -175.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.632 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 30.8 p -82.92 175.52 10.0 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.0 0.428 . . . . 0.0 111.176 -178.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -123.04 -135.57 4.62 Favored Glycine 0 N--CA 1.437 -1.253 0 C-N-CA 120.474 -0.87 . . . . 0.0 112.499 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -74.58 152.29 39.31 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 122.899 0.48 . . . . 0.0 111.071 -179.029 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 94.84 15.92 43.89 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.021 -0.609 . . . . 0.0 112.944 178.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.695 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 16.1 t -114.77 -62.61 1.58 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.103 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 76.3 p 52.38 35.48 17.46 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.124 0.569 . . . . 0.0 111.8 -177.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.695 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -58.35 142.44 48.21 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.339 179.757 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -93.28 18.31 9.78 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 121.392 0.615 . . . . 0.0 109.681 178.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -120.71 -53.55 2.08 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.531 -177.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.581 ' CB ' ' HB3' ' A' ' 21' ' ' CYS . 29.8 p -98.24 -38.93 9.09 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.735 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 11.1 ttmm -107.18 36.01 2.84 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.471 0.653 . . . . 0.0 111.104 -174.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.407 ' O ' ' HD3' ' A' ' 67' ' ' LYS . 14.7 t -96.86 171.27 8.62 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.729 -177.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -99.8 148.59 24.25 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.663 178.656 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -110.28 3.89 20.36 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.656 -178.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 64.8 m -80.08 155.79 27.38 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-O 120.827 0.346 . . . . 0.0 110.712 179.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 54.7 p -122.87 159.15 28.79 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.403 -178.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.5 m -65.03 -27.97 69.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.148 0.499 . . . . 0.0 110.241 179.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -66.52 -32.18 73.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.896 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -174.44 128.36 1.44 Allowed Glycine 0 N--CA 1.437 -1.253 0 C-N-CA 120.89 -0.671 . . . . 0.0 111.759 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.9 t -63.31 144.23 57.12 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 178.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm -104.9 -21.58 13.29 Favored 'General case' 0 C--N 1.317 -0.848 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -175.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 25.7 p -98.12 -41.69 7.81 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.75 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.93 -2.38 19.54 Favored Glycine 0 N--CA 1.443 -0.893 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.094 -178.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.598 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 30.4 mmmt -79.65 -3.33 46.77 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.691 0.281 . . . . 0.0 110.405 178.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 70.16 17.06 7.3 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.513 176.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.55 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 3.4 p -69.5 -37.5 77.24 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.798 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.439 ' HG1' ' C ' ' A' ' 52' ' ' CYS . 44.1 p 52.09 37.39 21.39 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.715 0.806 . . . . 0.0 112.797 177.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 134.44 159.59 8.88 Favored Glycine 0 N--CA 1.439 -1.129 0 C-N-CA 120.148 -1.025 . . . . 0.0 112.296 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.26 -25.52 76.79 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.968 2.445 . . . . 0.0 112.798 -178.399 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -62.01 -40.08 94.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.692 -178.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 40.2 m -115.53 18.35 15.95 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 121.035 0.445 . . . . 0.0 110.626 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.55 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 48.6 t -79.06 120.77 24.1 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.21 0.529 . . . . 0.0 111.067 -178.645 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -108.49 7.48 26.88 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.81 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.598 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 26.5 m -80.77 142.75 33.46 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.656 178.386 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -127.2 82.37 0.35 Allowed Glycine 0 C--N 1.311 -0.842 0 C-N-CA 120.925 -0.655 . . . . 0.0 111.771 -178.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 52.0 m 62.99 171.99 0.15 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.722 0.409 . . . . 0.0 110.992 -178.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 31.6 m 62.81 3.53 1.21 Allowed 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 176.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 33.1 t -101.74 167.26 10.21 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 122.032 -0.417 . . . . 0.0 110.376 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.9 t -68.46 -27.84 66.51 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.748 -177.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 25.6 p -82.55 -0.86 48.73 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.138 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.407 ' HD3' ' O ' ' A' ' 38' ' ' THR . 70.8 mmtt . . . . . 0 C--O 1.263 1.814 0 CA-C-O 117.676 -1.154 . . . . 0.0 110.786 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.365 0 N-CA-C 112.276 -0.33 . . . . 0.0 112.276 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.0 m -132.31 150.32 52.18 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 120.675 0.274 . . . . 0.0 110.503 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 166.95 101.31 0.15 Allowed Glycine 0 N--CA 1.443 -0.862 0 N-CA-C 111.533 -0.627 . . . . 0.0 111.533 -179.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.8 mmmt -83.69 115.24 22.09 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.186 0.517 . . . . 0.0 111.318 -179.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -96.06 -20.43 25.84 Favored Glycine 0 CA--C 1.495 -1.17 0 N-CA-C 109.932 -1.267 . . . . 0.0 109.932 177.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -142.52 122.58 13.7 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 114.908 -0.646 . . . . 0.0 109.309 177.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -97.95 -122.63 4.55 Favored Glycine 0 N--CA 1.441 -1.026 0 C-N-CA 120.374 -0.917 . . . . 0.0 112.738 -179.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.428 ' HB3' ' HD2' ' A' ' 9' ' ' LYS . 11.9 mm-40 -73.03 -85.7 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.328 0.585 . . . . 0.0 112.256 -178.448 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.428 ' HD2' ' HB3' ' A' ' 8' ' ' GLU . 10.8 mptt -127.24 25.25 6.2 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.764 -178.157 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.504 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 85.9 m -88.5 139.1 30.82 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.016 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.409 ' OG1' ' HB2' ' A' ' 26' ' ' GLN . 73.4 p -89.42 -177.62 5.39 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.396 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 11.3 m -64.13 -22.77 67.07 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.064 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.86 -49.39 58.73 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 120.837 0.351 . . . . 0.0 110.737 179.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 36.3 t -73.48 -31.16 63.6 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.002 0.43 . . . . 0.0 110.536 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.553 ' HA ' ' NE ' ' A' ' 15' ' ' ARG . 1.7 mmp_? -74.17 -11.39 60.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.857 179.252 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.9 t -82.11 165.27 20.71 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.439 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 8.0 pt-20 -126.37 115.08 23.36 Favored Pre-proline 0 C--N 1.316 -0.85 0 CA-C-O 120.81 0.338 . . . . 0.0 110.997 -179.294 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.439 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 1.8 Cg_endo -81.27 -174.07 13.4 Favored 'Cis proline' 0 C--N 1.348 0.514 0 C-N-CA 123.58 -1.425 . . . . 0.0 111.722 -0.163 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.5 m -56.63 126.56 27.25 Favored 'General case' 0 CA--C 1.504 -0.814 0 CA-C-O 121.644 0.735 . . . . 0.0 112.55 -178.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -101.92 12.82 36.33 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.738 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 15.1 m -60.99 -28.77 69.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.269 177.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 59.58 -112.6 4.45 Favored Glycine 0 C--N 1.34 0.791 0 CA-C-N 115.74 -0.663 . . . . 0.0 112.028 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 70.3 m -121.43 17.75 11.35 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.147 0.498 . . . . 0.0 110.211 177.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -102.31 -45.83 4.99 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.836 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 55.9 90.94 0.03 OUTLIER 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.608 0.718 . . . . 0.0 110.601 -176.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.409 ' HB2' ' OG1' ' A' ' 11' ' ' THR . 49.4 mt-30 -92.9 -6.08 49.44 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.298 -174.708 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.504 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 26.3 p -88.27 174.06 8.41 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-O 121.101 0.477 . . . . 0.0 111.501 -177.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -118.12 -134.29 5.05 Favored Glycine 0 N--CA 1.443 -0.892 0 C-N-CA 120.936 -0.649 . . . . 0.0 113.242 -179.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -74.25 176.8 6.31 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 123.189 0.595 . . . . 0.0 112.027 -177.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 62.46 31.7 80.49 Favored Glycine 0 CA--C 1.502 -0.76 0 CA-C-N 115.283 -0.871 . . . . 0.0 112.158 178.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 49.3 t -124.9 -76.7 0.59 Allowed 'General case' 0 N--CA 1.423 -1.823 0 C-N-CA 120.651 -0.419 . . . . 0.0 111.909 -177.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 75.1 p 48.73 41.12 17.42 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.548 0.689 . . . . 0.0 110.906 -178.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -54.48 157.41 2.88 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 114.753 -1.112 . . . . 0.0 112.445 -178.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -95.57 21.03 8.75 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.341 0.591 . . . . 0.0 110.386 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -131.55 -63.81 0.82 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.371 -179.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 27.4 p -82.91 -45.2 14.49 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.705 -0.679 . . . . 0.0 112.16 -179.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.0 ttmt -118.79 50.94 1.15 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.192 0.52 . . . . 0.0 112.162 -170.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.7 t -97.62 162.66 13.18 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.707 179.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.428 ' SG ' ' HB2' ' A' ' 41' ' ' CYS . 51.6 t -94.96 140.56 29.78 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -99.64 0.61 42.4 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.837 -179.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.428 ' HB2' ' SG ' ' A' ' 39' ' ' CYS . 62.1 m -82.93 141.09 32.42 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.727 177.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 59.3 p -100.39 164.89 11.72 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 -178.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.435 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 7.9 m -69.55 -9.68 54.97 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 121.299 0.571 . . . . 0.0 110.539 178.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -99.44 -32.77 10.97 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.005 179.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -150.2 128.42 2.67 Favored Glycine 0 N--CA 1.438 -1.187 0 C-N-CA 120.289 -0.958 . . . . 0.0 112.843 -177.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.0 t -80.57 133.73 35.82 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -98.84 -24.78 14.86 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -176.005 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 23.2 p -93.43 -35.41 13.0 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.221 -0.592 . . . . 0.0 110.579 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 110.37 -2.24 29.51 Favored Glycine 0 N--CA 1.438 -1.204 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.932 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -78.4 -7.16 57.04 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.034 0.445 . . . . 0.0 110.47 179.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 64.16 33.6 11.72 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.173 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.448 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 3.1 p -75.1 -49.12 20.69 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.139 178.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.435 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 53.4 p 50.45 76.27 0.15 Allowed 'General case' 0 C--O 1.237 0.423 0 C-N-CA 123.941 0.896 . . . . 0.0 112.432 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 113.84 138.92 7.06 Favored Glycine 0 N--CA 1.436 -1.324 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.714 179.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.437 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 21.8 Cg_endo -62.12 -27.98 79.43 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.783 2.322 . . . . 0.0 112.524 -178.318 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -62.84 -39.51 94.58 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.106 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.4 m -107.05 24.23 13.14 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.487 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.448 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 0.5 OUTLIER -76.04 131.42 39.49 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.772 -178.272 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -106.73 3.77 26.98 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.219 0.533 . . . . 0.0 109.607 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 4.3 m -96.24 167.3 11.28 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.877 -175.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -98.59 -106.63 2.62 Favored Glycine 0 N--CA 1.442 -0.959 0 CA-C-N 115.815 -0.63 . . . . 0.0 112.222 179.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.9 m -131.43 -12.74 3.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.73 0.3 . . . . 0.0 111.591 -178.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 17.4 m -103.0 20.51 17.43 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -175.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 38.2 t -96.75 165.69 12.0 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.838 0.351 . . . . 0.0 110.963 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.6 m -64.18 -25.32 68.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.291 -178.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.502 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 26.7 p -89.84 13.53 14.26 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.725 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.502 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 39.5 mmtm . . . . . 0 C--O 1.264 1.822 0 CA-C-O 117.875 -1.059 . . . . 0.0 110.437 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.461 ' N ' ' HB3' ' A' ' 4' ' ' LYS . . . . . . . . 0 N--CA 1.489 2.201 0 N-CA-C 112.406 -0.278 . . . . 0.0 112.406 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.9 m -76.32 98.52 4.53 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.85 0.357 . . . . 0.0 111.115 -178.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 71.35 19.41 77.53 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.185 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.461 ' HB3' ' N ' ' A' ' 1' ' ' GLY . 28.3 tptp -97.17 -65.6 0.95 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -72.29 -48.52 24.5 Favored Glycine 0 N--CA 1.447 -0.581 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 176.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -162.43 179.68 7.62 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 177.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -104.52 106.31 2.72 Favored Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.189 -1.005 . . . . 0.0 113.807 -176.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -76.25 120.81 22.02 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 176.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 47.8 mtmt -90.89 52.12 2.1 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 121.36 0.6 . . . . 0.0 110.511 -177.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.515 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 78.1 m -80.53 134.9 36.01 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.682 178.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 61.2 p -80.87 177.32 9.12 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.126 -178.784 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.9 p -58.15 -37.16 74.15 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.211 178.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.02 -47.53 82.7 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.862 0.363 . . . . 0.0 110.839 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 47.4 t -68.13 -38.61 82.38 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.163 0.506 . . . . 0.0 110.406 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 29.3 ttt180 -73.05 -9.36 58.65 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.874 -179.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.2 m -71.99 164.57 25.88 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 122.107 -0.37 . . . . 0.0 110.594 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.402 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 0.2 OUTLIER -125.23 114.08 25.99 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.654 178.442 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -75.73 174.34 53.36 Favored 'Cis proline' 0 C--O 1.237 0.438 0 C-N-CA 123.394 -1.503 . . . . 0.0 112.066 -1.184 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.57 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 49.6 t -57.9 132.88 54.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.228 -178.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 79.5 mm-40 -117.59 17.35 14.47 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.958 -179.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.663 ' SG ' ' HA ' ' A' ' 25' ' ' CYS . 3.8 t -60.11 -29.23 68.47 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.966 -179.588 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 81.13 -153.1 33.58 Favored Glycine 0 N--CA 1.431 -1.66 0 CA-C-N 115.463 -0.79 . . . . 0.0 112.195 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.5 m -107.33 11.82 28.73 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -102.53 -30.58 10.89 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.862 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.663 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 1.1 m 65.59 103.78 0.04 OUTLIER 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.568 0.699 . . . . 0.0 112.799 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -95.48 -5.57 42.63 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 115.38 -0.827 . . . . 0.0 108.861 176.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.515 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 22.8 p -92.89 160.12 15.05 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.184 -178.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -79.96 162.15 46.35 Favored Glycine 0 N--CA 1.44 -1.049 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 174.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.24 163.04 23.69 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 117.529 0.664 . . . . 0.0 111.307 -178.283 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 98.19 0.88 58.31 Favored Glycine 0 N--CA 1.439 -1.151 0 N-CA-C 110.311 -1.116 . . . . 0.0 110.311 -175.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 43.2 t -75.46 142.19 42.99 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 75.7 p -103.8 14.18 31.45 Favored 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -175.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.7 m -67.33 133.03 48.86 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.032 175.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -99.69 12.91 35.35 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.645 0.736 . . . . 0.0 109.035 177.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.8 -57.01 2.12 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.403 -178.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.581 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 28.4 p -82.6 -43.62 16.79 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.746 177.538 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.2 ttpm? -101.8 81.15 2.1 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.519 178.564 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.3 t -121.73 155.41 35.3 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 -179.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.409 ' SG ' ' HB2' ' A' ' 41' ' ' CYS . 53.6 t -92.83 135.05 34.48 Favored 'General case' 0 N--CA 1.444 -0.725 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.044 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -92.85 1.34 57.34 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 121.1 0.476 . . . . 0.0 110.881 -178.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.507 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 56.3 m -88.81 133.7 34.17 Favored 'General case' 0 N--CA 1.437 -1.12 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.338 179.197 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 1.6 t -108.69 164.77 12.08 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.337 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.527 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 44.4 m -70.58 -9.88 57.94 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.707 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -88.33 -19.69 26.35 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.432 177.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -179.65 131.11 1.61 Allowed Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.058 -179.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.6 t -76.9 147.84 36.78 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -109.71 -30.89 7.66 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 112.324 0.491 . . . . 0.0 112.324 -177.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.514 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 29.1 p -87.89 -34.18 18.26 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.188 -0.605 . . . . 0.0 111.397 -177.574 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.28 -1.38 31.14 Favored Glycine 0 N--CA 1.445 -0.765 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.507 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.551 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 75.1 mmtt -80.58 -8.64 59.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.029 0.442 . . . . 0.0 109.902 178.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 67.82 30.87 6.08 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.062 -0.972 . . . . 0.0 111.144 178.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.412 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.6 p -72.66 -44.05 62.36 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.157 177.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.527 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 77.7 p 50.78 41.0 25.83 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.72 0.808 . . . . 0.0 112.859 177.146 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 147.4 136.38 2.8 Favored Glycine 0 N--CA 1.437 -1.276 0 C-N-CA 120.384 -0.912 . . . . 0.0 111.731 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -57.2 -24.6 59.97 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.122 2.548 . . . . 0.0 113.621 -178.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -74.22 -35.86 63.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.923 0.392 . . . . 0.0 111.197 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 37.0 t -101.2 10.92 40.29 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.524 0.678 . . . . 0.0 109.746 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.412 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 13.8 t -79.87 110.27 15.07 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.69 -178.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -108.24 -6.95 16.11 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.725 -177.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.551 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.8 p -85.36 157.92 20.4 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.157 -0.617 . . . . 0.0 111.707 -179.165 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -64.6 175.34 12.41 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 115.234 0.854 . . . . 0.0 115.234 -174.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.487 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 14.2 m -77.94 -10.63 59.68 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 123.697 0.799 . . . . 0.0 111.121 -178.698 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.7 m -93.95 9.81 35.95 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.96 0.41 . . . . 0.0 110.676 179.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 44.2 t -81.35 169.63 17.01 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.205 -178.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.8 t -69.97 -24.76 63.37 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.956 -177.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.507 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 22.0 p -82.5 -3.87 56.57 Favored 'General case' 0 CA--C 1.512 -0.515 0 C-N-CA 120.466 -0.493 . . . . 0.0 110.815 -179.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.487 ' HG3' ' HA ' ' A' ' 62' ' ' SER . 38.5 mmtm . . . . . 0 C--O 1.26 1.657 0 CA-C-O 117.533 -1.222 . . . . 0.0 110.449 -177.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.263 0 N-CA-C 112.448 -0.261 . . . . 0.0 112.448 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.1 m -139.1 150.99 46.34 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.686 0.279 . . . . 0.0 110.561 -179.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -122.35 28.29 5.82 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.897 -0.668 . . . . 0.0 111.975 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 44.8 mttm -130.69 156.04 45.59 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.056 0.455 . . . . 0.0 111.326 -178.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -158.63 139.91 6.59 Favored Glycine 0 N--CA 1.437 -1.262 0 N-CA-C 110.294 -1.122 . . . . 0.0 110.294 177.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -122.48 139.19 54.15 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 117.091 0.445 . . . . 0.0 110.333 -179.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -81.52 -100.33 0.39 Allowed Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.423 -0.894 . . . . 0.0 111.29 178.246 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.448 ' H ' ' HG3' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -100.43 -93.71 0.28 Allowed 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 120.796 0.332 . . . . 0.0 110.861 178.091 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.423 ' H ' ' CD ' ' A' ' 8' ' ' GLU . 11.9 mptt -108.03 10.41 28.24 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 176.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.633 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 80.9 m -64.23 150.62 45.52 Favored 'General case' 0 N--CA 1.431 -1.408 0 CA-C-N 114.621 -1.172 . . . . 0.0 112.885 -176.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 65.2 p -109.76 -174.1 2.41 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.116 -179.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.9 t -67.19 -30.05 69.89 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.673 0.273 . . . . 0.0 110.809 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.87 -49.03 79.11 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 120.751 0.31 . . . . 0.0 110.667 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 42.6 t -64.07 -38.81 92.42 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.151 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 26.6 mtp180 -80.55 18.54 0.92 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.3 m -106.06 159.83 15.77 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 173.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -120.09 115.77 32.95 Favored Pre-proline 0 C--N 1.321 -0.661 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.633 -179.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -77.61 169.2 74.37 Favored 'Cis proline' 0 C--N 1.346 0.41 0 C-N-CA 123.115 -1.619 . . . . 0.0 111.033 -2.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 74.6 m -54.02 122.33 9.91 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.088 0.471 . . . . 0.0 110.646 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 32.3 mm-40 -88.89 16.78 6.39 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.987 -175.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.485 ' HB3' ' HA ' ' A' ' 25' ' ' CYS . 2.3 m -64.53 -29.73 70.76 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.953 178.343 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 62.97 -138.86 44.35 Favored Glycine 0 N--CA 1.444 -0.802 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.838 -179.082 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.6 m -98.86 12.01 37.05 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 121.028 0.442 . . . . 0.0 110.233 178.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -97.51 -53.18 3.52 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.638 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 0.1 OUTLIER 64.84 99.36 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.916 -1.038 . . . . 0.0 112.355 178.23 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -90.65 -14.3 32.57 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.666 -178.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.633 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 31.6 p -87.68 -175.1 5.06 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.029 0.443 . . . . 0.0 111.698 -177.078 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.23 -110.01 0.6 Allowed Glycine 0 N--CA 1.442 -0.915 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.43 179.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -160.77 0.0 0.06 Allowed 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -176.132 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -86.76 -6.96 79.17 Favored Glycine 0 C--N 1.301 -1.377 0 C-N-CA 121.077 -0.583 . . . . 0.0 113.719 -175.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.513 ' SG ' ' HE2' ' A' ' 37' ' ' LYS . 3.8 p -75.71 -29.67 59.03 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 120.837 0.351 . . . . 0.0 110.917 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 63.6 p 50.06 42.12 24.4 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.492 0.717 . . . . 0.0 112.251 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.436 ' SG ' ' HB2' ' A' ' 31' ' ' CYS . 58.3 m -66.62 177.31 1.62 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.881 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -111.7 -0.27 16.07 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 121.243 0.544 . . . . 0.0 110.222 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.49 -67.23 0.88 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.569 -178.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.638 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 7.9 p -85.05 -13.45 50.37 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.222 0.534 . . . . 0.0 110.942 179.528 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.584 ' NZ ' ' SG ' ' A' ' 27' ' ' CYS . 11.2 mptt -105.71 45.19 0.98 Allowed 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 121.585 0.707 . . . . 0.0 110.982 178.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 8.8 t -91.31 128.44 37.14 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.595 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.9 t -92.27 135.28 34.14 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -89.06 -6.57 57.02 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-O 121.143 0.497 . . . . 0.0 110.704 -178.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.529 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 36.8 m -81.43 133.24 35.38 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.658 178.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 74.9 p -109.42 170.73 7.87 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.161 -177.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.9 m -71.75 -9.93 59.02 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.164 0.506 . . . . 0.0 110.403 178.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -80.43 -40.36 26.49 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.968 178.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -169.18 139.39 5.6 Favored Glycine 0 N--CA 1.437 -1.287 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.767 -179.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 19.1 t -79.97 129.75 34.74 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 120.702 0.287 . . . . 0.0 110.431 179.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -87.99 -39.7 14.48 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.473 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 16.6 p -78.01 -33.13 51.33 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 119.97 -0.692 . . . . 0.0 110.264 -178.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 104.72 0.22 42.55 Favored Glycine 0 N--CA 1.438 -1.192 0 C-N-CA 120.79 -0.719 . . . . 0.0 113.262 177.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.473 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 28.5 mmtp -82.4 -1.69 50.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 117.15 0.475 . . . . 0.0 110.991 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 68.88 23.07 6.91 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.44 176.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . . . . . . . . . 1.8 p -70.74 -47.2 60.93 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.919 177.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 47.6 p 51.43 31.63 7.58 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.876 0.87 . . . . 0.0 112.864 177.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 159.16 145.84 4.37 Favored Glycine 0 N--CA 1.436 -1.343 0 C-N-CA 120.534 -0.841 . . . . 0.0 111.897 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.56 -30.87 51.53 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.903 2.402 . . . . 0.0 113.302 -177.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -76.16 -17.67 59.45 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.287 0.565 . . . . 0.0 110.485 -178.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.8 m -117.17 18.52 14.51 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.095 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -73.11 130.26 39.89 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.645 -178.523 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.44 ' HB3' ' HZ1' ' A' ' 59' ' ' LYS . 1.0 OUTLIER -113.65 6.4 16.9 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.616 -177.905 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -122.9 159.07 29.0 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.754 -177.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -77.33 -164.82 22.88 Favored Glycine 0 C--N 1.332 0.327 0 CA-C-N 115.983 -0.553 . . . . 0.0 113.761 -177.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.463 ' OG ' ' HE3' ' A' ' 37' ' ' LYS . 4.0 m -85.7 -10.39 55.73 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 122.923 0.489 . . . . 0.0 111.753 -176.644 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.0 m -89.2 13.08 14.12 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.147 0.499 . . . . 0.0 110.353 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 11.5 t -90.68 170.06 10.46 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.355 -178.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.9 p -76.31 -16.18 59.83 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -176.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.552 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 21.6 p -87.15 2.66 49.2 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.988 0.423 . . . . 0.0 110.723 178.497 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.552 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 11.3 mmtp . . . . . 0 C--O 1.265 1.884 0 CA-C-O 117.686 -1.15 . . . . 0.0 110.91 -176.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 N-CA-C 112.354 -0.298 . . . . 0.0 112.354 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 43.0 m -81.81 150.44 27.86 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-O 120.76 0.314 . . . . 0.0 110.418 179.274 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 99.3 5.12 56.11 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.213 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.2 pttm -76.07 132.26 39.98 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.902 0.382 . . . . 0.0 110.562 179.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -79.04 83.99 1.26 Allowed Glycine 0 N--CA 1.442 -0.957 0 C-N-CA 121.192 -0.528 . . . . 0.0 112.217 -178.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -92.13 -27.41 17.75 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.648 0.261 . . . . 0.0 110.299 179.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 59.61 -117.64 11.86 Favored Glycine 0 CA--C 1.503 -0.71 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.303 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -146.47 137.48 24.26 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 178.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -77.77 -0.75 28.23 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.82 -178.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.673 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 93.6 m -82.09 143.66 31.33 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-O 121.191 0.52 . . . . 0.0 111.522 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 67.1 p -93.52 -179.28 4.98 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.348 -179.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.9 m -66.38 -21.39 66.23 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.959 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.57 -45.95 67.5 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-O 120.829 0.347 . . . . 0.0 111.042 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.412 ' HB2' ' HB3' ' A' ' 27' ' ' CYS . 22.6 t -68.1 -31.49 71.13 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.233 0.539 . . . . 0.0 110.226 -179.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 31.5 mmt180 -90.57 9.57 28.97 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.007 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.1 t -83.76 169.55 15.1 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.459 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 33.5 mm-40 -119.34 105.69 43.85 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.713 -0.222 . . . . 0.0 111.083 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.459 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 1.6 Cg_endo -83.85 -173.33 10.72 Favored 'Cis proline' 0 N--CA 1.456 -0.685 0 C-N-CA 123.888 -1.297 . . . . 0.0 111.314 -1.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 15.1 t -56.42 123.3 14.25 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.015 0.436 . . . . 0.0 110.54 -178.365 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -108.75 20.59 18.31 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.717 -176.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.67 -35.74 77.01 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 120.78 0.324 . . . . 0.0 111.205 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.26 -169.97 54.67 Favored Glycine 0 N--CA 1.44 -1.049 0 C-N-CA 121.131 -0.557 . . . . 0.0 112.83 178.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 24.5 m -77.53 -11.82 59.9 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.688 0.28 . . . . 0.0 111.301 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -86.55 -31.74 21.07 Favored 'General case' 0 CA--C 1.507 -0.688 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.0 t 66.54 105.83 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.805 -176.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -110.4 28.49 8.59 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.818 -173.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.565 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 9.1 p -124.25 -164.81 1.29 Allowed 'General case' 0 C--N 1.312 -1.062 0 CA-C-O 120.665 0.269 . . . . 0.0 110.555 178.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -114.25 153.95 17.28 Favored Glycine 0 N--CA 1.442 -0.91 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -79.09 84.07 5.11 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.489 0.662 . . . . 0.0 111.269 -176.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -168.82 23.89 0.1 Allowed Glycine 0 C--N 1.301 -1.373 0 N-CA-C 110.634 -0.986 . . . . 0.0 110.634 177.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.701 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 28.6 p -112.95 -21.29 11.19 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.682 -0.259 . . . . 0.0 111.572 -177.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 38.4 p 49.08 39.14 14.39 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.464 0.649 . . . . 0.0 109.951 -173.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.701 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 1.8 t -66.73 149.91 49.85 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.555 -176.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -104.52 22.61 14.67 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.148 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -126.17 -58.17 1.37 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.069 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 7.8 p -83.74 -44.45 14.42 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.318 0.58 . . . . 0.0 110.034 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -86.24 82.79 7.9 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.148 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.444 ' O ' ' HD3' ' A' ' 67' ' ' LYS . 14.1 t -142.88 174.28 10.8 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.83 -179.412 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.501 ' SG ' ' HB2' ' A' ' 66' ' ' CYS . 48.7 t -114.01 145.19 41.9 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.1 0.476 . . . . 0.0 110.939 -178.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -102.26 -4.79 25.14 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.87 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.607 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 61.7 m -77.98 151.07 33.81 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.798 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 63.2 p -121.23 169.47 10.53 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.453 -178.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.47 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 14.4 m -68.97 -27.07 65.39 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.172 0.51 . . . . 0.0 110.574 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -81.17 -34.4 32.4 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.28 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -153.84 131.86 3.38 Favored Glycine 0 N--CA 1.436 -1.304 0 C-N-CA 120.323 -0.942 . . . . 0.0 112.511 -177.184 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 4.4 t -86.27 135.86 33.38 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -93.47 -28.02 16.35 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -176.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 21.7 p -92.97 -30.68 15.23 Favored 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.829 -178.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.5 9.6 52.65 Favored Glycine 0 N--CA 1.444 -0.831 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.883 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -90.64 -4.6 56.68 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.956 0.407 . . . . 0.0 110.303 178.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 65.67 26.55 11.46 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.213 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.554 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 4.4 p -66.82 -46.94 73.59 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 176.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.47 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 52.0 p 50.78 72.79 0.32 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 114.915 -1.038 . . . . 0.0 113.184 176.051 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 111.96 140.26 8.0 Favored Glycine 0 N--CA 1.444 -0.816 0 C-N-CA 120.713 -0.756 . . . . 0.0 111.876 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.71 -29.61 86.2 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.103 2.536 . . . . 0.0 112.846 -177.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -64.16 -39.23 93.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.979 0.419 . . . . 0.0 111.229 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.6 t -106.16 17.34 23.66 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.288 0.565 . . . . 0.0 109.941 -179.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.554 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 19.3 t -86.64 111.01 20.24 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.124 -178.481 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -106.3 -2.5 22.24 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.716 -177.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.9 m -71.72 154.63 41.21 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.636 -179.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.526 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -74.53 -179.56 41.92 Favored Glycine 0 N--CA 1.443 -0.875 0 C-N-CA 120.477 -0.868 . . . . 0.0 111.258 176.587 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.6 m -80.31 4.28 18.3 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.893 0.377 . . . . 0.0 111.88 -178.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.0 m -109.98 12.7 23.62 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.917 0.389 . . . . 0.0 110.587 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 22.2 t -86.59 166.88 15.06 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.559 -178.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.5 m -62.62 -26.52 68.66 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -177.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.607 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 6.1 p -81.18 -6.71 59.15 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.779 0.323 . . . . 0.0 111.8 -178.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.526 ' HG3' ' O ' ' A' ' 61' ' ' GLY . 13.2 mmtp . . . . . 0 C--O 1.261 1.659 0 CA-C-O 117.955 -1.021 . . . . 0.0 111.326 -177.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.177 0 N-CA-C 112.553 -0.219 . . . . 0.0 112.553 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.6 t -80.64 -46.24 15.94 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.983 0.421 . . . . 0.0 110.562 -179.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 143.09 -172.81 24.44 Favored Glycine 0 N--CA 1.439 -1.147 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.074 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt -93.05 -66.78 0.9 Allowed 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 120.513 0.197 . . . . 0.0 111.249 -178.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.99 109.65 1.91 Allowed Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.858 -0.686 . . . . 0.0 111.665 -179.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.446 ' HG2' ' O ' ' A' ' 7' ' ' GLY . 21.2 ttpp -142.79 134.94 27.31 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 120.794 0.33 . . . . 0.0 110.984 -178.136 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . 0.446 ' O ' ' HG2' ' A' ' 6' ' ' LYS . . . -90.07 175.29 41.34 Favored Glycine 0 N--CA 1.438 -1.18 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 175.291 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 17.0 mp0 -59.04 -56.97 15.35 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 116.934 0.367 . . . . 0.0 111.168 178.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? 176.82 -40.48 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.574 ' SG ' ' HB2' ' A' ' 27' ' ' CYS . 88.5 m -57.82 139.81 53.23 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.481 -0.782 . . . . 0.0 111.217 178.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.8 p -80.69 174.22 11.83 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.793 -178.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.8 p -61.84 -28.55 69.57 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.126 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.85 -43.45 75.44 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.547 179.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.743 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 18.3 t -69.97 -36.33 75.14 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.033 -178.213 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.9 ttt180 -79.84 -9.24 59.64 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.437 -177.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.9 t -80.16 161.86 25.02 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.552 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 9.4 pt-20 -136.31 123.77 14.58 Favored Pre-proline 0 C--N 1.316 -0.886 0 CA-C-O 120.784 0.326 . . . . 0.0 111.437 -179.408 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.552 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 40.6 Cg_endo -64.36 157.9 71.89 Favored 'Cis proline' 0 C--N 1.348 0.525 0 C-N-CA 123.158 -1.601 . . . . 0.0 112.038 0.889 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.648 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 44.4 t -60.9 130.36 46.06 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.948 -177.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 78.3 mm-40 -101.94 13.75 33.9 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.897 -177.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.743 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -70.45 -16.49 62.94 Favored 'General case' 0 C--O 1.209 -1.043 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.057 -179.314 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.79 -30.26 56.3 Favored Glycine 0 CA--C 1.525 0.664 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.69 -179.243 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 53.1 p -64.64 -48.5 74.61 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -130.49 -46.18 1.08 Allowed 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 120.664 0.269 . . . . 0.0 111.384 -178.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.626 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 8.3 t 64.06 82.29 0.19 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.362 -179.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -117.51 20.07 13.7 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.491 -177.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.574 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 24.5 p -75.46 163.06 27.79 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.042 178.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -103.12 25.25 27.85 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.183 -1.008 . . . . 0.0 111.549 177.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.421 ' CD ' ' H ' ' A' ' 30' ' ' GLY . 0.0 OUTLIER 66.14 -175.19 0.19 Allowed 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.337 0.655 . . . . 0.0 110.444 -177.676 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.421 ' H ' ' CD ' ' A' ' 29' ' ' GLU . . . 87.28 10.29 71.44 Favored Glycine 0 N--CA 1.434 -1.442 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 -176.371 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.569 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 7.3 p -100.49 -26.45 13.85 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 114.651 -0.775 . . . . 0.0 109.685 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.413 ' HG1' ' C ' ' A' ' 31' ' ' CYS . 46.6 p 53.06 36.43 22.18 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.945 -179.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 62.6 m -66.14 167.34 10.22 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.701 179.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -117.91 11.87 13.59 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.316 -0.857 . . . . 0.0 108.841 176.48 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -110.68 -67.74 0.97 Allowed 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.467 -178.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.626 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 28.2 p -77.91 -44.62 26.43 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-O 121.368 0.604 . . . . 0.0 109.443 178.677 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 58.4 tttp -84.17 108.64 17.19 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.098 178.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.0 t -179.26 164.16 1.34 Allowed 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 178.739 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.6 t -96.21 143.69 27.08 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -103.17 5.44 37.78 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.892 0.377 . . . . 0.0 111.48 -177.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.433 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 60.9 m -85.61 146.7 26.75 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.014 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 60.2 p -120.66 161.52 21.24 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.485 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 35.4 m -63.03 -27.76 69.63 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.091 0.472 . . . . 0.0 110.413 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.93 -36.01 79.42 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.952 178.433 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -164.01 128.98 1.91 Allowed Glycine 0 N--CA 1.437 -1.27 0 C-N-CA 120.351 -0.928 . . . . 0.0 112.73 -179.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 6.8 t -79.18 124.41 28.32 Favored 'General case' 0 N--CA 1.439 -1.005 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.428 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 33.4 mmtp -76.35 -42.82 43.48 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.719 -176.09 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 19.8 p -84.21 -38.3 20.76 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 120.901 0.381 . . . . 0.0 110.749 -177.261 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.12 3.44 27.88 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.819 -0.705 . . . . 0.0 113.107 179.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.636 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 73.5 mmtt -81.55 -3.9 54.52 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.981 0.391 . . . . 0.0 111.008 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 65.34 24.98 12.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.962 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.485 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.3 p -71.7 -47.63 52.75 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 176.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.485 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 82.5 p 51.94 28.92 5.56 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 115.135 -0.939 . . . . 0.0 113.472 175.511 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 164.09 140.77 2.95 Favored Glycine 0 N--CA 1.436 -1.325 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -56.36 -37.31 97.24 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.976 2.451 . . . . 0.0 113.532 -177.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -67.4 -40.88 85.66 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.848 0.356 . . . . 0.0 111.019 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 40.7 m -94.37 15.34 17.86 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.601 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.485 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 24.5 t -85.4 135.07 34.03 Favored 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.15 -179.082 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -113.15 -6.28 13.66 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.218 -179.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.636 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 13.9 m -77.52 157.51 30.36 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.836 -178.185 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -86.05 -108.99 0.76 Allowed Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.377 -179.024 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.2 m -135.16 -2.39 2.54 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 120.543 0.211 . . . . 0.0 111.414 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 18.6 m -106.27 5.11 29.47 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.941 0.401 . . . . 0.0 111.457 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 29.9 t -82.8 167.0 18.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.333 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.7 t -70.61 -16.33 62.83 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.798 -177.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.433 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 24.7 p -88.72 2.11 53.95 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.366 -0.533 . . . . 0.0 111.322 179.396 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 25.2 mmtp . . . . . 0 C--O 1.261 1.704 0 CA-C-O 117.67 -1.157 . . . . 0.0 110.866 -179.107 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.942 0 N-CA-C 112.563 -0.215 . . . . 0.0 112.563 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.2 m -96.35 -3.24 44.14 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.059 0.457 . . . . 0.0 110.992 -179.112 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 115.44 119.96 3.3 Favored Glycine 0 N--CA 1.44 -1.04 0 N-CA-C 111.087 -0.805 . . . . 0.0 111.087 -178.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.9 mtmt -70.74 84.9 0.65 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.377 0.608 . . . . 0.0 111.366 -178.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -162.02 25.22 0.23 Allowed Glycine 0 N--CA 1.442 -0.908 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.367 178.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -77.32 -21.15 53.89 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 121.254 0.549 . . . . 0.0 110.013 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -67.06 148.17 50.06 Favored Glycine 0 N--CA 1.432 -1.629 0 CA-C-N 115.243 -0.889 . . . . 0.0 112.037 179.136 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -66.97 -43.59 82.7 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 179.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt 58.81 31.02 20.82 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.197 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.569 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 91.5 m -85.65 152.87 22.76 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-O 121.371 0.605 . . . . 0.0 111.838 -179.591 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 81.3 p -92.02 176.27 6.57 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.81 -177.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.9 m -67.16 -21.73 65.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.148 0.499 . . . . 0.0 110.079 178.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.0 -47.56 36.26 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.32 178.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.632 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 10.2 t -66.44 -33.56 75.97 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.382 0.611 . . . . 0.0 109.667 179.478 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.7 mmt180 -91.22 21.27 4.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.844 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.6 t -94.45 -178.55 4.61 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 178.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -131.09 101.93 16.18 Favored Pre-proline 0 CA--C 1.543 0.687 0 CA-C-O 120.709 0.29 . . . . 0.0 111.292 -178.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -81.41 -174.94 14.79 Favored 'Cis proline' 0 N--CA 1.461 -0.416 0 C-N-CA 123.625 -1.406 . . . . 0.0 111.072 -0.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.714 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 48.6 t -59.49 127.9 34.35 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.038 0.447 . . . . 0.0 110.829 -179.653 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -112.04 17.62 19.46 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 -179.344 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.714 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 0.5 OUTLIER -64.86 -23.15 67.15 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.348 -177.341 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.71 -12.04 9.18 Favored Glycine 0 CA--C 1.528 0.883 0 C-N-CA 121.303 -0.475 . . . . 0.0 113.723 -177.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.4 m -68.6 -35.58 77.53 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 122.727 -0.278 . . . . 0.0 110.992 179.078 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 69.3 mttm -146.19 -43.28 0.2 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 122.899 0.48 . . . . 0.0 110.323 178.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.659 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 10.5 t 67.24 74.12 0.32 Allowed 'General case' 0 CA--C 1.504 -0.8 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.051 -179.133 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -104.82 10.55 34.44 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 114.572 -1.195 . . . . 0.0 110.84 -175.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.538 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 21.0 p -75.75 -178.71 4.36 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.155 0.502 . . . . 0.0 111.072 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.92 -141.36 10.57 Favored Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 115.789 -0.642 . . . . 0.0 111.915 177.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.44 ' HA ' ' HE2' ' A' ' 37' ' ' LYS . 8.2 mp0 -123.77 13.65 9.28 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.168 0.508 . . . . 0.0 110.734 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -84.48 -30.79 26.43 Favored Glycine 0 C--N 1.306 -1.112 0 C-N-CA 120.819 -0.705 . . . . 0.0 113.183 -177.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.772 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 20.3 p -67.96 -34.13 75.97 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -176.288 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 58.9 p 53.1 33.7 15.64 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.8 0.809 . . . . 0.0 109.994 -173.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.772 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -62.56 117.04 5.68 Favored 'General case' 0 C--O 1.222 -0.365 0 CA-C-N 114.276 -1.329 . . . . 0.0 110.37 -178.655 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -86.11 20.25 2.37 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.385 0.612 . . . . 0.0 110.831 -177.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -109.42 -48.92 3.17 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.029 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.572 ' SG ' ' HG3' ' A' ' 37' ' ' LYS . 26.2 p -94.24 -41.5 9.44 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.569 177.673 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.572 ' HG3' ' SG ' ' A' ' 36' ' ' CYS . 26.3 mtpp -99.26 88.86 4.03 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.837 -178.508 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 12.3 t -144.83 172.2 13.35 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.738 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.476 ' HA ' ' O ' ' A' ' 66' ' ' CYS . 35.8 t -92.17 133.9 35.36 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -83.9 -17.7 39.89 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.155 0.502 . . . . 0.0 110.224 -177.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.404 ' HB3' ' HA ' ' A' ' 46' ' ' CYS . 37.4 m -69.57 136.34 51.17 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.001 -176.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 82.3 p -99.64 166.26 11.21 Favored 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 178.106 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.455 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 46.9 m -64.03 -26.79 68.72 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.922 0.392 . . . . 0.0 111.8 -178.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -88.47 -30.7 19.2 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.717 -179.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -143.34 119.29 1.32 Allowed Glycine 0 N--CA 1.445 -0.753 0 C-N-CA 119.784 -1.198 . . . . 0.0 113.697 -175.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.404 ' HA ' ' HB3' ' A' ' 41' ' ' CYS . 17.5 t -78.07 126.99 31.62 Favored 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 177.419 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.468 ' HZ2' ' HB3' ' A' ' 47' ' ' LYS . 3.2 mmmp? -82.05 -36.57 27.56 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -176.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.487 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 21.5 p -91.95 -37.93 12.56 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.897 -177.474 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.2 11.36 13.74 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 120.739 -0.743 . . . . 0.0 113.816 178.505 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.744 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 32.4 mmtp -88.23 -3.2 58.9 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 117.331 0.565 . . . . 0.0 110.985 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 65.61 17.49 10.92 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.139 -177.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.541 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.2 p -64.57 -47.29 79.26 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 177.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.461 ' HG1' ' C ' ' A' ' 52' ' ' CYS . 53.2 p 49.88 44.54 25.23 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.189 -0.914 . . . . 0.0 113.063 174.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.412 ' O ' ' HB2' ' A' ' 58' ' ' CYS . . . 135.1 150.28 6.02 Favored Glycine 0 N--CA 1.438 -1.206 0 C-N-CA 120.624 -0.798 . . . . 0.0 111.587 179.738 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -61.81 -22.53 74.56 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.845 2.363 . . . . 0.0 112.559 -177.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -63.12 -52.56 62.07 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.645 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.1 m -104.12 20.73 17.74 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.788 -177.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.541 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 48.8 t -86.91 137.58 32.26 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-O 121.213 0.53 . . . . 0.0 111.229 -178.499 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -118.67 3.26 11.71 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.569 -179.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.744 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 5.5 m -91.15 117.43 29.61 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 -179.664 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -97.56 82.4 0.69 Allowed Glycine 0 C--N 1.303 -1.257 0 CA-C-N 115.517 -0.765 . . . . 0.0 112.578 -175.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.8 m 63.77 170.28 0.16 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.016 0.526 . . . . 0.0 111.386 -178.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.4 m 70.87 -25.16 0.17 Allowed 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 176.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 38.0 t -72.05 167.73 19.58 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 121.919 -0.488 . . . . 0.0 111.288 -176.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 32.3 t -62.59 -27.44 69.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.592 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.476 ' O ' ' HA ' ' A' ' 39' ' ' CYS . 32.1 p -85.87 8.44 20.16 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.018 179.56 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.436 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 1.0 OUTLIER . . . . . 0 C--O 1.262 1.727 0 CA-C-O 118.037 -0.982 . . . . 0.0 111.064 -178.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.188 0 N-CA-C 112.317 -0.313 . . . . 0.0 112.317 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.9 m -135.83 115.15 12.54 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.759 0.314 . . . . 0.0 110.682 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -105.17 -76.73 1.08 Allowed Glycine 0 N--CA 1.443 -0.847 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 177.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -162.15 154.46 19.38 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 177.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -145.92 167.69 27.69 Favored Glycine 0 N--CA 1.441 -1.023 0 C-N-CA 120.559 -0.829 . . . . 0.0 111.816 -179.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp -125.87 178.87 5.47 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -104.4 -175.91 25.16 Favored Glycine 0 N--CA 1.44 -1.052 0 C-N-CA 120.58 -0.819 . . . . 0.0 111.4 178.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -83.41 117.52 23.1 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 121.095 0.474 . . . . 0.0 110.471 179.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -73.93 -13.64 60.92 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.246 -177.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.558 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 57.4 m -88.49 145.04 25.98 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-O 121.298 0.57 . . . . 0.0 112.27 -176.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.3 p -77.16 176.05 9.09 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.775 -178.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.8 m -62.45 -32.8 73.73 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.135 178.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.9 -52.22 64.97 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.271 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.658 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 43.5 t -67.15 -28.67 68.31 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.571 0.7 . . . . 0.0 110.81 -179.366 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.1 ttm180 -79.66 -5.13 54.49 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.371 -177.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.9 m -85.44 167.48 15.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.086 0.47 . . . . 0.0 111.924 -177.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -127.59 108.72 20.78 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.683 177.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -76.15 169.67 73.86 Favored 'Cis proline' 0 C--O 1.237 0.458 0 C-N-CA 123.457 -1.476 . . . . 0.0 112.157 0.055 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.658 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 41.7 t -61.03 140.36 57.86 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.004 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 -117.28 19.81 13.95 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.296 -177.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.535 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.1 OUTLIER -67.46 -31.25 71.29 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.981 0.419 . . . . 0.0 109.922 179.899 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 72.58 -168.03 53.18 Favored Glycine 0 N--CA 1.442 -0.924 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.633 178.828 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.8 p -80.22 -11.98 59.68 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.825 0.345 . . . . 0.0 110.675 178.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -77.51 -42.08 36.92 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 178.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 8.7 t 65.53 99.22 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.516 -1.22 . . . . 0.0 111.296 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -100.83 -0.8 36.32 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.375 -0.829 . . . . 0.0 112.513 -176.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.558 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 7.3 p -91.94 164.13 13.76 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 120.837 0.351 . . . . 0.0 111.677 -176.408 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -86.21 148.33 22.17 Favored Glycine 0 N--CA 1.441 -1.014 0 N-CA-C 109.101 -1.6 . . . . 0.0 109.101 172.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -77.72 89.57 3.99 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 117.769 0.785 . . . . 0.0 112.163 -174.035 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -158.17 25.25 0.4 Allowed Glycine 0 N--CA 1.435 -1.383 0 N-CA-C 110.022 -1.231 . . . . 0.0 110.022 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.582 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 26.2 p -115.12 -28.73 6.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.143 -0.528 . . . . 0.0 112.121 -175.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 57.4 p 54.27 29.07 10.07 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.4 0.619 . . . . 0.0 110.015 -171.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.582 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 2.1 t -57.64 140.25 51.62 Favored 'General case' 0 C--N 1.346 0.453 0 CA-C-N 114.744 -1.116 . . . . 0.0 110.273 -177.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -93.8 16.8 13.24 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 120.922 0.391 . . . . 0.0 111.171 -176.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -116.53 -57.02 2.23 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.561 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.535 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 6.1 p -89.41 -43.15 11.08 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.717 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -84.39 74.21 10.39 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 121.683 0.754 . . . . 0.0 109.825 178.097 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.9 t -125.77 149.74 48.32 Favored 'General case' 0 N--CA 1.431 -1.412 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.988 -179.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.1 t -100.58 128.99 46.46 Favored 'General case' 0 N--CA 1.442 -0.869 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 177.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -90.99 -1.52 57.81 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.487 -178.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.559 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 61.6 m -75.93 136.68 40.07 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.637 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 61.0 p -102.74 165.01 11.3 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.091 -178.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.1 m -71.23 -10.35 59.61 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.182 0.515 . . . . 0.0 110.356 177.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -89.86 -32.31 16.95 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.745 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -164.71 132.82 2.79 Favored Glycine 0 N--CA 1.435 -1.399 0 C-N-CA 120.796 -0.716 . . . . 0.0 111.991 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 4.7 t -72.73 136.37 45.51 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 179.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -95.97 -22.35 17.45 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 111.938 0.348 . . . . 0.0 111.938 -176.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.465 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 21.8 p -99.69 -39.97 8.0 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.499 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.65 3.62 25.24 Favored Glycine 0 N--CA 1.437 -1.258 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.948 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.465 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 46.3 mmtm -81.37 -6.04 58.5 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 120.964 0.411 . . . . 0.0 110.251 178.318 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 68.94 20.91 7.71 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.664 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.483 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 4.7 p -71.2 -41.57 70.11 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.418 178.756 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.1 p 52.93 29.48 7.89 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.857 0.863 . . . . 0.0 113.297 177.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 149.32 159.18 8.46 Favored Glycine 0 N--CA 1.44 -1.1 0 C-N-CA 119.887 -1.149 . . . . 0.0 112.838 178.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 58.0 Cg_endo -69.64 -11.95 32.09 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 123.113 2.542 . . . . 0.0 112.779 -178.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -84.08 -10.07 58.11 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.029 0.442 . . . . 0.0 110.835 -178.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.8 m -142.58 26.36 1.77 Allowed 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.146 0.498 . . . . 0.0 110.112 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.483 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 0.5 OUTLIER -71.11 122.76 20.69 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.998 -177.919 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -100.05 4.28 44.59 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.936 -178.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.432 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.2 p -137.91 157.45 46.38 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.05 -174.353 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -150.15 171.89 30.05 Favored Glycine 0 N--CA 1.439 -1.101 0 C-N-CA 120.022 -1.085 . . . . 0.0 113.563 -178.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.5 m 63.53 -84.79 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 124.489 1.116 . . . . 0.0 113.855 177.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.2 m -117.4 66.33 0.73 Allowed 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -174.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 41.3 t -112.84 166.61 11.22 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 173.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.409 ' HB2' ' HA ' ' A' ' 48' ' ' CYS . 7.4 m -64.61 -9.39 19.05 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 122.719 0.407 . . . . 0.0 112.028 -177.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.559 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 25.0 p -104.62 -11.02 17.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.722 0.296 . . . . 0.0 111.227 177.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.477 ' NZ ' ' SG ' ' A' ' 58' ' ' CYS . 3.5 mmpp? . . . . . 0 C--O 1.251 1.164 0 CA-C-O 117.317 -1.325 . . . . 0.0 110.156 -178.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.393 0 N-CA-C 112.329 -0.309 . . . . 0.0 112.329 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.8 t -114.56 -0.13 13.79 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.946 0.403 . . . . 0.0 110.658 -179.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 124.73 138.6 5.09 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.676 -0.773 . . . . 0.0 111.946 -179.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.46 ' HE2' ' O ' ' A' ' 30' ' ' GLY . 14.3 mptt -98.92 140.41 33.12 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.014 0.435 . . . . 0.0 111.457 -179.323 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -91.2 -26.38 21.52 Favored Glycine 0 N--CA 1.44 -1.05 0 N-CA-C 109.898 -1.281 . . . . 0.0 109.898 174.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -79.32 130.05 35.06 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 115.049 -0.576 . . . . 0.0 110.334 177.771 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -82.0 86.33 1.43 Allowed Glycine 0 N--CA 1.433 -1.5 0 C-N-CA 120.714 -0.755 . . . . 0.0 111.454 178.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 63.3 mm-40 -65.38 -88.53 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.73 0.3 . . . . 0.0 111.0 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 42.7 mtmt -153.51 50.53 0.7 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.251 0.548 . . . . 0.0 110.202 179.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.456 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 85.6 m -98.68 130.91 45.19 Favored 'General case' 0 C--N 1.301 -1.503 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.003 178.065 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.6 p -76.35 178.09 6.79 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.085 0.469 . . . . 0.0 111.871 -176.252 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.468 ' HA ' ' HG2' ' A' ' 15' ' ' ARG . 16.6 m -57.37 -33.23 67.58 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.143 -179.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.5 -44.86 81.44 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.331 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.4 ' HB3' ' HB3' ' A' ' 10' ' ' CYS . 37.4 t -69.97 -34.49 73.46 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.096 0.474 . . . . 0.0 111.208 -177.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.468 ' HG2' ' HA ' ' A' ' 12' ' ' SER . 9.2 ptm85 -78.36 -6.81 56.24 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.519 -0.472 . . . . 0.0 111.475 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.3 m -79.5 153.43 29.58 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 179.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -126.41 119.75 23.29 Favored Pre-proline 0 C--N 1.312 -1.028 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.295 179.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -69.61 160.89 86.83 Favored 'Cis proline' 0 C--O 1.243 0.748 0 C-N-CA 123.438 -1.484 . . . . 0.0 111.966 -0.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -51.82 130.78 29.77 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.935 -177.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -105.52 8.7 33.49 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.602 -177.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -62.02 -35.89 79.91 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.846 0.355 . . . . 0.0 110.635 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 62.12 -135.83 45.8 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.792 178.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.0 m -100.18 -6.75 25.66 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 120.648 0.261 . . . . 0.0 111.061 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -79.03 -45.3 20.47 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 178.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER 58.47 91.96 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.643 177.314 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -88.74 -12.96 40.74 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.908 -175.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.456 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 30.6 p -79.07 159.67 27.44 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.513 -0.475 . . . . 0.0 111.548 -177.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -87.45 -155.4 28.28 Favored Glycine 0 N--CA 1.448 -0.527 0 CA-C-N 115.913 -0.585 . . . . 0.0 112.673 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -83.21 157.89 22.53 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.962 0.411 . . . . 0.0 111.15 -178.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.46 ' O ' ' HE2' ' A' ' 4' ' ' LYS . . . 94.38 9.58 58.96 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.386 178.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.469 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 17.1 t -97.35 -61.64 1.37 Allowed 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.805 -179.401 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 81.6 p 49.41 39.09 15.64 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.239 0.616 . . . . 0.0 111.661 -177.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.469 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -54.73 147.73 14.2 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.723 178.921 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -85.58 28.44 0.76 Allowed 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.616 0.722 . . . . 0.0 110.205 -178.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -140.51 -61.06 0.51 Allowed 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.457 -179.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 20.7 p -88.27 -40.41 13.66 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -177.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.1 ttmt -116.75 53.99 0.87 Allowed 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.281 0.562 . . . . 0.0 111.741 -172.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.463 ' O ' ' HD3' ' A' ' 67' ' ' LYS . 13.9 t -121.5 179.32 4.48 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.772 178.512 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.469 ' HA ' ' HZ2' ' A' ' 67' ' ' LYS . 35.1 t -93.52 156.89 16.48 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.2 0.524 . . . . 0.0 111.061 -178.578 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -117.33 0.18 12.16 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.481 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.446 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 69.1 m -80.6 149.48 29.87 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.118 179.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 68.0 p -118.87 168.52 10.69 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.346 -178.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.6 m -65.81 -25.73 67.36 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.221 0.534 . . . . 0.0 110.278 178.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -72.38 -36.24 68.67 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.361 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -166.65 135.47 3.69 Favored Glycine 0 N--CA 1.433 -1.535 0 C-N-CA 120.205 -0.997 . . . . 0.0 112.75 -178.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 5.1 t -77.6 124.64 28.19 Favored 'General case' 0 C--N 1.313 -1.02 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 177.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -84.35 -29.4 26.31 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -176.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.493 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 20.2 p -89.91 -39.88 12.74 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 120.191 -0.603 . . . . 0.0 110.273 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.99 0.34 30.14 Favored Glycine 0 N--CA 1.443 -0.877 0 C-N-CA 120.913 -0.66 . . . . 0.0 112.762 178.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.493 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 30.0 mmtp -81.31 -0.26 40.2 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.292 0.568 . . . . 0.0 110.188 179.43 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 64.41 36.57 8.86 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 114.647 -1.161 . . . . 0.0 112.131 176.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.472 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 0.8 OUTLIER -81.4 -46.61 14.38 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.088 176.271 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 48.2 p 52.94 34.65 17.28 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 177.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.469 ' O ' ' HB2' ' A' ' 58' ' ' CYS . . . 166.21 161.6 15.67 Favored Glycine 0 N--CA 1.425 -2.034 0 C-N-CA 120.339 -0.934 . . . . 0.0 111.653 178.341 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -75.55 -44.47 0.3 Allowed 'Trans proline' 0 N--CA 1.46 -0.451 0 C-N-CA 122.679 2.252 . . . . 0.0 112.683 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -77.38 -16.32 58.92 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.162 0.506 . . . . 0.0 110.553 -178.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 40.1 m -106.6 13.03 28.74 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.481 177.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.472 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 47.1 t -86.69 135.54 33.36 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.552 -179.277 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 32.0 mtmt -109.39 -7.85 15.15 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.04 -178.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 34.5 m -77.47 157.32 30.52 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.166 -177.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -90.59 -85.2 1.39 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.971 -0.633 . . . . 0.0 113.368 -178.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 54.3 p -147.42 -30.14 0.33 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -177.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 35.8 m -92.4 47.16 1.29 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.102 0.477 . . . . 0.0 111.637 -177.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 16.1 t -124.22 165.23 17.98 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 178.033 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 8.8 m -66.62 -19.7 65.83 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.885 -177.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.446 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 27.7 p -93.72 22.09 5.85 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.811 0.338 . . . . 0.0 111.03 -179.413 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.469 ' HZ2' ' HA ' ' A' ' 39' ' ' CYS . 36.2 mmtm . . . . . 0 C--O 1.262 1.711 0 CA-C-O 117.285 -1.34 . . . . 0.0 110.598 -178.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.282 0 N-CA-C 112.227 -0.349 . . . . 0.0 112.227 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.2 m -66.8 -47.69 71.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.832 0.349 . . . . 0.0 111.05 -179.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -88.83 68.54 2.8 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.313 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.519 ' H ' ' HD2' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -82.44 158.11 23.39 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.674 0.273 . . . . 0.0 110.51 179.806 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -88.32 145.08 18.85 Favored Glycine 0 N--CA 1.44 -1.053 0 C-N-CA 120.662 -0.78 . . . . 0.0 111.563 179.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.525 ' HZ3' ' HB2' ' A' ' 6' ' ' LYS . 8.3 mtmp? -119.16 0.44 11.23 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.124 0.487 . . . . 0.0 110.636 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -147.42 148.35 19.86 Favored Glycine 0 N--CA 1.442 -0.91 0 N-CA-C 111.352 -0.699 . . . . 0.0 111.352 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -112.04 -118.85 0.3 Allowed 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 120.788 0.328 . . . . 0.0 111.875 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -95.02 34.73 1.34 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.817 -175.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.563 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 87.9 m -98.47 139.1 34.71 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 120.985 0.421 . . . . 0.0 111.722 179.414 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.2 p -89.66 -178.33 5.51 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.618 -179.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.3 m -64.33 -28.66 69.86 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.804 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.0 -44.86 91.38 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.882 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.551 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 48.9 t -77.21 -31.23 55.1 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.662 -179.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.656 ' HA ' ' NE ' ' A' ' 15' ' ' ARG . 1.8 mmp_? -74.25 -9.17 58.34 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.129 -0.487 . . . . 0.0 112.178 -179.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 52.7 m -88.23 159.28 18.2 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 177.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -126.54 119.13 22.98 Favored Pre-proline 0 C--N 1.309 -1.191 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 179.785 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -77.09 -178.19 23.4 Favored 'Cis proline' 0 C--N 1.348 0.529 0 C-N-CA 123.191 -1.587 . . . . 0.0 112.126 1.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.5 m -65.57 139.62 58.46 Favored 'General case' 0 CA--C 1.503 -0.861 0 CA-C-O 121.535 0.683 . . . . 0.0 111.941 -178.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 -114.26 15.75 18.06 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.835 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.571 ' HB3' ' HA ' ' A' ' 25' ' ' CYS . 1.9 m -63.08 -31.53 72.69 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.843 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 72.17 -148.19 42.23 Favored Glycine 0 N--CA 1.438 -1.21 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.791 177.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.5 m -88.42 -18.53 28.14 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-O 120.922 0.391 . . . . 0.0 110.082 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -77.66 -48.19 17.39 Favored 'General case' 0 CA--C 1.499 -1.0 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.943 -179.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.618 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 1.3 t 72.42 98.17 0.07 Allowed 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 114.614 -1.175 . . . . 0.0 110.119 -176.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -80.69 -24.04 39.15 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.771 -1.104 . . . . 0.0 112.544 -175.563 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.563 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 18.6 p -79.28 156.23 28.17 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 119.929 -0.709 . . . . 0.0 110.477 -179.704 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -83.95 -66.77 1.47 Allowed Glycine 0 N--CA 1.433 -1.508 0 C-N-CA 120.215 -0.993 . . . . 0.0 111.442 179.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -169.88 168.16 8.87 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 -178.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 101.93 32.45 5.02 Favored Glycine 0 N--CA 1.441 -0.983 0 C-N-CA 120.579 -0.819 . . . . 0.0 113.557 177.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.415 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 30.1 p -139.72 -37.58 0.49 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 117.323 0.561 . . . . 0.0 111.767 178.093 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 46.3 p 49.65 46.43 23.74 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 121.226 0.536 . . . . 0.0 111.285 -178.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 68.4 m -63.98 168.66 4.99 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.781 -179.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.408 ' HA ' ' HB ' ' A' ' 38' ' ' THR . . . -102.82 16.81 25.49 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.443 177.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -124.85 -70.34 0.76 Allowed 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.698 -178.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.618 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 29.4 p -86.49 -38.65 17.05 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.222 0.534 . . . . 0.0 111.637 -178.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.08 41.03 1.54 Allowed 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.514 -173.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.408 ' HB ' ' HA ' ' A' ' 34' ' ' ALA . 7.8 t -114.67 163.27 15.68 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.488 -175.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 51.3 t -109.07 140.64 42.34 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 176.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -98.76 3.6 47.57 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 120.704 0.288 . . . . 0.0 111.498 -177.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.491 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 85.0 m -80.02 164.25 23.58 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-O 120.928 0.394 . . . . 0.0 110.954 178.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 29.7 p -131.22 162.47 29.9 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.516 -179.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.9 m -69.37 -22.18 63.75 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.948 0.404 . . . . 0.0 110.922 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -86.63 -2.24 58.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.388 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 169.65 128.52 1.02 Allowed Glycine 0 N--CA 1.44 -1.08 0 C-N-CA 120.301 -0.952 . . . . 0.0 112.529 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.8 t -78.59 128.08 33.02 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.491 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 32.1 mmmt -87.82 -30.5 20.17 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -175.117 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.441 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 19.6 p -88.79 -36.79 15.88 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.285 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 110.66 -0.51 29.06 Favored Glycine 0 N--CA 1.442 -0.923 0 C-N-CA 120.833 -0.699 . . . . 0.0 113.056 178.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.441 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 72.2 mmtt -80.24 -2.05 43.32 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 117.065 0.432 . . . . 0.0 110.907 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 67.88 21.93 8.85 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.131 177.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.516 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 3.0 p -72.54 -44.88 61.54 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.18 178.01 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.406 ' HG1' ' C ' ' A' ' 52' ' ' CYS . 67.2 p 53.49 26.51 5.6 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.988 0.915 . . . . 0.0 113.114 176.526 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.453 ' O ' ' HB2' ' A' ' 58' ' ' CYS . . . 158.09 160.59 10.35 Favored Glycine 0 N--CA 1.439 -1.149 0 C-N-CA 120.76 -0.734 . . . . 0.0 111.335 -179.527 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -69.04 -12.27 33.84 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.667 2.245 . . . . 0.0 113.533 -177.402 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -79.41 -50.73 10.36 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.864 0.364 . . . . 0.0 111.084 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 24.1 t -90.78 7.75 38.17 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 120.953 0.406 . . . . 0.0 110.1 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.516 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 4.5 t -70.13 109.49 4.63 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.82 179.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -110.28 1.42 18.56 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.452 -177.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.2 p -98.08 152.06 19.72 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.663 178.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.439 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -67.31 -177.6 10.12 Favored Glycine 0 CA--C 1.523 0.554 0 CA-C-N 116.082 -0.508 . . . . 0.0 114.239 -175.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 20.1 m -82.14 6.22 17.18 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 123.074 0.55 . . . . 0.0 111.76 -177.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.9 m -107.52 11.3 28.88 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.961 0.41 . . . . 0.0 110.34 178.645 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . 0.472 ' SG ' ' N ' ' A' ' 65' ' ' SER . 53.4 t -84.38 173.93 10.51 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.954 -179.288 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.472 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 8.9 m -64.82 -31.85 73.27 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.426 -179.163 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.555 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 26.0 p -81.6 10.63 5.67 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-O 120.843 0.354 . . . . 0.0 111.233 -179.288 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.555 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 15.0 mmtp . . . . . 0 C--O 1.266 1.934 0 CA-C-O 117.88 -1.057 . . . . 0.0 110.828 -177.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.446 0 N-CA-C 112.267 -0.333 . . . . 0.0 112.267 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.0 m -139.62 115.29 10.06 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.613 0.244 . . . . 0.0 110.35 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -163.9 38.07 0.31 Allowed Glycine 0 N--CA 1.446 -0.692 0 C-N-CA 120.584 -0.817 . . . . 0.0 112.446 179.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.503 ' HD3' ' H ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -70.77 141.25 51.44 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 179.389 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -145.11 13.29 1.88 Allowed Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 119.946 -1.121 . . . . 0.0 113.285 -177.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -78.42 135.81 37.5 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.721 0.296 . . . . 0.0 110.4 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -128.74 134.35 8.01 Favored Glycine 0 N--CA 1.439 -1.117 0 C-N-CA 120.789 -0.719 . . . . 0.0 111.613 178.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -66.54 -33.32 75.41 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 122.354 0.262 . . . . 0.0 110.855 -179.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.438 ' HB2' ' HA3' ' A' ' 28' ' ' GLY . 31.5 mmmt 66.69 14.35 9.73 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.759 179.283 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.544 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 91.5 m -77.08 130.93 38.05 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 121.288 0.566 . . . . 0.0 112.16 -178.7 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 35.8 p -87.19 177.57 7.14 Favored 'General case' 0 N--CA 1.431 -1.393 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.253 -179.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.5 m -58.98 -27.02 64.99 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.753 -179.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.34 -45.0 77.68 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 120.856 0.36 . . . . 0.0 110.814 178.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.649 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 5.4 t -78.07 -26.0 47.97 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.065 0.46 . . . . 0.0 110.534 -178.84 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 32.7 mmt180 -74.66 -17.88 60.62 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.052 179.076 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.3 t -62.6 159.64 15.57 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.61 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -132.32 107.07 13.38 Favored Pre-proline 0 C--N 1.308 -1.2 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.887 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -74.18 170.96 69.41 Favored 'Cis proline' 0 C--O 1.243 0.732 0 C-N-CA 123.517 -1.451 . . . . 0.0 112.476 0.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.614 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 21.5 t -55.98 143.67 31.36 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.867 -178.688 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -120.79 15.24 11.77 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.468 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.649 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 0.5 OUTLIER -70.8 -4.01 21.81 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.054 0.454 . . . . 0.0 110.94 179.535 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.77 -15.37 73.6 Favored Glycine 0 CA--C 1.521 0.454 0 C-N-CA 121.158 -0.544 . . . . 0.0 112.583 178.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 t -73.18 -47.51 43.12 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.649 -0.324 . . . . 0.0 110.76 179.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -140.91 -43.57 0.39 Allowed 'General case' 0 C--O 1.237 0.43 0 CA-C-N 116.66 -0.245 . . . . 0.0 111.247 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 16.0 t 74.02 100.84 0.07 Allowed 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.99 0.806 . . . . 0.0 110.988 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -125.52 13.14 8.12 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.894 -177.709 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.544 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 15.1 p -84.11 -175.53 5.84 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.254 0.549 . . . . 0.0 110.858 -178.204 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.493 ' C ' ' H ' ' A' ' 30' ' ' GLY . . . -88.59 130.92 10.39 Favored Glycine 0 N--CA 1.425 -2.085 0 N-CA-C 109.431 -1.468 . . . . 0.0 109.431 173.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.0 18.82 0.08 Allowed 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -176.249 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . 0.493 ' H ' ' C ' ' A' ' 28' ' ' GLY . . . -110.63 11.13 30.33 Favored Glycine 0 N--CA 1.436 -1.356 0 N-CA-C 111.151 -0.78 . . . . 0.0 111.151 177.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.812 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 15.4 p -80.49 -15.44 56.72 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 120.644 0.259 . . . . 0.0 110.415 179.552 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 82.8 p 57.34 26.53 12.54 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.868 0.867 . . . . 0.0 111.627 -177.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.812 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 6.6 t -62.86 127.9 33.38 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.822 179.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -92.15 32.18 1.19 Allowed 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.393 -177.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -128.65 -50.71 1.26 Allowed 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.174 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.471 ' CB ' ' HB3' ' A' ' 21' ' ' CYS . 25.3 p -98.09 -39.56 8.85 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.112 179.649 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -84.55 115.57 22.67 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-O 121.107 0.479 . . . . 0.0 110.891 -179.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.0 t -177.76 -178.34 0.71 Allowed 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 178.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -98.23 135.05 40.42 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 109.524 -0.546 . . . . 0.0 109.524 177.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -86.71 -6.01 58.96 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.208 -178.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 59.9 m -80.63 135.18 36.0 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.769 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 71.5 p -105.87 172.68 6.67 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.618 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 34.0 p -75.12 -10.0 59.07 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.167 0.508 . . . . 0.0 110.197 178.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -76.36 -40.99 49.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.971 177.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -169.01 136.96 4.3 Favored Glycine 0 N--CA 1.431 -1.659 0 C-N-CA 120.887 -0.673 . . . . 0.0 111.824 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 17.8 t -69.32 128.18 35.68 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 10.8 mmpt? -82.23 -40.03 22.21 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 -177.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.502 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 19.2 p -86.99 -36.5 18.21 Favored 'General case' 0 C--N 1.318 -0.804 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.908 -177.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 106.72 15.16 17.57 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.185 178.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.502 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 74.4 mmtt -94.75 1.59 55.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.954 0.407 . . . . 0.0 110.54 178.294 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 62.4 33.38 16.33 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.09 178.757 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.573 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.4 p -82.6 -47.35 12.19 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.985 177.407 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.45 ' HG1' ' C ' ' A' ' 52' ' ' CYS . 51.3 p 52.69 37.74 24.39 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.942 0.897 . . . . 0.0 113.131 176.614 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 141.56 157.31 7.12 Favored Glycine 0 N--CA 1.437 -1.284 0 C-N-CA 120.161 -1.019 . . . . 0.0 112.302 178.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -61.24 -27.07 83.02 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.874 2.383 . . . . 0.0 112.709 -178.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -62.19 -54.58 38.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.84 0.352 . . . . 0.0 111.219 -179.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.7 m -99.69 20.12 14.65 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.291 -178.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.573 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 4.5 t -74.32 105.55 5.54 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-O 121.059 0.457 . . . . 0.0 110.514 -179.169 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -83.33 -22.05 33.0 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.92 -177.679 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.2 p -93.02 133.38 36.22 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 120.678 -0.409 . . . . 0.0 109.987 179.182 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -120.71 114.97 2.77 Favored Glycine 0 N--CA 1.439 -1.143 0 C-N-CA 120.602 -0.808 . . . . 0.0 112.126 -175.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 63.7 m 64.13 163.89 0.13 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 122.941 0.497 . . . . 0.0 112.163 -179.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.5 m 66.88 -24.37 0.11 Allowed 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 174.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 37.9 t -73.41 163.72 27.66 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 118.273 0.488 . . . . 0.0 111.414 -177.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.0 p -66.21 -26.7 67.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.03 -0.532 . . . . 0.0 112.048 -178.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.497 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 30.4 p -81.08 0.39 36.24 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.71 178.808 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.497 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 5.2 mmpp? . . . . . 0 C--O 1.262 1.743 0 CA-C-O 118.249 -0.882 . . . . 0.0 110.494 -179.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.223 0 N-CA-C 112.385 -0.286 . . . . 0.0 112.385 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.0 m -74.96 113.82 12.72 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.665 0.269 . . . . 0.0 110.368 179.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 79.54 73.54 1.13 Allowed Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.867 178.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -101.52 -178.24 3.67 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-O 120.818 0.342 . . . . 0.0 110.669 178.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 132.65 -29.39 3.27 Favored Glycine 0 N--CA 1.439 -1.113 0 C-N-CA 120.67 -0.776 . . . . 0.0 111.643 -178.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -115.71 107.15 14.72 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.922 0.391 . . . . 0.0 111.049 179.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -122.77 -8.25 6.91 Favored Glycine 0 CA--C 1.499 -0.934 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.109 178.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.5 mp0 -117.17 147.23 42.64 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 50.3 mtpt -100.14 29.88 4.07 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.49 178.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.564 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 67.8 m -122.07 160.77 24.32 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.742 -177.064 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 20.9 p -85.63 174.06 9.69 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.222 -179.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.7 m -57.61 -36.78 72.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.337 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.92 -46.06 89.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.416 -179.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.461 ' HB3' ' HB3' ' A' ' 10' ' ' CYS . 26.4 t -68.96 -30.29 68.7 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.101 0.477 . . . . 0.0 110.005 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 28.5 mmm180 -78.35 -2.82 40.05 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.551 178.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.8 m -84.06 165.57 18.43 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.664 0.269 . . . . 0.0 110.766 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -133.2 116.63 14.36 Favored Pre-proline 0 C--N 1.318 -0.767 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -70.81 173.29 48.99 Favored 'Cis proline' 0 C--O 1.235 0.327 0 C-N-CA 123.153 -1.603 . . . . 0.0 112.253 0.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.7 t -57.23 116.55 3.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.362 -178.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -102.39 13.56 34.26 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.001 0.429 . . . . 0.0 111.108 -176.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.64 ' SG ' ' HA ' ' A' ' 25' ' ' CYS . 4.7 t -70.4 -20.36 62.94 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.595 -179.41 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 59.02 -152.62 32.18 Favored Glycine 0 C--N 1.343 0.964 0 CA-C-N 115.284 -0.871 . . . . 0.0 113.04 177.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 67.1 m -95.69 -3.58 45.78 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-O 120.658 0.266 . . . . 0.0 110.464 177.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -71.6 -44.25 64.77 Favored 'General case' 0 CA--C 1.495 -1.136 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 176.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.64 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 4.8 t 55.58 92.82 0.03 OUTLIER 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 114.415 -1.266 . . . . 0.0 112.625 174.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -102.88 3.61 36.75 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.352 -179.492 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.456 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 29.1 p -87.89 174.92 8.05 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.697 179.292 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -98.07 -102.97 2.26 Favored Glycine 0 N--CA 1.44 -1.093 0 C-N-CA 120.607 -0.806 . . . . 0.0 111.359 178.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -139.66 161.73 36.83 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.89 28.05 7.57 Favored Glycine 0 N--CA 1.436 -1.344 0 C-N-CA 120.353 -0.927 . . . . 0.0 112.928 178.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.564 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 15.0 p -115.63 -23.89 8.53 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 117.044 0.422 . . . . 0.0 110.225 177.831 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 38.6 p 51.49 36.05 15.89 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.59 0.756 . . . . 0.0 112.281 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 74.2 m -75.21 171.9 13.35 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 121.083 0.468 . . . . 0.0 110.904 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -135.4 9.5 3.44 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 175.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.32 -58.87 1.8 Allowed 'General case' 0 CA--C 1.507 -0.69 0 CA-C-N 114.801 -1.09 . . . . 0.0 109.943 -178.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.613 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 31.8 p -86.41 -47.36 9.39 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -95.38 92.07 6.53 Favored 'General case' 0 N--CA 1.424 -1.756 0 CA-C-N 114.754 -1.112 . . . . 0.0 109.549 177.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.8 t -137.36 162.18 34.28 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 13.1 t -107.31 133.28 52.09 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 120.932 0.396 . . . . 0.0 110.057 -179.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -89.95 -6.32 55.8 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.16 0.505 . . . . 0.0 110.38 -177.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 38.0 m -79.3 145.1 33.68 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.97 -177.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 64.9 p -115.09 170.0 8.69 Favored 'General case' 0 N--CA 1.438 -1.058 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 178.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.429 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 2.8 p -73.62 -11.01 60.29 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.06 0.457 . . . . 0.0 111.151 178.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -90.59 -33.05 16.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.838 179.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -158.45 127.25 1.84 Allowed Glycine 0 N--CA 1.434 -1.499 0 C-N-CA 120.348 -0.929 . . . . 0.0 112.364 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 6.7 t -76.09 134.72 39.96 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp -96.15 -16.53 21.45 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -175.059 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.405 ' HB3' ' HB3' ' A' ' 66' ' ' CYS . 32.1 p -103.1 -39.34 6.92 Favored 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.277 178.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.36 5.34 26.48 Favored Glycine 0 N--CA 1.438 -1.176 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.74 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -84.74 -2.25 57.36 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 120.935 0.398 . . . . 0.0 110.455 178.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 63.68 24.11 13.77 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.052 0.941 . . . . 0.0 111.179 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.468 ' O ' ' HB2' ' A' ' 57' ' ' SER . 3.9 p -70.77 -43.65 68.32 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 178.397 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.466 ' HG1' ' C ' ' A' ' 52' ' ' CYS . 64.3 p 51.26 39.9 24.93 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.808 0.843 . . . . 0.0 112.899 176.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 145.04 149.37 5.01 Favored Glycine 0 N--CA 1.439 -1.162 0 C-N-CA 120.255 -0.974 . . . . 0.0 112.071 179.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -61.98 -26.13 78.4 Favored 'Trans proline' 0 CA--C 1.532 0.395 0 C-N-CA 123.021 2.481 . . . . 0.0 112.758 -177.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -71.28 -24.04 62.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.398 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.468 ' HB2' ' O ' ' A' ' 52' ' ' CYS . 23.6 m -119.14 15.99 13.22 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.226 0.536 . . . . 0.0 110.04 179.322 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.411 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 13.3 t -83.44 106.07 14.9 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.734 -176.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -95.8 -13.32 24.16 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.224 -177.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.2 p -89.58 148.93 23.08 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.915 -179.219 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -79.52 -167.08 33.65 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.934 -0.651 . . . . 0.0 113.837 -175.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.429 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 16.1 m -73.31 -13.45 61.12 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 123.299 0.64 . . . . 0.0 111.792 -177.567 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 45.4 m -86.62 18.37 3.4 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.777 0.323 . . . . 0.0 111.158 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 13.0 t -100.06 172.19 7.35 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 178.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 25.2 m -81.43 -11.04 59.38 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -176.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.427 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 25.9 p -93.29 15.97 14.32 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.835 0.35 . . . . 0.0 110.789 179.373 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.429 ' HG3' ' HA ' ' A' ' 62' ' ' SER . 9.0 mmtp . . . . . 0 C--O 1.263 1.782 0 CA-C-O 118.006 -0.997 . . . . 0.0 111.117 -177.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.305 0 N-CA-C 112.357 -0.297 . . . . 0.0 112.357 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.6 m -81.15 -2.2 47.55 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 120.957 0.408 . . . . 0.0 111.315 -179.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -71.11 -30.72 67.22 Favored Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 120.917 -0.659 . . . . 0.0 112.25 179.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 50.6 tptt 63.69 25.65 14.29 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.741 0.781 . . . . 0.0 110.461 179.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 145.18 -51.88 0.6 Allowed Glycine 0 N--CA 1.438 -1.172 0 N-CA-C 110.856 -0.897 . . . . 0.0 110.856 -179.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.9 mttp -119.19 114.31 22.24 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 120.664 0.269 . . . . 0.0 110.672 178.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -82.46 145.8 24.31 Favored Glycine 0 N--CA 1.441 -1.005 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 178.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 64.02 99.9 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.137 0.494 . . . . 0.0 110.634 -178.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -76.38 -2.3 31.19 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.423 -178.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.509 ' HB3' ' HB3' ' A' ' 14' ' ' CYS . 57.3 m -79.58 148.74 31.62 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.336 178.857 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.1 t -85.5 171.3 11.87 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.058 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.6 m -53.54 -32.08 49.12 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 123.205 0.602 . . . . 0.0 111.194 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.8 -45.35 94.24 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.429 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.701 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 29.4 t -75.23 -24.81 57.75 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.446 0.641 . . . . 0.0 110.256 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 77.5 mtp180 -84.62 4.99 29.76 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.72 -178.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.8 m -106.73 162.75 13.5 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.685 0.278 . . . . 0.0 110.725 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -126.87 117.98 22.34 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.184 178.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -74.1 178.06 35.24 Favored 'Cis proline' 0 C--O 1.239 0.553 0 C-N-CA 123.144 -1.607 . . . . 0.0 112.155 0.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.431 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 21.1 t -69.9 136.53 50.74 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.76 -176.996 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -112.36 6.91 19.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.49 -177.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.701 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 4.8 m -75.11 -11.2 60.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.661 0.267 . . . . 0.0 111.636 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.81 69.11 2.69 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.979 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.3 t -174.3 -61.72 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -115.13 -46.45 2.9 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.872 -0.603 . . . . 0.0 109.666 177.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.417 ' HB2' ' O ' ' A' ' 21' ' ' CYS . 38.3 t 60.96 100.41 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.163 -0.926 . . . . 0.0 112.466 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -100.56 23.78 9.89 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.212 178.824 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -63.27 148.29 48.64 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.94 178.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.27 163.09 37.23 Favored Glycine 0 N--CA 1.433 -1.549 0 N-CA-C 109.759 -1.336 . . . . 0.0 109.759 172.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -70.97 114.36 8.94 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 117.247 0.523 . . . . 0.0 110.09 -177.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 132.92 24.54 0.72 Allowed Glycine 0 N--CA 1.436 -1.321 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.269 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.4 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 45.9 t -91.68 146.42 23.79 Favored 'General case' 0 N--CA 1.439 -0.975 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 178.52 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.7 p -123.44 30.67 6.19 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.314 -179.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.4 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 21.0 t -68.76 163.9 23.03 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.258 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -117.17 25.27 10.59 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.022 0.439 . . . . 0.0 110.246 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -127.6 -59.42 1.21 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.439 -178.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 7.1 p -86.45 -39.58 16.19 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.007 0.432 . . . . 0.0 111.022 -179.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.2 tmtp? -104.21 91.68 4.03 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.025 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.6 t -173.96 -175.83 1.11 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.936 -179.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 39.2 t -113.82 137.44 51.65 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.916 0.388 . . . . 0.0 110.327 178.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 32.1 m-80 -93.97 -0.29 55.65 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.87 -178.387 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.447 ' HB3' ' HA ' ' A' ' 53' ' ' THR . 81.7 m -78.7 156.5 28.92 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.124 0.487 . . . . 0.0 111.525 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.3 p -137.81 169.55 17.59 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.261 178.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.0 m -67.9 -18.19 64.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.223 0.535 . . . . 0.0 110.469 178.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -68.22 -37.27 80.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.489 177.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -175.0 133.24 2.4 Favored Glycine 0 N--CA 1.434 -1.474 0 C-N-CA 120.85 -0.69 . . . . 0.0 111.912 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 4.8 t -72.63 116.29 12.93 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 178.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -74.43 -33.59 62.99 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.583 -174.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.551 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 28.2 p -86.8 -43.82 12.21 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.054 -0.659 . . . . 0.0 110.073 179.822 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.81 4.8 26.07 Favored Glycine 0 N--CA 1.436 -1.309 0 CA-C-N 115.74 -0.664 . . . . 0.0 112.432 -179.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.551 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 46.1 mmtm -79.51 -5.36 54.68 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.249 0.547 . . . . 0.0 109.696 177.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 68.76 30.41 4.86 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 114.772 -1.104 . . . . 0.0 110.884 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.496 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 5.3 p -80.3 -39.45 28.73 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.288 177.441 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.447 ' HA ' ' HB3' ' A' ' 41' ' ' CYS . 39.0 p 51.97 33.42 11.74 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 177.254 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 145.77 150.45 5.21 Favored Glycine 0 N--CA 1.441 -1.033 0 C-N-CA 120.168 -1.015 . . . . 0.0 112.268 178.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -55.98 -28.04 66.91 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.307 2.671 . . . . 0.0 113.407 -178.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -66.89 -34.44 77.8 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.759 0.314 . . . . 0.0 111.625 -178.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.452 ' HB2' ' O ' ' A' ' 52' ' ' CYS . 19.2 m -111.97 13.15 20.79 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.286 0.565 . . . . 0.0 110.264 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.496 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 28.0 t -78.42 119.53 21.86 Favored 'General case' 0 N--CA 1.438 -1.04 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.842 -179.208 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -115.77 1.11 13.38 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.584 -178.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.472 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 0.6 OUTLIER -97.2 110.01 22.65 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 176.864 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -99.11 114.66 5.09 Favored Glycine 0 CA--C 1.491 -1.422 0 C-N-CA 120.993 -0.623 . . . . 0.0 112.639 -173.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.435 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 43.6 t 61.89 161.63 0.07 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.065 0.546 . . . . 0.0 111.424 -179.057 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 19.1 t 73.14 -32.77 0.25 Allowed 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 175.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 33.3 t -67.98 162.75 23.71 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 119.736 -0.786 . . . . 0.0 111.801 -176.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.4 t -68.75 -21.75 64.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.832 -177.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.545 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 29.3 p -86.24 0.31 54.06 Favored 'General case' 0 C--O 1.219 -0.52 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.976 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.545 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 0.1 OUTLIER . . . . . 0 C--O 1.261 1.671 0 CA-C-O 117.998 -1.001 . . . . 0.0 111.051 -179.029 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.31 0 N-CA-C 112.479 -0.249 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 65.6 p 49.24 79.09 0.08 Allowed 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.467 0.707 . . . . 0.0 112.004 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -101.69 163.69 17.52 Favored Glycine 0 N--CA 1.44 -1.08 0 C-N-CA 120.644 -0.789 . . . . 0.0 111.779 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -91.81 97.35 10.93 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 179.258 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -112.71 65.25 0.26 Allowed Glycine 0 N--CA 1.441 -1.012 0 C-N-CA 120.414 -0.898 . . . . 0.0 112.414 -178.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -93.25 163.85 13.46 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.822 0.344 . . . . 0.0 110.632 179.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 162.77 70.0 0.02 OUTLIER Glycine 0 N--CA 1.443 -0.874 0 C-N-CA 121.028 -0.606 . . . . 0.0 111.597 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -81.77 -81.45 0.14 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.973 0.416 . . . . 0.0 110.818 -178.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -131.63 29.48 4.5 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.026 -179.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.487 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 6.0 m -95.82 164.7 12.63 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-O 121.892 0.853 . . . . 0.0 112.726 -179.558 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.4 t -100.85 161.21 13.75 Favored 'General case' 0 N--CA 1.43 -1.453 0 CA-C-N 114.26 -1.336 . . . . 0.0 108.672 176.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.0 t -58.4 -30.62 66.99 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.94 0.4 . . . . 0.0 110.477 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.83 -35.01 79.07 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.124 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 10.4 t -86.44 -30.23 22.22 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.329 -176.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 42.2 ttp180 -77.38 -8.09 57.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.049 0.452 . . . . 0.0 110.281 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.9 t -89.26 161.84 16.19 Favored 'General case' 0 N--CA 1.435 -1.205 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 177.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.457 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 45.0 mt-10 -128.53 129.14 23.56 Favored Pre-proline 0 C--N 1.307 -1.259 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 -179.161 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . 0.457 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 56.0 Cg_endo -68.5 173.16 40.85 Favored 'Cis proline' 0 C--N 1.348 0.52 0 C-N-CA 123.55 -1.438 . . . . 0.0 113.099 1.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.0 t -62.69 115.73 4.57 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.957 -178.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -107.2 14.43 26.19 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.079 -177.537 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.614 ' SG ' ' HA ' ' A' ' 25' ' ' CYS . 4.5 t -68.47 -20.7 64.63 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 179.068 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 61.86 -154.04 40.33 Favored Glycine 0 C--N 1.339 0.713 0 CA-C-N 115.076 -0.965 . . . . 0.0 114.411 174.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.6 m -89.81 -10.22 46.26 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.343 -0.429 . . . . 0.0 110.194 179.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -76.0 -40.01 54.62 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 177.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.614 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 10.9 t 56.33 86.61 0.06 Allowed 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.61 176.721 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 11.2 mm100 -89.74 -7.04 55.39 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.489 -177.79 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.487 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 14.6 p -85.19 162.17 19.31 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-O 121.089 0.471 . . . . 0.0 110.676 -179.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.83 -159.59 35.5 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.698 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.5 mp0 -78.69 168.91 19.06 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.817 0.342 . . . . 0.0 110.396 179.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 87.21 -0.99 86.18 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.659 178.779 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 32.0 t -84.55 -48.56 9.43 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 122.768 -0.254 . . . . 0.0 111.356 -179.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 60.4 p 53.0 43.31 31.9 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.587 0.755 . . . . 0.0 112.401 -179.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.92 165.12 20.64 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.424 178.181 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -113.35 11.14 18.5 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.29 0.567 . . . . 0.0 110.051 179.141 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -117.46 -64.43 1.3 Allowed 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.608 -179.501 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.587 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 25.5 p -74.43 -42.92 58.34 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-O 121.134 0.492 . . . . 0.0 109.701 178.337 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.456 ' NZ ' ' SG ' ' A' ' 27' ' ' CYS . 14.0 mptt -83.76 87.6 7.07 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.027 176.068 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.5 t -142.21 154.76 45.05 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 44.2 t -89.07 136.16 33.17 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -92.22 -3.75 55.1 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.116 -178.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 62.3 m -77.98 141.47 38.93 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.502 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 62.8 p -102.76 164.84 11.4 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.965 -177.182 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.4 m -67.93 -31.59 71.45 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.919 0.39 . . . . 0.0 110.681 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -71.67 -34.11 69.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.986 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -163.69 136.52 4.3 Favored Glycine 0 N--CA 1.435 -1.422 0 C-N-CA 120.284 -0.96 . . . . 0.0 112.705 -178.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 37.2 t -73.0 147.81 44.8 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 177.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.441 ' NZ ' ' HB3' ' A' ' 47' ' ' LYS . 8.3 mtpm? -112.05 -19.6 12.26 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -177.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.419 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 17.4 p -96.99 -37.71 10.07 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 119.993 -0.683 . . . . 0.0 110.793 -179.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.66 0.43 17.88 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.618 -0.801 . . . . 0.0 113.306 178.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.791 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 73.9 mmtt -84.6 -9.17 58.54 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 117.078 0.439 . . . . 0.0 110.703 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 66.4 27.94 9.81 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.16 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.515 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 0.8 OUTLIER -71.16 -47.46 57.58 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.312 178.197 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.5 p 55.89 35.99 26.47 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.182 0.993 . . . . 0.0 113.332 176.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 150.46 149.52 5.05 Favored Glycine 0 C--O 1.218 -0.899 0 C-N-CA 120.012 -1.09 . . . . 0.0 112.252 178.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -70.82 -23.24 26.21 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.875 2.383 . . . . 0.0 113.068 -178.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -82.68 -21.21 34.99 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.212 0.53 . . . . 0.0 109.878 -178.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.8 m -121.77 22.86 10.36 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.546 179.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.515 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 8.2 t -75.34 142.29 43.21 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.116 -177.508 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 45.1 mtpt -110.7 1.38 17.87 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.496 -176.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.791 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 4.7 m -101.17 143.88 30.73 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.798 -177.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -110.03 70.84 0.21 Allowed Glycine 0 CA--C 1.507 -0.45 0 N-CA-C 111.23 -0.748 . . . . 0.0 111.23 -178.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.6 t 60.59 -179.61 0.1 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.205 0.602 . . . . 0.0 110.323 -177.037 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.7 m 62.92 -0.28 0.61 Allowed 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 177.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 36.2 t -93.77 162.68 13.83 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.285 178.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 51.0 m -70.1 -12.02 61.3 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -177.26 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.645 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 24.8 p -86.91 0.34 55.2 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 120.027 -0.669 . . . . 0.0 110.531 177.024 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.645 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 23.5 mmtp . . . . . 0 C--O 1.25 1.123 0 CA-C-O 117.767 -1.111 . . . . 0.0 110.532 -179.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 N-CA-C 112.254 -0.338 . . . . 0.0 112.254 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.4 m -87.86 -34.23 18.27 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.176 0.513 . . . . 0.0 110.443 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 115.82 157.29 11.21 Favored Glycine 0 N--CA 1.438 -1.207 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 -178.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.9 pttt -154.65 18.47 0.46 Allowed 'General case' 0 C--N 1.312 -1.027 0 CA-C-O 120.959 0.409 . . . . 0.0 110.861 -178.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -167.63 -86.6 0.06 OUTLIER Glycine 0 N--CA 1.444 -0.808 0 C-N-CA 120.826 -0.702 . . . . 0.0 111.623 -179.424 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt 59.17 91.58 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.279 0.631 . . . . 0.0 112.679 178.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -104.41 -75.41 1.03 Allowed Glycine 0 N--CA 1.444 -0.813 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 176.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 58.23 101.36 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.879 0.872 . . . . 0.0 113.23 176.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 60.8 mttm -90.57 4.07 52.29 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.992 179.206 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.539 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 60.4 m -99.97 163.65 12.35 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.371 0.605 . . . . 0.0 112.603 -176.167 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.8 p -100.02 175.5 5.74 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.657 -178.453 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.4 m -62.16 -31.52 72.02 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.22 179.235 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.0 -44.07 81.3 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 120.919 0.39 . . . . 0.0 110.536 179.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 41.9 t -70.89 -43.07 69.13 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.93 -178.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.436 ' HG2' ' O ' ' A' ' 15' ' ' ARG . 40.6 ttt180 -79.17 3.45 17.67 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.025 0.441 . . . . 0.0 111.307 -178.741 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.5 t -73.33 165.0 25.88 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 178.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -119.77 105.78 42.69 Favored Pre-proline 0 C--N 1.312 -1.05 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -179.121 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -82.45 -177.02 17.89 Favored 'Cis proline' 0 C--N 1.352 0.715 0 C-N-CA 124.026 -1.239 . . . . 0.0 111.939 -0.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 37.5 t -61.62 129.68 42.25 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 120.949 0.404 . . . . 0.0 111.179 -177.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 76.4 mm-40 -114.58 13.61 17.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.575 -178.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.583 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 1.8 t -68.68 -31.77 71.12 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -179.574 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 60.3 -162.4 18.94 Favored Glycine 0 C--N 1.34 0.759 0 CA-C-N 115.091 -0.959 . . . . 0.0 114.627 175.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.0 m -76.49 -7.23 54.71 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 120.97 0.414 . . . . 0.0 110.818 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -78.53 -45.02 22.89 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 177.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.508 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 5.0 t 59.99 95.25 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.877 176.465 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -102.56 2.03 35.68 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.668 -178.255 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.539 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 14.8 p -90.49 -158.69 0.56 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.202 0.525 . . . . 0.0 111.298 -178.318 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -140.86 157.18 25.79 Favored Glycine 0 N--CA 1.438 -1.204 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 177.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -59.71 93.99 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.517 0.675 . . . . 0.0 112.055 -177.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -165.53 6.44 0.06 OUTLIER Glycine 0 N--CA 1.434 -1.445 0 N-CA-C 110.574 -1.011 . . . . 0.0 110.574 179.003 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.495 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 31.7 p -120.22 178.2 4.73 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.03 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.3 p -129.09 33.21 4.61 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 121.306 0.574 . . . . 0.0 110.538 -178.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 83.4 m -63.35 146.83 52.71 Favored 'General case' 0 CA--C 1.506 -0.727 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -177.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.552 ' C ' ' HB ' ' A' ' 38' ' ' THR . . . -114.95 21.67 14.09 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-N 114.069 -1.423 . . . . 0.0 107.254 173.698 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -113.48 -63.28 1.47 Allowed 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.702 -1.135 . . . . 0.0 110.476 -178.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.583 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 29.2 p -89.19 -45.66 9.39 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 121.588 0.708 . . . . 0.0 109.845 179.044 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.413 ' HG3' ' OG ' ' A' ' 62' ' ' SER . 2.0 ttpm? -95.97 44.81 1.07 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.059 -178.255 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.552 ' HB ' ' C ' ' A' ' 34' ' ' ALA . 14.1 t -100.91 142.07 32.91 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.731 -178.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.5 t -80.53 137.17 36.4 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.655 178.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -106.54 7.28 30.73 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 120.919 0.39 . . . . 0.0 111.308 -178.372 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' CYS . . . . . 0.568 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 85.2 m -80.91 133.28 35.53 Favored 'General case' 0 N--CA 1.435 -1.188 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.181 178.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 55.8 p -88.61 156.34 19.1 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.583 -177.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.416 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 14.5 m -65.18 -29.73 70.58 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.645 0.736 . . . . 0.0 109.133 176.606 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -65.24 -42.77 93.01 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.696 -1.138 . . . . 0.0 110.744 178.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -159.88 135.77 4.26 Favored Glycine 0 N--CA 1.44 -1.083 0 C-N-CA 121.048 -0.596 . . . . 0.0 111.906 -178.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 12.7 t -71.89 147.98 46.55 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -108.02 -31.74 7.84 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -177.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.446 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 20.7 p -89.75 -39.03 13.41 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.136 -0.625 . . . . 0.0 111.416 -177.61 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 118.48 -5.13 14.98 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.495 -0.859 . . . . 0.0 112.885 -179.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.666 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 74.0 mmtt -76.22 -13.42 60.17 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 120.8 0.333 . . . . 0.0 110.604 179.171 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 71.3 28.07 3.05 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.704 -179.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' CYS . . . . . 0.52 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.8 p -74.33 -43.88 54.8 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.268 178.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.416 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 55.0 p 54.03 31.96 14.64 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.087 0.955 . . . . 0.0 113.106 177.574 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 144.01 154.77 6.22 Favored Glycine 0 N--CA 1.442 -0.922 0 C-N-CA 120.353 -0.927 . . . . 0.0 112.299 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -60.47 -28.46 86.76 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.02 2.48 . . . . 0.0 112.677 -177.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -63.05 -29.29 70.7 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.104 -178.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 13.6 t -126.48 22.75 6.98 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.471 -178.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . 0.52 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 17.8 t -82.71 137.0 34.57 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.078 0.466 . . . . 0.0 110.871 -178.798 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -117.31 10.54 13.74 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.157 -178.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.666 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 2.6 m -102.01 156.3 17.63 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.154 -176.028 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -85.58 -115.68 0.83 Allowed Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 121.002 -0.618 . . . . 0.0 112.8 -178.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' SER . . . . . 0.413 ' OG ' ' HG3' ' A' ' 37' ' ' LYS . 14.9 m -123.49 -13.46 7.56 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 120.832 0.349 . . . . 0.0 111.073 -177.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 58.3 m -107.33 24.24 13.17 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -177.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' CYS . . . . . 0.42 ' SG ' ' N ' ' A' ' 65' ' ' SER . 42.4 t -93.3 171.98 8.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 177.537 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.42 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 19.4 m -67.33 -23.01 65.58 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -177.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.568 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 20.6 p -90.9 4.65 51.31 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.794 -0.362 . . . . 0.0 111.647 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 22.1 mmtp . . . . . 0 C--O 1.26 1.626 0 CA-C-O 117.574 -1.203 . . . . 0.0 110.676 -178.76 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 92.7 mttt . . . . . 0 N--CA 1.451 -0.413 0 CA-C-O 121.454 0.645 . . . . 0.0 109.479 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.559 ' SG ' ' HB2' ' A' ' 27' ' ' CYS . 76.4 m -85.34 150.46 24.73 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.093 -178.255 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.9 t -81.22 166.94 20.13 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.565 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.2 m -54.52 -39.09 67.28 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.589 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.69 -45.62 89.07 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.253 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.633 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 44.6 t -69.38 -34.08 74.01 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.226 0.536 . . . . 0.0 110.373 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 77.5 mtp180 -84.46 14.82 4.13 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.716 -0.675 . . . . 0.0 112.043 -178.533 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.6 m -100.99 164.39 11.84 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.557 0.218 . . . . 0.0 110.636 178.365 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.436 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 11.4 mp0 -121.49 110.85 33.62 Favored Pre-proline 0 C--N 1.327 -0.384 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 177.377 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.436 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 91.0 Cg_endo -78.23 172.12 63.14 Favored 'Cis proline' 0 C--O 1.237 0.47 0 C-N-CA 123.72 -1.367 . . . . 0.0 111.74 0.35 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.647 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 43.3 t -62.34 134.62 56.73 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 121.127 0.489 . . . . 0.0 110.571 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 9.9 mm100 -113.34 23.78 12.91 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.933 -178.092 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.68 ' SG ' ' HA ' ' A' ' 25' ' ' CYS . 0.7 OUTLIER -73.97 -25.7 60.08 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 -178.908 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 59.45 -145.06 45.22 Favored Glycine 0 N--CA 1.443 -0.889 0 CA-C-N 115.172 -0.922 . . . . 0.0 113.24 177.035 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -95.03 -9.9 32.45 Favored 'General case' 0 N--CA 1.438 -1.038 0 CA-C-O 120.92 0.39 . . . . 0.0 110.164 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.439 ' CE ' ' HA ' ' A' ' 24' ' ' LYS . 5.4 mmpt? -72.94 -42.05 63.83 Favored 'General case' 0 CA--C 1.511 -0.555 0 N-CA-C 109.244 -0.651 . . . . 0.0 109.244 178.338 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.68 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 2.6 t 53.83 79.42 0.13 Allowed 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.861 175.05 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -99.91 16.67 23.06 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.749 -178.037 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.559 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 23.9 p -87.63 -163.57 0.96 Allowed 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.48 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -111.83 153.04 17.54 Favored Glycine 0 N--CA 1.441 -0.998 0 C-N-CA 120.554 -0.832 . . . . 0.0 112.485 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -71.98 120.2 17.23 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 120.807 0.337 . . . . 0.0 110.324 178.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 135.79 -3.35 3.83 Favored Glycine 0 N--CA 1.441 -1.021 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.601 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.551 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 9.1 p -89.31 -31.92 17.6 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.698 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 42.9 p 50.87 38.81 20.97 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.229 0.611 . . . . 0.0 111.306 -176.511 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.551 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 6.9 t -59.72 136.12 57.9 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.011 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.01 23.52 0.7 Allowed 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -174.053 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -125.7 -50.8 1.6 Allowed 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.134 0.493 . . . . 0.0 110.117 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.616 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 3.2 p -94.73 -43.1 8.41 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.621 179.063 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.439 ' HE3' ' OG ' ' A' ' 62' ' ' SER . 13.4 mptt -83.53 63.08 7.16 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.468 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.4 t -112.2 175.62 5.36 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.574 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 43.2 t -134.27 135.66 43.04 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -100.95 7.66 43.46 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.484 -175.132 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.487 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 62.8 m -82.85 134.87 35.08 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.637 178.691 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 53.2 p -101.91 167.91 9.76 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.165 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.3 m -69.75 -20.36 63.5 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.016 0.436 . . . . 0.0 110.289 178.082 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -74.64 -38.33 62.54 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.621 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -164.53 135.31 3.69 Favored Glycine 0 N--CA 1.428 -1.864 0 C-N-CA 120.455 -0.879 . . . . 0.0 112.285 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.2 t -73.23 129.55 38.29 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 179.048 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.487 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 75.1 mmtt -86.74 -25.51 24.67 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 112.068 0.395 . . . . 0.0 112.068 -176.496 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.449 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 19.1 p -97.77 -36.58 10.17 Favored 'General case' 0 C--N 1.313 -1.007 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.345 179.226 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 107.7 5.28 33.87 Favored Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.974 178.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.449 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 74.9 mmtt -83.96 -2.2 56.09 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-O 121.019 0.438 . . . . 0.0 110.542 178.869 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 67.16 23.91 9.41 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.721 177.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.433 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 1.7 p -73.78 -45.68 50.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.94 177.54 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 46.0 p 52.75 33.67 14.55 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.036 0.934 . . . . 0.0 113.375 176.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 156.74 144.13 3.85 Favored Glycine 0 N--CA 1.441 -1.032 0 C-N-CA 120.25 -0.976 . . . . 0.0 112.047 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.406 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 24.3 Cg_endo -63.18 -36.51 57.39 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.653 2.236 . . . . 0.0 112.406 -178.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -69.23 -14.93 63.24 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.938 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.6 m -125.47 22.56 7.66 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.038 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.433 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 4.6 t -83.33 137.98 33.73 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.298 -177.24 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 86.1 mttt -123.93 -4.83 8.02 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.384 -176.447 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.6 p -103.94 156.3 17.96 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 120.934 0.397 . . . . 0.0 111.911 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -71.34 -177.04 25.66 Favored Glycine 0 CA--C 1.52 0.361 0 CA-C-N 115.759 -0.655 . . . . 0.0 114.263 -176.38 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.465 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 41.3 m -78.21 -10.27 59.58 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -176.84 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 30.6 m -89.63 19.19 4.78 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.067 0.461 . . . . 0.0 110.365 178.342 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 29.6 t -96.97 166.44 11.61 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.825 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 49.3 m -66.32 -29.66 69.9 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -177.67 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.532 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 25.2 p -80.34 4.65 17.18 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.795 0.331 . . . . 0.0 111.383 -178.493 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.532 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 9.9 mmtp . . . . . 0 C--O 1.264 1.854 0 CA-C-O 117.939 -1.029 . . . . 0.0 110.832 -177.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt . . . . . 0 C--O 1.227 -0.098 0 CA-C-O 120.995 0.426 . . . . 0.0 110.929 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.718 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 96.3 m -92.36 139.71 30.32 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-O 121.387 0.613 . . . . 0.0 111.932 -179.302 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 80.9 p -93.26 179.51 5.39 Favored 'General case' 0 N--CA 1.429 -1.479 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.459 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.1 m -64.23 -26.03 68.33 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.234 -178.804 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.43 -44.22 83.51 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.828 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.524 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 42.4 t -75.12 -32.87 61.49 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.231 0.539 . . . . 0.0 110.977 -179.12 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 36.4 ttm-85 -80.36 0.56 32.59 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.178 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.2 t -89.0 162.27 16.13 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -134.12 117.41 13.65 Favored Pre-proline 0 C--N 1.318 -0.802 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -68.5 166.64 69.03 Favored 'Cis proline' 0 N--CA 1.477 0.507 0 C-N-CA 123.498 -1.459 . . . . 0.0 112.555 0.467 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.419 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 4.4 t -62.47 133.0 54.38 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.425 -178.026 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 80.2 mm-40 -112.93 18.7 17.93 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -174.348 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.524 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 1.2 m -65.49 -30.49 71.27 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 120.239 -0.584 . . . . 0.0 111.358 179.459 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 58.99 -136.88 50.93 Favored Glycine 0 CA--C 1.52 0.363 0 CA-C-N 115.961 -0.563 . . . . 0.0 114.15 176.044 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.0 m -93.32 -8.17 42.8 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.866 0.365 . . . . 0.0 111.165 -177.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -88.01 -49.88 6.77 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.134 179.239 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.4 ' HA ' ' HB3' ' A' ' 21' ' ' CYS . 5.4 t 59.96 92.61 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.074 -178.628 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -85.14 -7.6 59.0 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.164 -0.925 . . . . 0.0 112.78 -174.146 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.567 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 22.6 p -101.07 -176.47 3.17 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.255 0.55 . . . . 0.0 111.686 -177.562 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -100.38 -147.9 21.67 Favored Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.981 177.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -109.13 18.05 20.99 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 121.157 0.504 . . . . 0.0 110.491 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -83.17 -9.12 84.48 Favored Glycine 0 C--N 1.309 -0.935 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.489 -177.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.718 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 29.8 p -94.27 -30.61 14.47 Favored 'General case' 0 C--N 1.318 -0.795 0 O-C-N 122.769 -0.253 . . . . 0.0 111.468 -178.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 41.1 p 49.61 41.23 21.23 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-O 121.709 0.766 . . . . 0.0 109.854 -173.594 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.622 ' O ' ' HB2' ' A' ' 37' ' ' LYS . 0.3 OUTLIER -58.77 159.19 7.06 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 114.528 -1.215 . . . . 0.0 111.214 -177.606 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -104.59 12.93 32.48 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.627 -178.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -121.72 -64.43 1.22 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.054 -178.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 14.7 p -82.11 -25.35 34.53 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.958 0.408 . . . . 0.0 111.275 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.622 ' HB2' ' O ' ' A' ' 33' ' ' CYS . 1.4 mmpp? -93.32 58.38 2.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.79 0.329 . . . . 0.0 111.208 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.7 t -127.72 159.97 33.14 Favored 'General case' 0 C--N 1.313 -1.017 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.735 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.3 t -93.35 139.52 30.58 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.352 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -95.15 -0.16 53.59 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 120.862 0.363 . . . . 0.0 111.384 -177.58 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.554 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 62.8 m -81.31 135.29 35.69 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.219 -0.446 . . . . 0.0 109.949 177.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 69.5 p -101.3 166.47 10.74 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.758 -178.607 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.7 m -71.72 -15.2 62.19 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.532 179.403 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -80.66 -35.32 33.94 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.508 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -166.61 130.04 2.05 Favored Glycine 0 N--CA 1.439 -1.151 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.091 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 18.6 t -67.88 133.87 49.89 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 32.8 mmmt -92.41 -30.85 15.55 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -176.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.1 p -91.62 -39.61 11.77 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.611 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 114.41 4.74 21.72 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.817 -0.706 . . . . 0.0 113.028 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.511 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 75.3 mmtt -86.32 -2.99 58.89 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.982 0.391 . . . . 0.0 111.507 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 67.94 18.31 9.56 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.311 0.577 . . . . 0.0 111.284 177.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.505 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 0.9 OUTLIER -65.83 -49.55 67.8 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.008 178.108 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 46.5 p 53.05 46.47 26.65 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.042 -0.981 . . . . 0.0 113.111 177.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 135.13 153.1 6.67 Favored Glycine 0 N--CA 1.442 -0.951 0 C-N-CA 120.212 -0.994 . . . . 0.0 112.687 177.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.09 -18.34 30.92 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.752 2.302 . . . . 0.0 112.68 -178.412 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -82.16 -4.83 57.78 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.158 0.504 . . . . 0.0 110.729 -178.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 49.3 m -148.07 26.44 0.98 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.317 0.58 . . . . 0.0 110.209 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.505 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 12.2 t -84.21 138.2 33.1 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.988 -177.403 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -110.82 12.43 22.38 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.445 0.641 . . . . 0.0 109.406 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.511 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 19.3 m -108.66 151.25 26.41 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.456 -178.473 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLY . . . . . 0.401 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -89.18 -106.7 1.11 Allowed Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 121.106 -0.569 . . . . 0.0 112.558 -178.058 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 61.7 p -129.32 -9.0 4.71 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-O 120.9 0.381 . . . . 0.0 111.142 -178.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.1 m -104.38 20.61 18.14 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.88 -175.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 35.3 t -102.13 170.48 8.08 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.669 179.334 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.6 t -65.93 -28.94 69.3 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.186 -178.554 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.554 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 17.3 p -80.52 1.81 27.96 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 120.845 0.355 . . . . 0.0 111.488 -178.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 61' ' ' GLY . 23.5 mmtp . . . . . 0 C--O 1.258 1.525 0 CA-C-O 117.544 -1.217 . . . . 0.0 110.533 -179.104 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.487 ' HD2' ' N ' ' A' ' 9' ' ' LYS . 11.5 mptt . . . . . 0 N--CA 1.45 -0.459 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.854 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 79.7 m -100.35 146.33 27.09 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.271 -177.335 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.5 p -94.68 178.76 5.48 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.589 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.5 p -60.47 -29.35 68.99 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.385 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.27 -45.66 87.09 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.259 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.481 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 17.5 t -69.42 -35.27 75.57 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.006 0.432 . . . . 0.0 110.71 -178.694 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 15' ' ' ARG . 19.0 mtt180 -76.12 0.91 17.19 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.8 m -81.18 160.12 24.43 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.683 0.278 . . . . 0.0 111.064 -178.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.4 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 74.9 mm-40 -126.48 108.45 23.47 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.991 178.305 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.4 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 69.3 Cg_endo -74.44 173.12 58.74 Favored 'Cis proline' 0 C--O 1.241 0.634 0 C-N-CA 123.554 -1.436 . . . . 0.0 112.145 -2.12 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.481 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 8.7 t -57.66 139.92 52.5 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.871 -177.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 86.1 mm-40 -119.01 16.49 13.34 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -175.563 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -62.86 -29.86 71.07 Favored 'General case' 0 C--O 1.241 0.619 0 C-N-CA 120.269 -0.572 . . . . 0.0 110.412 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 59.33 -139.5 48.62 Favored Glycine 0 N--CA 1.448 -0.562 0 CA-C-N 115.663 -0.699 . . . . 0.0 113.032 176.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -99.17 10.69 40.94 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.133 0.492 . . . . 0.0 110.647 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -98.61 -50.23 4.33 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 177.474 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 t 57.3 94.6 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.0 179.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -97.36 9.61 41.84 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.562 -175.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.575 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 31.7 p -107.63 173.59 6.26 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.947 -179.335 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -102.06 178.45 26.93 Favored Glycine 0 N--CA 1.445 -0.742 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.798 178.094 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -82.14 78.23 8.84 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.221 0.534 . . . . 0.0 111.284 -178.647 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -159.14 23.09 0.31 Allowed Glycine 0 N--CA 1.444 -0.821 0 N-CA-C 111.265 -0.734 . . . . 0.0 111.265 178.002 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.854 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 25.1 p -116.52 -19.79 9.91 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 -178.255 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 71.7 p 50.92 30.41 5.22 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-O 121.573 0.702 . . . . 0.0 110.543 -175.589 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.429 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 1.9 t -76.84 116.41 17.48 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.008 -177.204 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -88.1 16.94 5.44 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.37 0.605 . . . . 0.0 110.607 -176.83 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.38 -54.07 2.67 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.216 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 28.6 p -98.44 -30.48 12.52 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.122 178.319 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.546 ' NZ ' ' HB2' ' A' ' 37' ' ' LYS . 0.3 OUTLIER -106.52 80.18 1.45 Allowed 'General case' 0 N--CA 1.435 -1.193 0 CA-C-O 121.448 0.642 . . . . 0.0 111.796 -175.17 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.5 t -157.17 161.75 39.32 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.035 178.69 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.6 t -89.96 146.91 24.03 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 120.835 0.35 . . . . 0.0 110.736 -179.495 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 -114.51 2.76 14.69 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.098 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.572 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 57.2 m -79.71 148.11 31.67 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.235 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 44.8 p -114.25 162.24 16.82 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.698 -179.132 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.446 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 6.6 p -63.8 -25.75 68.32 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.021 0.438 . . . . 0.0 111.312 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -73.4 -35.09 65.82 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.299 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -164.24 131.07 2.33 Favored Glycine 0 N--CA 1.442 -0.949 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.032 -179.052 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 27.4 t -76.96 133.65 39.13 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 120.743 0.306 . . . . 0.0 110.483 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -86.41 -41.06 14.77 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -178.127 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.451 ' HA ' ' HB2' ' A' ' 65' ' ' SER . 19.2 p -83.37 -39.23 20.97 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.033 -177.411 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.64 5.82 25.57 Favored Glycine 0 N--CA 1.44 -1.071 0 C-N-CA 120.47 -0.871 . . . . 0.0 113.029 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -84.58 -0.51 53.48 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.075 0.464 . . . . 0.0 110.264 178.301 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 63.66 21.23 12.62 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.215 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.56 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 3.2 p -70.04 -47.53 61.67 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.956 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.446 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 73.5 p 55.35 25.68 7.84 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 114.956 -1.02 . . . . 0.0 113.032 177.246 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 152.02 155.22 6.93 Favored Glycine 0 N--CA 1.441 -1.025 0 C-N-CA 120.297 -0.954 . . . . 0.0 112.518 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.455 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 20.8 Cg_endo -60.36 -26.64 83.18 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 123.258 2.639 . . . . 0.0 113.179 -179.075 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -70.74 -17.73 62.8 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.927 0.394 . . . . 0.0 111.656 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.1 m -135.43 25.15 3.48 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.008 0.432 . . . . 0.0 110.032 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.56 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 6.3 t -81.59 126.42 31.71 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.146 -176.767 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp -106.34 17.27 23.66 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.462 -178.328 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.3 m -109.5 159.38 17.11 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.197 -175.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -110.21 -77.04 0.91 Allowed Glycine 0 N--CA 1.439 -1.115 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.624 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 34.8 m -146.47 159.3 43.59 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 110.376 -0.231 . . . . 0.0 110.376 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.2 m 65.21 7.4 4.13 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 177.73 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' CYS . . . . . 0.433 ' HB3' ' HG2' ' A' ' 67' ' ' LYS . 45.3 t -75.46 167.47 21.84 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 176.887 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.451 ' HB2' ' HA ' ' A' ' 48' ' ' CYS . 15.4 m -64.34 -16.56 62.46 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 120.771 0.319 . . . . 0.0 111.771 -177.592 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.572 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 25.5 p -101.15 1.92 39.64 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 120.571 0.224 . . . . 0.0 111.29 178.433 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.52 ' HE2' ' SG ' ' A' ' 66' ' ' CYS . 71.9 mmtt . . . . . 0 C--O 1.261 1.708 0 CA-C-O 117.843 -1.075 . . . . 0.0 111.049 -177.236 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.9 mttt . . . . . 0 CA--C 1.514 -0.412 0 CA-C-O 120.944 0.402 . . . . 0.0 110.119 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.563 ' SG ' ' HB2' ' A' ' 27' ' ' CYS . 78.6 m -95.86 147.86 23.21 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -176.429 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 74.8 p -100.51 179.6 4.39 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.805 -178.088 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.5 m -62.12 -20.07 63.68 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.31 -178.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.38 -50.14 48.94 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 120.956 0.408 . . . . 0.0 110.023 177.541 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 51.4 t -73.57 -35.68 65.48 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.009 178.795 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 27.7 mtm180 -69.35 -3.34 13.75 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.948 0.404 . . . . 0.0 111.649 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.5 t -83.62 163.97 20.01 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 176.455 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -132.86 111.43 13.37 Favored Pre-proline 0 C--N 1.306 -1.3 0 CA-C-O 120.884 0.373 . . . . 0.0 110.565 178.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -75.22 173.14 59.5 Favored 'Cis proline' 0 C--N 1.35 0.613 0 C-N-CA 123.444 -1.482 . . . . 0.0 112.238 -0.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 71.2 m -59.86 140.68 56.44 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.075 0.464 . . . . 0.0 111.164 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 28.7 mm-40 -114.29 21.1 14.99 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.004 -177.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.44 ' HB3' ' HA ' ' A' ' 25' ' ' CYS . 11.0 m -66.1 -33.14 75.1 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.84 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 79.75 -114.85 3.95 Favored Glycine 0 N--CA 1.438 -1.17 0 C-N-CA 120.775 -0.726 . . . . 0.0 111.445 -178.521 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.9 t -129.29 -3.27 4.97 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.043 0.449 . . . . 0.0 110.248 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -88.22 -40.81 13.39 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.086 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.538 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 0.6 OUTLIER 66.72 104.39 0.04 OUTLIER 'General case' 0 CA--C 1.505 -0.772 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.848 -179.615 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -88.3 -14.88 37.2 Favored 'General case' 0 C--N 1.305 -1.346 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.009 177.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.563 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 26.6 p -84.19 170.86 13.33 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.194 178.294 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.12 -126.68 2.87 Favored Glycine 0 N--CA 1.441 -0.987 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.29 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -137.36 77.41 1.64 Allowed 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 121.635 0.731 . . . . 0.0 110.556 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -172.36 43.21 0.17 Allowed Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.844 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.566 ' SG ' ' HE2' ' A' ' 37' ' ' LYS . 12.0 p -130.88 -28.63 1.97 Allowed 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 120.6 0.238 . . . . 0.0 111.178 -178.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.8 p 50.04 45.66 25.18 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 123.466 0.706 . . . . 0.0 112.8 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.637 ' O ' ' HB2' ' A' ' 37' ' ' LYS . 59.1 m -74.6 170.95 14.74 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.503 178.164 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -109.41 3.54 21.54 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.27 0.557 . . . . 0.0 110.08 178.174 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -104.62 -69.09 0.82 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.389 -178.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.538 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 25.3 p -88.68 0.23 56.63 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.139 -179.631 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.637 ' HB2' ' O ' ' A' ' 33' ' ' CYS . 34.1 mmtm -120.39 37.67 4.2 Favored 'General case' 0 CA--C 1.503 -0.832 0 CA-C-O 121.568 0.699 . . . . 0.0 111.454 -179.359 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.5 t -113.81 165.42 12.59 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.558 177.035 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 27.9 t -102.73 136.43 42.57 Favored 'General case' 0 C--N 1.307 -1.255 0 C-N-CA 120.633 -0.427 . . . . 0.0 109.922 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -87.31 -5.26 58.97 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.041 0.448 . . . . 0.0 110.806 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.426 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 69.3 m -80.03 136.01 36.49 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.176 178.345 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 61.1 p -92.59 152.91 19.34 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.448 -178.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.516 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 45.5 m -66.52 -13.0 60.35 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-O 121.215 0.531 . . . . 0.0 110.795 178.606 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -86.01 -19.81 29.8 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.248 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 178.2 134.8 2.15 Favored Glycine 0 N--CA 1.438 -1.17 0 C-N-CA 120.976 -0.63 . . . . 0.0 112.033 -178.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 30.9 t -69.03 142.24 54.62 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -112.18 -10.32 13.86 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.216 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.522 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 14.5 p -103.67 -39.48 6.67 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.121 -0.632 . . . . 0.0 109.962 177.158 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 122.9 -1.62 9.96 Favored Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.81 -0.709 . . . . 0.0 113.437 177.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.807 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 35.2 mmtp -84.71 -4.12 58.88 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 117.136 0.468 . . . . 0.0 111.526 -178.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 67.85 19.58 9.51 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.273 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.559 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.2 p -69.06 -44.29 72.88 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.132 -179.518 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.516 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 67.0 p 53.65 27.75 7.17 Favored 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 176.142 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.97 158.62 7.66 Favored Glycine 0 N--CA 1.443 -0.882 0 C-N-CA 120.095 -1.05 . . . . 0.0 112.151 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.91 -26.51 81.3 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 123.159 2.572 . . . . 0.0 113.065 -178.476 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -60.29 -50.25 74.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.873 0.368 . . . . 0.0 111.467 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.0 m -107.21 19.38 20.45 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.237 -177.271 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.559 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 41.8 t -84.87 135.47 34.06 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 121.183 0.516 . . . . 0.0 111.509 -178.27 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -122.28 13.19 10.31 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.154 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.807 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 3.7 m -99.71 116.72 32.46 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 178.547 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -106.37 89.38 0.6 Allowed Glycine 0 C--N 1.298 -1.549 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.916 -175.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.458 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 39.7 m 66.14 164.72 0.18 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.17 0.588 . . . . 0.0 111.339 -179.15 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.9 m 69.31 -14.32 0.33 Allowed 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 25.5 t -86.22 165.37 16.56 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 119.873 -0.731 . . . . 0.0 110.932 -178.104 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.8 m -64.2 -22.69 67.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.738 -178.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.426 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 27.4 p -90.29 4.22 51.36 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.81 178.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.458 ' HD2' ' H ' ' A' ' 62' ' ' SER . 0.3 OUTLIER . . . . . 0 C--O 1.256 1.403 0 CA-C-O 118.078 -0.963 . . . . 0.0 110.474 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 50.4 mtpt . . . . . 0 C--O 1.235 0.3 0 CA-C-O 121.437 0.637 . . . . 0.0 111.341 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.731 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 71.7 m -92.93 139.4 30.57 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.218 177.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 64.4 p -88.08 -179.06 6.11 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.758 -177.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.0 p -62.74 -30.59 71.55 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.196 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.45 -49.43 76.86 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.695 179.468 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.425 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 43.2 t -67.97 -29.29 68.3 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.431 0.634 . . . . 0.0 110.423 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.4 mmt180 -84.38 15.94 3.36 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.975 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.6 m -107.81 161.09 15.22 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 175.597 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -123.35 110.87 30.36 Favored Pre-proline 0 C--N 1.315 -0.908 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.724 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -79.17 171.27 65.69 Favored 'Cis proline' 0 C--O 1.239 0.544 0 C-N-CA 123.483 -1.465 . . . . 0.0 111.852 -0.326 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 95.9 m -55.31 129.06 37.01 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.391 0.615 . . . . 0.0 111.215 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 31.4 mm-40 -94.75 8.89 41.03 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.034 -178.437 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.611 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 7.4 m -62.26 -37.02 83.85 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.093 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 64.59 -144.56 48.52 Favored Glycine 0 N--CA 1.441 -1.011 0 CA-C-N 115.687 -0.688 . . . . 0.0 113.105 178.008 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.7 m -88.58 -8.51 54.59 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -178.009 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -86.66 -54.13 4.56 Favored 'General case' 0 CA--C 1.491 -1.29 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 178.222 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.685 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 8.6 t 63.48 101.18 0.03 OUTLIER 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 114.358 -1.292 . . . . 0.0 112.467 175.822 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -97.18 12.15 33.82 Favored 'General case' 0 C--N 1.308 -1.197 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -178.361 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.731 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 21.8 p -104.12 166.05 10.65 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 119.754 -0.779 . . . . 0.0 111.24 176.624 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -79.41 -112.49 0.24 Allowed Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.225 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -139.84 -173.34 3.61 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -179.205 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.96 -33.8 5.67 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.472 -0.87 . . . . 0.0 113.095 177.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 18.5 p -69.37 -36.88 77.26 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.738 0.304 . . . . 0.0 110.814 -179.228 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 46.9 p 49.59 43.96 24.2 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.634 -179.071 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 72.3 m -64.81 172.38 2.85 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.926 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.39 3.29 23.17 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.539 0.685 . . . . 0.0 109.619 177.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -106.45 -72.06 0.73 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.542 -178.237 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.685 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 7.8 p -80.25 -23.43 40.83 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.183 0.516 . . . . 0.0 111.275 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.469 ' NZ ' ' SG ' ' A' ' 27' ' ' CYS . 11.2 mptt -95.36 105.52 17.48 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-O 121.473 0.654 . . . . 0.0 111.691 179.226 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.4 t -171.7 -173.04 1.11 Allowed 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 114.891 -1.049 . . . . 0.0 108.348 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.423 ' SG ' ' HB2' ' A' ' 41' ' ' CYS . 46.4 t -136.98 127.18 26.26 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 177.354 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 41.4 m-80 -72.48 -20.28 61.4 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.972 0.415 . . . . 0.0 110.705 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.488 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 49.5 m -68.59 137.15 54.04 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.712 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 77.9 p -117.9 173.38 6.8 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.434 -177.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.1 m -62.08 -20.27 63.84 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 121.04 0.448 . . . . 0.0 110.947 178.762 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -68.09 -39.59 82.83 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.391 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 176.22 146.51 6.01 Favored Glycine 0 N--CA 1.428 -1.855 0 C-N-CA 120.848 -0.691 . . . . 0.0 111.853 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 45.1 t -63.91 129.7 41.14 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 178.116 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.488 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 30.8 mmmt -96.23 -12.69 24.23 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -176.261 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.499 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 18.7 p -99.97 -41.4 7.21 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 119.654 -0.818 . . . . 0.0 109.928 177.123 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.46 15.82 9.3 Favored Glycine 0 N--CA 1.433 -1.531 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.816 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.499 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 75.7 mmtt -94.64 6.06 50.01 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 176.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 67.99 37.98 2.88 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.694 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.629 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 26.6 p -113.14 141.9 46.38 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.327 176.539 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.2 p -136.55 106.4 6.24 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.624 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 90.8 147.86 19.84 Favored Glycine 0 N--CA 1.437 -1.234 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.312 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -59.37 -30.26 92.28 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.327 2.018 . . . . 0.0 111.918 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -63.63 -47.01 83.1 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.565 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.4 m -101.52 19.62 17.59 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.257 -178.163 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.629 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 44.6 t -75.24 126.63 31.41 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 120.874 0.369 . . . . 0.0 110.375 179.594 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -99.58 -5.11 29.65 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.366 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.403 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 15.2 m -89.0 142.18 27.85 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.017 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -116.27 73.08 0.27 Allowed Glycine 0 C--N 1.316 -0.575 0 C-N-CA 120.808 -0.711 . . . . 0.0 113.074 -176.35 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.451 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 9.7 t 65.65 166.39 0.19 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.18 0.592 . . . . 0.0 111.355 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.3 t 70.21 -16.57 0.3 Allowed 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.411 0.684 . . . . 0.0 112.759 177.863 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 20.1 t -76.88 165.16 25.06 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 110.354 -0.239 . . . . 0.0 110.354 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 6.7 m -64.24 -24.59 67.72 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.87 -177.172 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.49 ' SG ' ' HE2' ' A' ' 67' ' ' LYS . 20.8 p -75.92 -4.09 39.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.922 0.392 . . . . 0.0 111.01 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.49 ' HE2' ' SG ' ' A' ' 66' ' ' CYS . 18.0 mmtt . . . . . 0 C--O 1.258 1.517 0 CA-C-O 117.485 -1.245 . . . . 0.0 110.34 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt . . . . . 0 C--O 1.241 0.637 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.639 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 59.4 m -91.34 156.49 17.74 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.659 -1.155 . . . . 0.0 112.617 -176.224 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.3 p -94.16 177.76 5.86 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.465 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.7 m -57.75 -37.74 74.14 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.782 0.29 . . . . 0.0 111.782 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.97 -42.28 98.96 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 120.942 0.401 . . . . 0.0 111.517 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.56 ' HB3' ' HB3' ' A' ' 10' ' ' CYS . 11.7 t -73.83 -25.46 60.1 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.365 0.603 . . . . 0.0 109.635 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 42.2 mtt180 -89.78 12.83 15.98 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.411 178.341 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.6 m -89.05 177.71 6.58 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 179.418 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.469 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 3.4 tm-20 -131.84 111.08 14.61 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-O 120.707 0.289 . . . . 0.0 110.507 178.765 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.469 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 72.0 Cg_endo -77.94 -170.55 8.85 Favored 'Cis proline' 0 C--N 1.347 0.481 0 C-N-CA 122.926 -1.697 . . . . 0.0 110.924 -2.264 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.7 t -59.46 122.95 15.27 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 120.898 0.38 . . . . 0.0 110.575 -179.217 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 84.5 mm-40 -110.17 15.73 22.22 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.007 -177.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.857 ' SG ' ' HA ' ' A' ' 25' ' ' CYS . 3.4 t -65.62 -27.88 68.71 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 50.75 -139.01 23.94 Favored Glycine 0 C--N 1.341 0.826 0 CA-C-N 114.704 -1.135 . . . . 0.0 115.345 173.323 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.2 m -84.03 -15.39 47.74 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.101 -0.549 . . . . 0.0 111.293 -177.836 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.8 mmmt -73.95 -48.75 28.42 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.186 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.857 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 8.2 t 53.59 81.9 0.09 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.74 -179.13 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -86.61 -11.2 52.12 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.869 -175.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.639 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 30.8 p -82.92 175.52 10.0 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.0 0.428 . . . . 0.0 111.176 -178.529 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -123.04 -135.57 4.62 Favored Glycine 0 N--CA 1.437 -1.253 0 C-N-CA 120.474 -0.87 . . . . 0.0 112.499 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -74.58 152.29 39.31 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 122.899 0.48 . . . . 0.0 111.071 -179.029 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 94.84 15.92 43.89 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.021 -0.609 . . . . 0.0 112.944 178.143 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.69 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 16.1 t -114.77 -62.61 1.58 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.103 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 76.3 p 52.38 35.48 17.46 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.124 0.569 . . . . 0.0 111.8 -177.027 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.69 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -58.35 142.44 48.21 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.339 179.757 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -93.28 18.31 9.78 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 121.392 0.615 . . . . 0.0 109.681 178.21 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -120.71 -53.55 2.08 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.531 -177.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.649 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 29.8 p -98.24 -38.93 9.09 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.735 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 11.1 ttmm -107.18 36.01 2.84 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.471 0.653 . . . . 0.0 111.104 -174.285 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.424 ' O ' ' HD3' ' A' ' 67' ' ' LYS . 14.7 t -96.86 171.27 8.62 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.729 -177.601 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -99.8 148.59 24.25 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.663 178.656 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -110.28 3.89 20.36 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.656 -178.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.406 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 64.8 m -80.08 155.79 27.38 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-O 120.827 0.346 . . . . 0.0 110.712 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 54.7 p -122.87 159.15 28.79 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.403 -178.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.5 m -65.03 -27.97 69.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.148 0.499 . . . . 0.0 110.241 179.176 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -66.52 -32.18 73.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.896 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -174.44 128.36 1.44 Allowed Glycine 0 N--CA 1.437 -1.253 0 C-N-CA 120.89 -0.671 . . . . 0.0 111.759 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.9 t -63.31 144.23 57.12 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 178.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm -104.9 -21.58 13.29 Favored 'General case' 0 C--N 1.317 -0.848 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -175.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 25.7 p -98.12 -41.69 7.81 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.75 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.93 -2.38 19.54 Favored Glycine 0 N--CA 1.443 -0.893 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.094 -178.601 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.602 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 30.4 mmmt -79.65 -3.33 46.77 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.691 0.281 . . . . 0.0 110.405 178.938 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 70.16 17.06 7.3 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.513 176.835 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.572 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 3.4 p -69.5 -37.5 77.24 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.798 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 44.1 p 52.09 37.39 21.39 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.715 0.806 . . . . 0.0 112.797 177.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 134.44 159.59 8.88 Favored Glycine 0 N--CA 1.439 -1.129 0 C-N-CA 120.148 -1.025 . . . . 0.0 112.296 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.26 -25.52 76.79 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.968 2.445 . . . . 0.0 112.798 -178.399 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -62.01 -40.08 94.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.692 -178.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 40.2 m -115.53 18.35 15.95 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 121.035 0.445 . . . . 0.0 110.626 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.572 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 48.6 t -79.06 120.77 24.1 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.21 0.529 . . . . 0.0 111.067 -178.645 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -108.49 7.48 26.88 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.81 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.602 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 26.5 m -80.77 142.75 33.46 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.656 178.386 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -127.2 82.37 0.35 Allowed Glycine 0 C--N 1.311 -0.842 0 C-N-CA 120.925 -0.655 . . . . 0.0 111.771 -178.332 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 52.0 m 62.99 171.99 0.15 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.722 0.409 . . . . 0.0 110.992 -178.054 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 31.6 m 62.81 3.53 1.21 Allowed 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 176.429 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 33.1 t -101.74 167.26 10.21 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 122.032 -0.417 . . . . 0.0 110.376 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.9 t -68.46 -27.84 66.51 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.748 -177.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.406 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 25.6 p -82.55 -0.86 48.73 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.138 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.424 ' HD3' ' O ' ' A' ' 38' ' ' THR . 70.8 mmtt . . . . . 0 C--O 1.263 1.814 0 CA-C-O 117.676 -1.154 . . . . 0.0 110.786 -178.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.8 mptt . . . . . 0 N--CA 1.446 -0.659 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.515 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 85.9 m -88.5 139.1 30.82 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.016 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.426 ' OG1' ' HB2' ' A' ' 26' ' ' GLN . 73.4 p -89.42 -177.62 5.39 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.396 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 11.3 m -64.13 -22.77 67.07 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.064 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.86 -49.39 58.73 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 120.837 0.351 . . . . 0.0 110.737 179.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 36.3 t -73.48 -31.16 63.6 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.002 0.43 . . . . 0.0 110.536 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.553 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 1.7 mmp_? -74.17 -11.39 60.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.857 179.252 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.9 t -82.11 165.27 20.71 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.406 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 8.0 pt-20 -126.37 115.08 23.36 Favored Pre-proline 0 C--N 1.316 -0.85 0 CA-C-O 120.81 0.338 . . . . 0.0 110.997 -179.294 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.406 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 1.8 Cg_endo -81.27 -174.07 13.4 Favored 'Cis proline' 0 C--N 1.348 0.514 0 C-N-CA 123.58 -1.425 . . . . 0.0 111.722 -0.163 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.5 m -56.63 126.56 27.25 Favored 'General case' 0 CA--C 1.504 -0.814 0 CA-C-O 121.644 0.735 . . . . 0.0 112.55 -178.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -101.92 12.82 36.33 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.738 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.405 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 15.1 m -60.99 -28.77 69.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.269 177.619 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 59.58 -112.6 4.45 Favored Glycine 0 C--N 1.34 0.791 0 CA-C-N 115.74 -0.663 . . . . 0.0 112.028 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 70.3 m -121.43 17.75 11.35 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.147 0.498 . . . . 0.0 110.211 177.525 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -102.31 -45.83 4.99 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.836 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 55.9 90.94 0.03 OUTLIER 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.608 0.718 . . . . 0.0 110.601 -176.715 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.426 ' HB2' ' OG1' ' A' ' 11' ' ' THR . 49.4 mt-30 -92.9 -6.08 49.44 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.298 -174.708 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.515 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 26.3 p -88.27 174.06 8.41 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-O 121.101 0.477 . . . . 0.0 111.501 -177.871 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -118.12 -134.29 5.05 Favored Glycine 0 N--CA 1.443 -0.892 0 C-N-CA 120.936 -0.649 . . . . 0.0 113.242 -179.115 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -74.25 176.8 6.31 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 123.189 0.595 . . . . 0.0 112.027 -177.178 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 62.46 31.7 80.49 Favored Glycine 0 CA--C 1.502 -0.76 0 CA-C-N 115.283 -0.871 . . . . 0.0 112.158 178.332 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 49.3 t -124.9 -76.7 0.59 Allowed 'General case' 0 N--CA 1.423 -1.823 0 C-N-CA 120.651 -0.419 . . . . 0.0 111.909 -177.582 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 75.1 p 48.73 41.12 17.42 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.548 0.689 . . . . 0.0 110.906 -178.001 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.426 ' HB2' ' SG ' ' A' ' 36' ' ' CYS . 0.5 OUTLIER -54.48 157.41 2.88 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 114.753 -1.112 . . . . 0.0 112.445 -178.66 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -95.57 21.03 8.75 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.341 0.591 . . . . 0.0 110.386 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -131.55 -63.81 0.82 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.371 -179.69 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.426 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 27.4 p -82.91 -45.2 14.49 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.705 -0.679 . . . . 0.0 112.16 -179.195 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.0 ttmt -118.79 50.94 1.15 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.192 0.52 . . . . 0.0 112.162 -170.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.7 t -97.62 162.66 13.18 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.707 179.004 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.413 ' SG ' ' HB2' ' A' ' 41' ' ' CYS . 51.6 t -94.96 140.56 29.78 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -99.64 0.61 42.4 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.837 -179.149 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.413 ' HB2' ' SG ' ' A' ' 39' ' ' CYS . 62.1 m -82.93 141.09 32.42 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.727 177.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 59.3 p -100.39 164.89 11.72 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 -178.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.452 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 7.9 m -69.55 -9.68 54.97 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 121.299 0.571 . . . . 0.0 110.539 178.802 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -99.44 -32.77 10.97 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.005 179.517 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -150.2 128.42 2.67 Favored Glycine 0 N--CA 1.438 -1.187 0 C-N-CA 120.289 -0.958 . . . . 0.0 112.843 -177.174 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.0 t -80.57 133.73 35.82 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.011 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -98.84 -24.78 14.86 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -176.005 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 23.2 p -93.43 -35.41 13.0 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.221 -0.592 . . . . 0.0 110.579 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 110.37 -2.24 29.51 Favored Glycine 0 N--CA 1.438 -1.204 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.932 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -78.4 -7.16 57.04 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.034 0.445 . . . . 0.0 110.47 179.15 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 64.16 33.6 11.72 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.173 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.494 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 3.1 p -75.1 -49.12 20.69 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.139 178.304 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.452 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 53.4 p 50.45 76.27 0.15 Allowed 'General case' 0 C--O 1.237 0.423 0 C-N-CA 123.941 0.896 . . . . 0.0 112.432 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 113.84 138.92 7.06 Favored Glycine 0 N--CA 1.436 -1.324 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.714 179.071 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.512 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 21.8 Cg_endo -62.12 -27.98 79.43 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.783 2.322 . . . . 0.0 112.524 -178.318 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -62.84 -39.51 94.58 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.106 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.4 m -107.05 24.23 13.14 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.487 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.512 ' HB2' ' HA ' ' A' ' 55' ' ' PRO . 0.5 OUTLIER -76.04 131.42 39.49 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.772 -178.272 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -106.73 3.77 26.98 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.219 0.533 . . . . 0.0 109.607 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 4.3 m -96.24 167.3 11.28 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.877 -175.211 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -98.59 -106.63 2.62 Favored Glycine 0 N--CA 1.442 -0.959 0 CA-C-N 115.815 -0.63 . . . . 0.0 112.222 179.243 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.9 m -131.43 -12.74 3.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.73 0.3 . . . . 0.0 111.591 -178.625 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 17.4 m -103.0 20.51 17.43 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -175.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 38.2 t -96.75 165.69 12.0 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.838 0.351 . . . . 0.0 110.963 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.6 m -64.18 -25.32 68.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.291 -178.111 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.502 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 26.7 p -89.84 13.53 14.26 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.725 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.502 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 39.5 mmtm . . . . . 0 C--O 1.264 1.822 0 CA-C-O 117.875 -1.059 . . . . 0.0 110.437 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 47.8 mtmt . . . . . 0 CA--C 1.511 -0.55 0 CA-C-O 121.36 0.6 . . . . 0.0 110.511 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.523 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 78.1 m -80.53 134.9 36.01 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.682 178.202 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 61.2 p -80.87 177.32 9.12 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.126 -178.784 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.9 p -58.15 -37.16 74.15 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.211 178.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.02 -47.53 82.7 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.862 0.363 . . . . 0.0 110.839 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 47.4 t -68.13 -38.61 82.38 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.163 0.506 . . . . 0.0 110.406 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 29.3 ttt180 -73.05 -9.36 58.65 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.874 -179.094 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.2 m -71.99 164.57 25.88 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 122.107 -0.37 . . . . 0.0 110.594 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.431 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -125.23 114.08 25.99 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.654 178.442 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.431 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 74.4 Cg_endo -75.73 174.34 53.36 Favored 'Cis proline' 0 C--O 1.237 0.438 0 C-N-CA 123.394 -1.503 . . . . 0.0 112.066 -1.184 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.578 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 49.6 t -57.9 132.88 54.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.228 -178.819 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 79.5 mm-40 -117.59 17.35 14.47 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.958 -179.235 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.682 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.8 t -60.11 -29.23 68.47 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.966 -179.588 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 81.13 -153.1 33.58 Favored Glycine 0 N--CA 1.431 -1.66 0 CA-C-N 115.463 -0.79 . . . . 0.0 112.195 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.5 m -107.33 11.82 28.73 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -102.53 -30.58 10.89 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.862 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.67 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 1.1 m 65.59 103.78 0.04 OUTLIER 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.568 0.699 . . . . 0.0 112.799 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -95.48 -5.57 42.63 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 115.38 -0.827 . . . . 0.0 108.861 176.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.523 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 22.8 p -92.89 160.12 15.05 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.184 -178.834 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -79.96 162.15 46.35 Favored Glycine 0 N--CA 1.44 -1.049 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 174.632 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.24 163.04 23.69 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 117.529 0.664 . . . . 0.0 111.307 -178.283 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 98.19 0.88 58.31 Favored Glycine 0 N--CA 1.439 -1.151 0 N-CA-C 110.311 -1.116 . . . . 0.0 110.311 -175.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 43.2 t -75.46 142.19 42.99 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 75.7 p -103.8 14.18 31.45 Favored 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -175.633 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.7 m -67.33 133.03 48.86 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.032 175.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -99.69 12.91 35.35 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.645 0.736 . . . . 0.0 109.035 177.47 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.8 -57.01 2.12 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.403 -178.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.682 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 28.4 p -82.6 -43.62 16.79 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.746 177.538 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.2 ttpm? -101.8 81.15 2.1 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.519 178.564 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.3 t -121.73 155.41 35.3 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 -179.598 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.6 t -92.83 135.05 34.48 Favored 'General case' 0 N--CA 1.444 -0.725 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.044 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -92.85 1.34 57.34 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 121.1 0.476 . . . . 0.0 110.881 -178.695 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.51 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 56.3 m -88.81 133.7 34.17 Favored 'General case' 0 N--CA 1.437 -1.12 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.338 179.197 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 1.6 t -108.69 164.77 12.08 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.337 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.551 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 44.4 m -70.58 -9.88 57.94 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.707 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -88.33 -19.69 26.35 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.432 177.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -179.65 131.11 1.61 Allowed Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.058 -179.37 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.6 t -76.9 147.84 36.78 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -109.71 -30.89 7.66 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 112.324 0.491 . . . . 0.0 112.324 -177.567 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.53 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 29.1 p -87.89 -34.18 18.26 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.188 -0.605 . . . . 0.0 111.397 -177.574 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.28 -1.38 31.14 Favored Glycine 0 N--CA 1.445 -0.765 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.507 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.558 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 75.1 mmtt -80.58 -8.64 59.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.029 0.442 . . . . 0.0 109.902 178.625 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 67.82 30.87 6.08 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.062 -0.972 . . . . 0.0 111.144 178.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.411 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.6 p -72.66 -44.05 62.36 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.157 177.587 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.551 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 77.7 p 50.78 41.0 25.83 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.72 0.808 . . . . 0.0 112.859 177.146 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 147.4 136.38 2.8 Favored Glycine 0 N--CA 1.437 -1.276 0 C-N-CA 120.384 -0.912 . . . . 0.0 111.731 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.423 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 13.2 Cg_endo -57.2 -24.6 59.97 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.122 2.548 . . . . 0.0 113.621 -178.387 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -74.22 -35.86 63.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.923 0.392 . . . . 0.0 111.197 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 37.0 t -101.2 10.92 40.29 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.524 0.678 . . . . 0.0 109.746 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.423 ' HB2' ' HA ' ' A' ' 55' ' ' PRO . 13.8 t -79.87 110.27 15.07 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.69 -178.631 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -108.24 -6.95 16.11 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.725 -177.051 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.558 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.8 p -85.36 157.92 20.4 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.157 -0.617 . . . . 0.0 111.707 -179.165 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -64.6 175.34 12.41 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 115.234 0.854 . . . . 0.0 115.234 -174.009 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.53 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 14.2 m -77.94 -10.63 59.68 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 123.697 0.799 . . . . 0.0 111.121 -178.698 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.7 m -93.95 9.81 35.95 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.96 0.41 . . . . 0.0 110.676 179.077 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 44.2 t -81.35 169.63 17.01 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.205 -178.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.8 t -69.97 -24.76 63.37 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.956 -177.278 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.51 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 22.0 p -82.5 -3.87 56.57 Favored 'General case' 0 CA--C 1.512 -0.515 0 C-N-CA 120.466 -0.493 . . . . 0.0 110.815 -179.253 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.53 ' HG3' ' HA ' ' A' ' 62' ' ' SER . 38.5 mmtm . . . . . 0 C--O 1.26 1.657 0 CA-C-O 117.533 -1.222 . . . . 0.0 110.449 -177.519 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.9 mptt . . . . . 0 CA--C 1.503 -0.854 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.645 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 80.9 m -64.23 150.62 45.52 Favored 'General case' 0 N--CA 1.431 -1.408 0 CA-C-N 114.621 -1.172 . . . . 0.0 112.885 -176.394 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 65.2 p -109.76 -174.1 2.41 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.116 -179.415 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.9 t -67.19 -30.05 69.89 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.673 0.273 . . . . 0.0 110.809 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.87 -49.03 79.11 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 120.751 0.31 . . . . 0.0 110.667 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 42.6 t -64.07 -38.81 92.42 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.151 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 26.6 mtp180 -80.55 18.54 0.92 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.3 m -106.06 159.83 15.77 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 173.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.447 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 19.4 mm-40 -120.09 115.77 32.95 Favored Pre-proline 0 C--N 1.321 -0.661 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.633 -179.577 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.447 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 72.9 Cg_endo -77.61 169.2 74.37 Favored 'Cis proline' 0 C--N 1.346 0.41 0 C-N-CA 123.115 -1.619 . . . . 0.0 111.033 -2.252 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 74.6 m -54.02 122.33 9.91 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.088 0.471 . . . . 0.0 110.646 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 32.3 mm-40 -88.89 16.78 6.39 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.987 -175.167 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.526 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 2.3 m -64.53 -29.73 70.76 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.953 178.343 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 62.97 -138.86 44.35 Favored Glycine 0 N--CA 1.444 -0.802 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.838 -179.082 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.6 m -98.86 12.01 37.05 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 121.028 0.442 . . . . 0.0 110.233 178.387 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -97.51 -53.18 3.52 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.64 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 0.1 OUTLIER 64.84 99.36 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.916 -1.038 . . . . 0.0 112.355 178.23 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -90.65 -14.3 32.57 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.666 -178.663 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.645 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 31.6 p -87.68 -175.1 5.06 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.029 0.443 . . . . 0.0 111.698 -177.078 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.23 -110.01 0.6 Allowed Glycine 0 N--CA 1.442 -0.915 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.43 179.437 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -160.77 0.0 0.06 Allowed 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -176.132 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -86.76 -6.96 79.17 Favored Glycine 0 C--N 1.301 -1.377 0 C-N-CA 121.077 -0.583 . . . . 0.0 113.719 -175.148 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.503 ' SG ' ' HE2' ' A' ' 37' ' ' LYS . 3.8 p -75.71 -29.67 59.03 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 120.837 0.351 . . . . 0.0 110.917 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 63.6 p 50.06 42.12 24.4 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.492 0.717 . . . . 0.0 112.251 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.429 ' SG ' ' HB2' ' A' ' 31' ' ' CYS . 58.3 m -66.62 177.31 1.62 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.881 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -111.7 -0.27 16.07 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 121.243 0.544 . . . . 0.0 110.222 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.49 -67.23 0.88 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.569 -178.407 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.64 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 7.9 p -85.05 -13.45 50.37 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.222 0.534 . . . . 0.0 110.942 179.528 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.542 ' NZ ' ' SG ' ' A' ' 27' ' ' CYS . 11.2 mptt -105.71 45.19 0.98 Allowed 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 121.585 0.707 . . . . 0.0 110.982 178.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 8.8 t -91.31 128.44 37.14 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.595 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.9 t -92.27 135.28 34.14 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -89.06 -6.57 57.02 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-O 121.143 0.497 . . . . 0.0 110.704 -178.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.535 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 36.8 m -81.43 133.24 35.38 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.658 178.556 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 74.9 p -109.42 170.73 7.87 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.161 -177.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.9 m -71.75 -9.93 59.02 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.164 0.506 . . . . 0.0 110.403 178.249 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -80.43 -40.36 26.49 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.968 178.252 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -169.18 139.39 5.6 Favored Glycine 0 N--CA 1.437 -1.287 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.767 -179.456 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 19.1 t -79.97 129.75 34.74 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 120.702 0.287 . . . . 0.0 110.431 179.517 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -87.99 -39.7 14.48 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.331 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.481 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 16.6 p -78.01 -33.13 51.33 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 119.97 -0.692 . . . . 0.0 110.264 -178.313 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 104.72 0.22 42.55 Favored Glycine 0 N--CA 1.438 -1.192 0 C-N-CA 120.79 -0.719 . . . . 0.0 113.262 177.46 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.481 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 28.5 mmtp -82.4 -1.69 50.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 117.15 0.475 . . . . 0.0 110.991 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 68.88 23.07 6.91 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.44 176.197 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.405 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 1.8 p -70.74 -47.2 60.93 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.919 177.843 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 47.6 p 51.43 31.63 7.58 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.876 0.87 . . . . 0.0 112.864 177.379 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 159.16 145.84 4.37 Favored Glycine 0 N--CA 1.436 -1.343 0 C-N-CA 120.534 -0.841 . . . . 0.0 111.897 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.56 -30.87 51.53 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.903 2.402 . . . . 0.0 113.302 -177.308 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -76.16 -17.67 59.45 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.287 0.565 . . . . 0.0 110.485 -178.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.8 m -117.17 18.52 14.51 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.095 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.405 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 0.5 OUTLIER -73.11 130.26 39.89 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.645 -178.523 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -113.65 6.4 16.9 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.616 -177.905 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -122.9 159.07 29.0 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.754 -177.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -77.33 -164.82 22.88 Favored Glycine 0 C--N 1.332 0.327 0 CA-C-N 115.983 -0.553 . . . . 0.0 113.761 -177.574 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.474 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 4.0 m -85.7 -10.39 55.73 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 122.923 0.489 . . . . 0.0 111.753 -176.644 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.0 m -89.2 13.08 14.12 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.147 0.499 . . . . 0.0 110.353 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 11.5 t -90.68 170.06 10.46 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.355 -178.74 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.9 p -76.31 -16.18 59.83 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -176.837 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.546 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 21.6 p -87.15 2.66 49.2 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.988 0.423 . . . . 0.0 110.723 178.497 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.546 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 11.3 mmtp . . . . . 0 C--O 1.265 1.884 0 CA-C-O 117.686 -1.15 . . . . 0.0 110.91 -176.452 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt . . . . . 0 C--O 1.233 0.223 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.699 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 93.6 m -82.09 143.66 31.33 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-O 121.191 0.52 . . . . 0.0 111.522 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 67.1 p -93.52 -179.28 4.98 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.348 -179.526 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.9 m -66.38 -21.39 66.23 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.959 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.57 -45.95 67.5 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-O 120.829 0.347 . . . . 0.0 111.042 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.448 ' HB2' ' HB3' ' A' ' 27' ' ' CYS . 22.6 t -68.1 -31.49 71.13 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.233 0.539 . . . . 0.0 110.226 -179.499 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 31.5 mmt180 -90.57 9.57 28.97 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.007 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.1 t -83.76 169.55 15.1 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.459 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 33.5 mm-40 -119.34 105.69 43.85 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.713 -0.222 . . . . 0.0 111.083 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.459 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 1.6 Cg_endo -83.85 -173.33 10.72 Favored 'Cis proline' 0 N--CA 1.456 -0.685 0 C-N-CA 123.888 -1.297 . . . . 0.0 111.314 -1.769 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 15.1 t -56.42 123.3 14.25 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.015 0.436 . . . . 0.0 110.54 -178.365 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -108.75 20.59 18.31 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.717 -176.349 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.67 -35.74 77.01 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 120.78 0.324 . . . . 0.0 111.205 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.26 -169.97 54.67 Favored Glycine 0 N--CA 1.44 -1.049 0 C-N-CA 121.131 -0.557 . . . . 0.0 112.83 178.191 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 24.5 m -77.53 -11.82 59.9 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.688 0.28 . . . . 0.0 111.301 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -86.55 -31.74 21.07 Favored 'General case' 0 CA--C 1.507 -0.688 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.0 t 66.54 105.83 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.805 -176.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -110.4 28.49 8.59 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.818 -173.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.613 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 9.1 p -124.25 -164.81 1.29 Allowed 'General case' 0 C--N 1.312 -1.062 0 CA-C-O 120.665 0.269 . . . . 0.0 110.555 178.956 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -114.25 153.95 17.28 Favored Glycine 0 N--CA 1.442 -0.91 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -79.09 84.07 5.11 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.489 0.662 . . . . 0.0 111.269 -176.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -168.82 23.89 0.1 Allowed Glycine 0 C--N 1.301 -1.373 0 N-CA-C 110.634 -0.986 . . . . 0.0 110.634 177.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.72 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 28.6 p -112.95 -21.29 11.19 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.682 -0.259 . . . . 0.0 111.572 -177.889 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 38.4 p 49.08 39.14 14.39 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.464 0.649 . . . . 0.0 109.951 -173.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.72 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 1.8 t -66.73 149.91 49.85 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.555 -176.81 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -104.52 22.61 14.67 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.148 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -126.17 -58.17 1.37 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.069 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 7.8 p -83.74 -44.45 14.42 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.318 0.58 . . . . 0.0 110.034 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -86.24 82.79 7.9 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.148 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.445 ' O ' ' HD3' ' A' ' 67' ' ' LYS . 14.1 t -142.88 174.28 10.8 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.83 -179.412 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.508 ' SG ' ' HB2' ' A' ' 66' ' ' CYS . 48.7 t -114.01 145.19 41.9 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.1 0.476 . . . . 0.0 110.939 -178.47 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -102.26 -4.79 25.14 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.87 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.622 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 61.7 m -77.98 151.07 33.81 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.798 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 63.2 p -121.23 169.47 10.53 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.453 -178.38 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.49 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 14.4 m -68.97 -27.07 65.39 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.172 0.51 . . . . 0.0 110.574 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -81.17 -34.4 32.4 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.28 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -153.84 131.86 3.38 Favored Glycine 0 N--CA 1.436 -1.304 0 C-N-CA 120.323 -0.942 . . . . 0.0 112.511 -177.184 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 4.4 t -86.27 135.86 33.38 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -93.47 -28.02 16.35 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -176.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 21.7 p -92.97 -30.68 15.23 Favored 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.829 -178.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.5 9.6 52.65 Favored Glycine 0 N--CA 1.444 -0.831 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.883 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -90.64 -4.6 56.68 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.956 0.407 . . . . 0.0 110.303 178.228 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 65.67 26.55 11.46 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.213 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.629 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 4.4 p -66.82 -46.94 73.59 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 176.446 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.49 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 52.0 p 50.78 72.79 0.32 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 114.915 -1.038 . . . . 0.0 113.184 176.051 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 111.96 140.26 8.0 Favored Glycine 0 N--CA 1.444 -0.816 0 C-N-CA 120.713 -0.756 . . . . 0.0 111.876 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.71 -29.61 86.2 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.103 2.536 . . . . 0.0 112.846 -177.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -64.16 -39.23 93.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.979 0.419 . . . . 0.0 111.229 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.6 t -106.16 17.34 23.66 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.288 0.565 . . . . 0.0 109.941 -179.348 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.629 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 19.3 t -86.64 111.01 20.24 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.124 -178.481 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -106.3 -2.5 22.24 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.716 -177.14 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.9 m -71.72 154.63 41.21 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.636 -179.206 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLY . . . . . 0.537 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -74.53 -179.56 41.92 Favored Glycine 0 N--CA 1.443 -0.875 0 C-N-CA 120.477 -0.868 . . . . 0.0 111.258 176.587 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.416 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 6.6 m -80.31 4.28 18.3 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.893 0.377 . . . . 0.0 111.88 -178.177 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.0 m -109.98 12.7 23.62 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.917 0.389 . . . . 0.0 110.587 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 22.2 t -86.59 166.88 15.06 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.559 -178.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.5 m -62.62 -26.52 68.66 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -177.808 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.622 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 6.1 p -81.18 -6.71 59.15 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.779 0.323 . . . . 0.0 111.8 -178.741 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.537 ' HG3' ' O ' ' A' ' 61' ' ' GLY . 13.2 mmtp . . . . . 0 C--O 1.261 1.659 0 CA-C-O 117.955 -1.021 . . . . 0.0 111.326 -177.11 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? . . . . . 0 CA--C 1.514 -0.416 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.59 ' SG ' ' HB2' ' A' ' 27' ' ' CYS . 88.5 m -57.82 139.81 53.23 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.481 -0.782 . . . . 0.0 111.217 178.721 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.8 p -80.69 174.22 11.83 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.793 -178.489 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.8 p -61.84 -28.55 69.57 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.126 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.85 -43.45 75.44 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.547 179.179 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.732 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 18.3 t -69.97 -36.33 75.14 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.033 -178.213 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.9 ttt180 -79.84 -9.24 59.64 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.437 -177.664 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.9 t -80.16 161.86 25.02 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.173 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.553 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 9.4 pt-20 -136.31 123.77 14.58 Favored Pre-proline 0 C--N 1.316 -0.886 0 CA-C-O 120.784 0.326 . . . . 0.0 111.437 -179.408 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.553 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 40.6 Cg_endo -64.36 157.9 71.89 Favored 'Cis proline' 0 C--N 1.348 0.525 0 C-N-CA 123.158 -1.601 . . . . 0.0 112.038 0.889 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.664 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 44.4 t -60.9 130.36 46.06 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.948 -177.578 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 78.3 mm-40 -101.94 13.75 33.9 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.897 -177.207 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.732 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -70.45 -16.49 62.94 Favored 'General case' 0 C--O 1.209 -1.043 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.057 -179.314 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.79 -30.26 56.3 Favored Glycine 0 CA--C 1.525 0.664 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.69 -179.243 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 53.1 p -64.64 -48.5 74.61 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -130.49 -46.18 1.08 Allowed 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 120.664 0.269 . . . . 0.0 111.384 -178.104 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.625 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 8.3 t 64.06 82.29 0.19 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.362 -179.713 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -117.51 20.07 13.7 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.491 -177.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.59 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 24.5 p -75.46 163.06 27.79 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.042 178.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -103.12 25.25 27.85 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.183 -1.008 . . . . 0.0 111.549 177.88 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.411 ' CD ' ' H ' ' A' ' 30' ' ' GLY . 0.0 OUTLIER 66.14 -175.19 0.19 Allowed 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.337 0.655 . . . . 0.0 110.444 -177.676 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.411 ' H ' ' CD ' ' A' ' 29' ' ' GLU . . . 87.28 10.29 71.44 Favored Glycine 0 N--CA 1.434 -1.442 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 -176.371 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.579 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 7.3 p -100.49 -26.45 13.85 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 114.651 -0.775 . . . . 0.0 109.685 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 46.6 p 53.06 36.43 22.18 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.945 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 62.6 m -66.14 167.34 10.22 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.701 179.535 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -117.91 11.87 13.59 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.316 -0.857 . . . . 0.0 108.841 176.48 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.404 ' HB3' ' HB3' ' A' ' 19' ' ' CYS . . . -110.68 -67.74 0.97 Allowed 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.467 -178.442 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.65 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 28.2 p -77.91 -44.62 26.43 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-O 121.368 0.604 . . . . 0.0 109.443 178.677 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.4 ' O ' ' HB ' ' A' ' 38' ' ' THR . 58.4 tttp -84.17 108.64 17.19 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.098 178.301 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.4 ' HB ' ' O ' ' A' ' 37' ' ' LYS . 10.0 t -179.26 164.16 1.34 Allowed 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 178.739 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.6 t -96.21 143.69 27.08 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.001 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -103.17 5.44 37.78 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.892 0.377 . . . . 0.0 111.48 -177.091 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.468 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 60.9 m -85.61 146.7 26.75 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.014 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 60.2 p -120.66 161.52 21.24 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.489 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 35.4 m -63.03 -27.76 69.63 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.091 0.472 . . . . 0.0 110.413 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.93 -36.01 79.42 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.952 178.433 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -164.01 128.98 1.91 Allowed Glycine 0 N--CA 1.437 -1.27 0 C-N-CA 120.351 -0.928 . . . . 0.0 112.73 -179.038 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 6.8 t -79.18 124.41 28.32 Favored 'General case' 0 N--CA 1.439 -1.005 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.519 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.468 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 33.4 mmtp -76.35 -42.82 43.48 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.719 -176.09 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 19.8 p -84.21 -38.3 20.76 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 120.901 0.381 . . . . 0.0 110.749 -177.261 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.12 3.44 27.88 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.819 -0.705 . . . . 0.0 113.107 179.287 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.645 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 73.5 mmtt -81.55 -3.9 54.52 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.981 0.391 . . . . 0.0 111.008 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 65.34 24.98 12.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.962 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.496 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.3 p -71.7 -47.63 52.75 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 176.806 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.489 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 82.5 p 51.94 28.92 5.56 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 115.135 -0.939 . . . . 0.0 113.472 175.511 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 164.09 140.77 2.95 Favored Glycine 0 N--CA 1.436 -1.325 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -56.36 -37.31 97.24 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.976 2.451 . . . . 0.0 113.532 -177.467 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -67.4 -40.88 85.66 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.848 0.356 . . . . 0.0 111.019 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 40.7 m -94.37 15.34 17.86 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.601 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.496 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 24.5 t -85.4 135.07 34.03 Favored 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.15 -179.082 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -113.15 -6.28 13.66 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.218 -179.21 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.645 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 13.9 m -77.52 157.51 30.36 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.836 -178.185 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -86.05 -108.99 0.76 Allowed Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.377 -179.024 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.2 m -135.16 -2.39 2.54 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 120.543 0.211 . . . . 0.0 111.414 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 18.6 m -106.27 5.11 29.47 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.941 0.401 . . . . 0.0 111.457 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 29.9 t -82.8 167.0 18.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.333 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.7 t -70.61 -16.33 62.83 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.798 -177.245 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.438 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 24.7 p -88.72 2.11 53.95 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.366 -0.533 . . . . 0.0 111.322 179.396 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 25.2 mmtp . . . . . 0 C--O 1.261 1.704 0 CA-C-O 117.67 -1.157 . . . . 0.0 110.866 -179.107 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt . . . . . 0 N--CA 1.468 0.468 0 CA-C-O 121.044 0.449 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.571 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 91.5 m -85.65 152.87 22.76 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-O 121.371 0.605 . . . . 0.0 111.838 -179.591 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 81.3 p -92.02 176.27 6.57 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.81 -177.379 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.9 m -67.16 -21.73 65.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.148 0.499 . . . . 0.0 110.079 178.449 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.0 -47.56 36.26 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.32 178.712 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.649 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 10.2 t -66.44 -33.56 75.97 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.382 0.611 . . . . 0.0 109.667 179.478 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.7 mmt180 -91.22 21.27 4.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.844 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.6 t -94.45 -178.55 4.61 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 178.517 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.435 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 7.0 pt-20 -131.09 101.93 16.18 Favored Pre-proline 0 CA--C 1.543 0.687 0 CA-C-O 120.709 0.29 . . . . 0.0 111.292 -178.448 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.435 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 87.9 Cg_endo -81.41 -174.94 14.79 Favored 'Cis proline' 0 N--CA 1.461 -0.416 0 C-N-CA 123.625 -1.406 . . . . 0.0 111.072 -0.946 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.731 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 48.6 t -59.49 127.9 34.35 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.038 0.447 . . . . 0.0 110.829 -179.653 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -112.04 17.62 19.46 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 -179.344 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.731 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 0.5 OUTLIER -64.86 -23.15 67.15 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.348 -177.341 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.71 -12.04 9.18 Favored Glycine 0 CA--C 1.528 0.883 0 C-N-CA 121.303 -0.475 . . . . 0.0 113.723 -177.712 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.4 m -68.6 -35.58 77.53 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 122.727 -0.278 . . . . 0.0 110.992 179.078 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 69.3 mttm -146.19 -43.28 0.2 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 122.899 0.48 . . . . 0.0 110.323 178.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.666 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 10.5 t 67.24 74.12 0.32 Allowed 'General case' 0 CA--C 1.504 -0.8 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.051 -179.133 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -104.82 10.55 34.44 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 114.572 -1.195 . . . . 0.0 110.84 -175.327 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.552 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 21.0 p -75.75 -178.71 4.36 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.155 0.502 . . . . 0.0 111.072 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.92 -141.36 10.57 Favored Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 115.789 -0.642 . . . . 0.0 111.915 177.382 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.461 ' HA ' ' HE2' ' A' ' 37' ' ' LYS . 8.2 mp0 -123.77 13.65 9.28 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.168 0.508 . . . . 0.0 110.734 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -84.48 -30.79 26.43 Favored Glycine 0 C--N 1.306 -1.112 0 C-N-CA 120.819 -0.705 . . . . 0.0 113.183 -177.573 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.795 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 20.3 p -67.96 -34.13 75.97 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -176.288 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 58.9 p 53.1 33.7 15.64 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.8 0.809 . . . . 0.0 109.994 -173.237 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.795 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -62.56 117.04 5.68 Favored 'General case' 0 C--O 1.222 -0.365 0 CA-C-N 114.276 -1.329 . . . . 0.0 110.37 -178.655 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -86.11 20.25 2.37 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.385 0.612 . . . . 0.0 110.831 -177.628 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -109.42 -48.92 3.17 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.029 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.63 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 26.2 p -94.24 -41.5 9.44 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.569 177.673 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.589 ' HG3' ' SG ' ' A' ' 36' ' ' CYS . 26.3 mtpp -99.26 88.86 4.03 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.837 -178.508 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 12.3 t -144.83 172.2 13.35 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.738 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.481 ' HA ' ' O ' ' A' ' 66' ' ' CYS . 35.8 t -92.17 133.9 35.36 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -83.9 -17.7 39.89 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.155 0.502 . . . . 0.0 110.224 -177.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.431 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 37.4 m -69.57 136.34 51.17 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.001 -176.294 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 82.3 p -99.64 166.26 11.21 Favored 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 178.106 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.484 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 46.9 m -64.03 -26.79 68.72 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.922 0.392 . . . . 0.0 111.8 -178.858 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -88.47 -30.7 19.2 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.717 -179.531 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -143.34 119.29 1.32 Allowed Glycine 0 N--CA 1.445 -0.753 0 C-N-CA 119.784 -1.198 . . . . 0.0 113.697 -175.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.412 ' HA ' ' HB3' ' A' ' 41' ' ' CYS . 17.5 t -78.07 126.99 31.62 Favored 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 177.419 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.431 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 3.2 mmmp? -82.05 -36.57 27.56 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -176.696 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.508 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 21.5 p -91.95 -37.93 12.56 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.897 -177.474 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.2 11.36 13.74 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 120.739 -0.743 . . . . 0.0 113.816 178.505 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.755 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 32.4 mmtp -88.23 -3.2 58.9 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 117.331 0.565 . . . . 0.0 110.985 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 65.61 17.49 10.92 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.139 -177.738 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.56 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.2 p -64.57 -47.29 79.26 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 177.698 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.484 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 53.2 p 49.88 44.54 25.23 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.189 -0.914 . . . . 0.0 113.063 174.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.435 ' O ' ' HB2' ' A' ' 58' ' ' CYS . . . 135.1 150.28 6.02 Favored Glycine 0 N--CA 1.438 -1.206 0 C-N-CA 120.624 -0.798 . . . . 0.0 111.587 179.738 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -61.81 -22.53 74.56 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.845 2.363 . . . . 0.0 112.559 -177.836 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -63.12 -52.56 62.07 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.645 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.1 m -104.12 20.73 17.74 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.788 -177.602 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.56 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 48.8 t -86.91 137.58 32.26 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-O 121.213 0.53 . . . . 0.0 111.229 -178.499 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -118.67 3.26 11.71 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.569 -179.069 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.755 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 5.5 m -91.15 117.43 29.61 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 -179.664 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -97.56 82.4 0.69 Allowed Glycine 0 C--N 1.303 -1.257 0 CA-C-N 115.517 -0.765 . . . . 0.0 112.578 -175.006 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.448 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 50.8 m 63.77 170.28 0.16 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.016 0.526 . . . . 0.0 111.386 -178.429 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.4 m 70.87 -25.16 0.17 Allowed 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 176.554 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 38.0 t -72.05 167.73 19.58 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 121.919 -0.488 . . . . 0.0 111.288 -176.255 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 32.3 t -62.59 -27.44 69.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.592 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.481 ' O ' ' HA ' ' A' ' 39' ' ' CYS . 32.1 p -85.87 8.44 20.16 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.018 179.56 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.448 ' HD2' ' H ' ' A' ' 62' ' ' SER . 1.0 OUTLIER . . . . . 0 C--O 1.262 1.727 0 CA-C-O 118.037 -0.982 . . . . 0.0 111.064 -178.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt . . . . . 0 CA--C 1.519 -0.246 0 CA-C-O 120.963 0.411 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.807 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 57.4 m -88.49 145.04 25.98 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-O 121.298 0.57 . . . . 0.0 112.27 -176.367 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.3 p -77.16 176.05 9.09 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.775 -178.15 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.8 m -62.45 -32.8 73.73 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.135 178.49 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.9 -52.22 64.97 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.271 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.669 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 43.5 t -67.15 -28.67 68.31 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.571 0.7 . . . . 0.0 110.81 -179.366 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.1 ttm180 -79.66 -5.13 54.49 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.371 -177.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.9 m -85.44 167.48 15.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.086 0.47 . . . . 0.0 111.924 -177.856 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.441 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 76.6 mm-40 -127.59 108.72 20.78 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.683 177.442 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.441 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 73.2 Cg_endo -76.15 169.67 73.86 Favored 'Cis proline' 0 C--O 1.237 0.458 0 C-N-CA 123.457 -1.476 . . . . 0.0 112.157 0.055 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.669 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 41.7 t -61.03 140.36 57.86 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.004 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 -117.28 19.81 13.95 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.296 -177.121 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.614 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.1 OUTLIER -67.46 -31.25 71.29 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.981 0.419 . . . . 0.0 109.922 179.899 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 72.58 -168.03 53.18 Favored Glycine 0 N--CA 1.442 -0.924 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.633 178.828 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.8 p -80.22 -11.98 59.68 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.825 0.345 . . . . 0.0 110.675 178.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -77.51 -42.08 36.92 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 178.336 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 8.7 t 65.53 99.22 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.516 -1.22 . . . . 0.0 111.296 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -100.83 -0.8 36.32 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.375 -0.829 . . . . 0.0 112.513 -176.085 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.594 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 7.3 p -91.94 164.13 13.76 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 120.837 0.351 . . . . 0.0 111.677 -176.408 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -86.21 148.33 22.17 Favored Glycine 0 N--CA 1.441 -1.014 0 N-CA-C 109.101 -1.6 . . . . 0.0 109.101 172.666 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -77.72 89.57 3.99 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 117.769 0.785 . . . . 0.0 112.163 -174.035 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -158.17 25.25 0.4 Allowed Glycine 0 N--CA 1.435 -1.383 0 N-CA-C 110.022 -1.231 . . . . 0.0 110.022 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.807 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 26.2 p -115.12 -28.73 6.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.143 -0.528 . . . . 0.0 112.121 -175.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 57.4 p 54.27 29.07 10.07 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.4 0.619 . . . . 0.0 110.015 -171.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.606 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 2.1 t -57.64 140.25 51.62 Favored 'General case' 0 C--N 1.346 0.453 0 CA-C-N 114.744 -1.116 . . . . 0.0 110.273 -177.744 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -93.8 16.8 13.24 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 120.922 0.391 . . . . 0.0 111.171 -176.592 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -116.53 -57.02 2.23 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.561 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.614 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 6.1 p -89.41 -43.15 11.08 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.717 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -84.39 74.21 10.39 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 121.683 0.754 . . . . 0.0 109.825 178.097 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.9 t -125.77 149.74 48.32 Favored 'General case' 0 N--CA 1.431 -1.412 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.988 -179.24 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.1 t -100.58 128.99 46.46 Favored 'General case' 0 N--CA 1.442 -0.869 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 177.862 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -90.99 -1.52 57.81 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.487 -178.471 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.566 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 61.6 m -75.93 136.68 40.07 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.637 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 61.0 p -102.74 165.01 11.3 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.091 -178.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.1 m -71.23 -10.35 59.61 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.182 0.515 . . . . 0.0 110.356 177.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -89.86 -32.31 16.95 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.745 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -164.71 132.82 2.79 Favored Glycine 0 N--CA 1.435 -1.399 0 C-N-CA 120.796 -0.716 . . . . 0.0 111.991 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 4.7 t -72.73 136.37 45.51 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 179.383 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.44 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 75.8 mmtt -95.97 -22.35 17.45 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 111.938 0.348 . . . . 0.0 111.938 -176.13 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.479 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 21.8 p -99.69 -39.97 8.0 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.499 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.65 3.62 25.24 Favored Glycine 0 N--CA 1.437 -1.258 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.948 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.479 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 46.3 mmtm -81.37 -6.04 58.5 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 120.964 0.411 . . . . 0.0 110.251 178.318 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 68.94 20.91 7.71 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.664 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.525 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 4.7 p -71.2 -41.57 70.11 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.418 178.756 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.1 p 52.93 29.48 7.89 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.857 0.863 . . . . 0.0 113.297 177.609 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 149.32 159.18 8.46 Favored Glycine 0 N--CA 1.44 -1.1 0 C-N-CA 119.887 -1.149 . . . . 0.0 112.838 178.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.429 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 58.0 Cg_endo -69.64 -11.95 32.09 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 123.113 2.542 . . . . 0.0 112.779 -178.229 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -84.08 -10.07 58.11 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.029 0.442 . . . . 0.0 110.835 -178.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.8 m -142.58 26.36 1.77 Allowed 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.146 0.498 . . . . 0.0 110.112 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.525 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 0.5 OUTLIER -71.11 122.76 20.69 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.998 -177.919 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -100.05 4.28 44.59 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.936 -178.334 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.445 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.2 p -137.91 157.45 46.38 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.05 -174.353 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -150.15 171.89 30.05 Favored Glycine 0 N--CA 1.439 -1.101 0 C-N-CA 120.022 -1.085 . . . . 0.0 113.563 -178.472 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.5 m 63.53 -84.79 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 124.489 1.116 . . . . 0.0 113.855 177.742 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.2 m -117.4 66.33 0.73 Allowed 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -174.355 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 41.3 t -112.84 166.61 11.22 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 173.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.447 ' HB2' ' HA ' ' A' ' 48' ' ' CYS . 7.4 m -64.61 -9.39 19.05 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 122.719 0.407 . . . . 0.0 112.028 -177.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.566 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 25.0 p -104.62 -11.02 17.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.722 0.296 . . . . 0.0 111.227 177.879 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.5 mmpp? . . . . . 0 C--O 1.251 1.164 0 CA-C-O 117.317 -1.325 . . . . 0.0 110.156 -178.9 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 42.7 mtmt . . . . . 0 CA--C 1.515 -0.4 0 CA-C-O 121.251 0.548 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.477 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 85.6 m -98.68 130.91 45.19 Favored 'General case' 0 C--N 1.301 -1.503 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.003 178.065 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.6 p -76.35 178.09 6.79 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.085 0.469 . . . . 0.0 111.871 -176.252 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.517 ' HA ' ' HG2' ' A' ' 15' ' ' ARG . 16.6 m -57.37 -33.23 67.58 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.143 -179.867 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.5 -44.86 81.44 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.331 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.405 ' HB3' ' HB3' ' A' ' 10' ' ' CYS . 37.4 t -69.97 -34.49 73.46 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.096 0.474 . . . . 0.0 111.208 -177.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.517 ' HG2' ' HA ' ' A' ' 12' ' ' SER . 9.2 ptm85 -78.36 -6.81 56.24 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.519 -0.472 . . . . 0.0 111.475 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.3 m -79.5 153.43 29.58 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 179.41 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -126.41 119.75 23.29 Favored Pre-proline 0 C--N 1.312 -1.028 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.295 179.393 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -69.61 160.89 86.83 Favored 'Cis proline' 0 C--O 1.243 0.748 0 C-N-CA 123.438 -1.484 . . . . 0.0 111.966 -0.8 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -51.82 130.78 29.77 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.935 -177.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -105.52 8.7 33.49 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.602 -177.229 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.418 ' HB3' ' CB ' ' A' ' 36' ' ' CYS . 0.1 OUTLIER -62.02 -35.89 79.91 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.846 0.355 . . . . 0.0 110.635 179.944 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 62.12 -135.83 45.8 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.792 178.339 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.0 m -100.18 -6.75 25.66 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 120.648 0.261 . . . . 0.0 111.061 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -79.03 -45.3 20.47 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 178.263 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER 58.47 91.96 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.643 177.314 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -88.74 -12.96 40.74 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.908 -175.757 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.477 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 30.6 p -79.07 159.67 27.44 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.513 -0.475 . . . . 0.0 111.548 -177.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -87.45 -155.4 28.28 Favored Glycine 0 N--CA 1.448 -0.527 0 CA-C-N 115.913 -0.585 . . . . 0.0 112.673 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -83.21 157.89 22.53 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.962 0.411 . . . . 0.0 111.15 -178.347 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 94.38 9.58 58.96 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.386 178.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.455 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 17.1 t -97.35 -61.64 1.37 Allowed 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.805 -179.401 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 81.6 p 49.41 39.09 15.64 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.239 0.616 . . . . 0.0 111.661 -177.612 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.455 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -54.73 147.73 14.2 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.723 178.921 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -85.58 28.44 0.76 Allowed 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.616 0.722 . . . . 0.0 110.205 -178.374 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -140.51 -61.06 0.51 Allowed 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.457 -179.048 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.418 ' CB ' ' HB3' ' A' ' 21' ' ' CYS . 20.7 p -88.27 -40.41 13.66 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -177.785 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.1 ttmt -116.75 53.99 0.87 Allowed 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.281 0.562 . . . . 0.0 111.741 -172.908 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.473 ' O ' ' HD3' ' A' ' 67' ' ' LYS . 13.9 t -121.5 179.32 4.48 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.772 178.512 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.467 ' HA ' ' HZ2' ' A' ' 67' ' ' LYS . 35.1 t -93.52 156.89 16.48 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.2 0.524 . . . . 0.0 111.061 -178.578 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -117.33 0.18 12.16 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.481 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.456 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 69.1 m -80.6 149.48 29.87 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.118 179.289 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 68.0 p -118.87 168.52 10.69 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.346 -178.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.6 m -65.81 -25.73 67.36 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.221 0.534 . . . . 0.0 110.278 178.834 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -72.38 -36.24 68.67 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.361 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -166.65 135.47 3.69 Favored Glycine 0 N--CA 1.433 -1.535 0 C-N-CA 120.205 -0.997 . . . . 0.0 112.75 -178.716 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 5.1 t -77.6 124.64 28.19 Favored 'General case' 0 C--N 1.313 -1.02 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 177.749 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -84.35 -29.4 26.31 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -176.043 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.508 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 20.2 p -89.91 -39.88 12.74 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 120.191 -0.603 . . . . 0.0 110.273 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.99 0.34 30.14 Favored Glycine 0 N--CA 1.443 -0.877 0 C-N-CA 120.913 -0.66 . . . . 0.0 112.762 178.599 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.508 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 30.0 mmtp -81.31 -0.26 40.2 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.292 0.568 . . . . 0.0 110.188 179.43 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 64.41 36.57 8.86 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 114.647 -1.161 . . . . 0.0 112.131 176.166 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.487 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 0.8 OUTLIER -81.4 -46.61 14.38 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.088 176.271 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 48.2 p 52.94 34.65 17.28 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 177.197 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.484 ' O ' ' HB2' ' A' ' 58' ' ' CYS . . . 166.21 161.6 15.67 Favored Glycine 0 N--CA 1.425 -2.034 0 C-N-CA 120.339 -0.934 . . . . 0.0 111.653 178.341 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -75.55 -44.47 0.3 Allowed 'Trans proline' 0 N--CA 1.46 -0.451 0 C-N-CA 122.679 2.252 . . . . 0.0 112.683 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -77.38 -16.32 58.92 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.162 0.506 . . . . 0.0 110.553 -178.199 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 40.1 m -106.6 13.03 28.74 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.481 177.348 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.487 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 47.1 t -86.69 135.54 33.36 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.552 -179.277 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 32.0 mtmt -109.39 -7.85 15.15 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.04 -178.612 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 34.5 m -77.47 157.32 30.52 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.166 -177.831 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -90.59 -85.2 1.39 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.971 -0.633 . . . . 0.0 113.368 -178.168 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 54.3 p -147.42 -30.14 0.33 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -177.694 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 35.8 m -92.4 47.16 1.29 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.102 0.477 . . . . 0.0 111.637 -177.589 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 16.1 t -124.22 165.23 17.98 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 178.033 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 8.8 m -66.62 -19.7 65.83 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.885 -177.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.456 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 27.7 p -93.72 22.09 5.85 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.811 0.338 . . . . 0.0 111.03 -179.413 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.473 ' HD3' ' O ' ' A' ' 38' ' ' THR . 36.2 mmtm . . . . . 0 C--O 1.262 1.711 0 CA-C-O 117.285 -1.34 . . . . 0.0 110.598 -178.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp . . . . . 0 N--CA 1.455 -0.207 0 CA-C-O 120.797 0.332 . . . . 0.0 111.817 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.639 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 87.9 m -98.47 139.1 34.71 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 120.985 0.421 . . . . 0.0 111.722 179.414 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.2 p -89.66 -178.33 5.51 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.618 -179.382 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.3 m -64.33 -28.66 69.86 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.804 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.0 -44.86 91.38 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.882 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.557 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 48.9 t -77.21 -31.23 55.1 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.662 -179.747 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.658 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 1.8 mmp_? -74.25 -9.17 58.34 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.129 -0.487 . . . . 0.0 112.178 -179.839 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 52.7 m -88.23 159.28 18.2 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 177.076 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.434 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 43.3 mt-10 -126.54 119.13 22.98 Favored Pre-proline 0 C--N 1.309 -1.191 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.434 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 5.1 Cg_exo -77.09 -178.19 23.4 Favored 'Cis proline' 0 C--N 1.348 0.529 0 C-N-CA 123.191 -1.587 . . . . 0.0 112.126 1.518 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.5 m -65.57 139.62 58.46 Favored 'General case' 0 CA--C 1.503 -0.861 0 CA-C-O 121.535 0.683 . . . . 0.0 111.941 -178.298 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 -114.26 15.75 18.06 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.835 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.63 ' HB3' ' HA ' ' A' ' 25' ' ' CYS . 1.9 m -63.08 -31.53 72.69 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.843 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 72.17 -148.19 42.23 Favored Glycine 0 N--CA 1.438 -1.21 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.791 177.393 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.5 m -88.42 -18.53 28.14 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-O 120.922 0.391 . . . . 0.0 110.082 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -77.66 -48.19 17.39 Favored 'General case' 0 CA--C 1.499 -1.0 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.943 -179.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.63 ' HA ' ' HB3' ' A' ' 21' ' ' CYS . 1.3 t 72.42 98.17 0.07 Allowed 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 114.614 -1.175 . . . . 0.0 110.119 -176.773 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -80.69 -24.04 39.15 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.771 -1.104 . . . . 0.0 112.544 -175.563 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.639 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 18.6 p -79.28 156.23 28.17 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 119.929 -0.709 . . . . 0.0 110.477 -179.704 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -83.95 -66.77 1.47 Allowed Glycine 0 N--CA 1.433 -1.508 0 C-N-CA 120.215 -0.993 . . . . 0.0 111.442 179.315 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -169.88 168.16 8.87 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 -178.221 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 101.93 32.45 5.02 Favored Glycine 0 N--CA 1.441 -0.983 0 C-N-CA 120.579 -0.819 . . . . 0.0 113.557 177.261 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.412 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 30.1 p -139.72 -37.58 0.49 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 117.323 0.561 . . . . 0.0 111.767 178.093 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 46.3 p 49.65 46.43 23.74 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 121.226 0.536 . . . . 0.0 111.285 -178.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 68.4 m -63.98 168.66 4.99 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.781 -179.025 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.413 ' HA ' ' HB ' ' A' ' 38' ' ' THR . . . -102.82 16.81 25.49 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.443 177.58 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -124.85 -70.34 0.76 Allowed 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.698 -178.158 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.616 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 29.4 p -86.49 -38.65 17.05 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.222 0.534 . . . . 0.0 111.637 -178.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.08 41.03 1.54 Allowed 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.514 -173.857 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.413 ' HB ' ' HA ' ' A' ' 34' ' ' ALA . 7.8 t -114.67 163.27 15.68 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.488 -175.793 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 51.3 t -109.07 140.64 42.34 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 176.76 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -98.76 3.6 47.57 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 120.704 0.288 . . . . 0.0 111.498 -177.44 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.541 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 85.0 m -80.02 164.25 23.58 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-O 120.928 0.394 . . . . 0.0 110.954 178.751 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 29.7 p -131.22 162.47 29.9 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.516 -179.136 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.9 m -69.37 -22.18 63.75 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.948 0.404 . . . . 0.0 110.922 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -86.63 -2.24 58.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.388 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 169.65 128.52 1.02 Allowed Glycine 0 N--CA 1.44 -1.08 0 C-N-CA 120.301 -0.952 . . . . 0.0 112.529 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.8 t -78.59 128.08 33.02 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.541 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 32.1 mmmt -87.82 -30.5 20.17 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -175.117 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.449 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 19.6 p -88.79 -36.79 15.88 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.285 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 110.66 -0.51 29.06 Favored Glycine 0 N--CA 1.442 -0.923 0 C-N-CA 120.833 -0.699 . . . . 0.0 113.056 178.196 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.449 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 72.2 mmtt -80.24 -2.05 43.32 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 117.065 0.432 . . . . 0.0 110.907 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 67.88 21.93 8.85 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.131 177.731 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.518 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 3.0 p -72.54 -44.88 61.54 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.18 178.01 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 67.2 p 53.49 26.51 5.6 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.988 0.915 . . . . 0.0 113.114 176.526 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.46 ' O ' ' HB2' ' A' ' 58' ' ' CYS . . . 158.09 160.59 10.35 Favored Glycine 0 N--CA 1.439 -1.149 0 C-N-CA 120.76 -0.734 . . . . 0.0 111.335 -179.527 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.406 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 45.9 Cg_endo -69.04 -12.27 33.84 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.667 2.245 . . . . 0.0 113.533 -177.402 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -79.41 -50.73 10.36 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.864 0.364 . . . . 0.0 111.084 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 24.1 t -90.78 7.75 38.17 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 120.953 0.406 . . . . 0.0 110.1 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.518 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 4.5 t -70.13 109.49 4.63 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.82 179.719 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -110.28 1.42 18.56 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.452 -177.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.2 p -98.08 152.06 19.72 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.663 178.475 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLY . . . . . 0.45 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -67.31 -177.6 10.12 Favored Glycine 0 CA--C 1.523 0.554 0 CA-C-N 116.082 -0.508 . . . . 0.0 114.239 -175.851 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 20.1 m -82.14 6.22 17.18 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 123.074 0.55 . . . . 0.0 111.76 -177.429 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.9 m -107.52 11.3 28.88 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.961 0.41 . . . . 0.0 110.34 178.645 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' CYS . . . . . 0.486 ' SG ' ' N ' ' A' ' 65' ' ' SER . 53.4 t -84.38 173.93 10.51 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.954 -179.288 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.486 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 8.9 m -64.82 -31.85 73.27 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.426 -179.163 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.548 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 26.0 p -81.6 10.63 5.67 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-O 120.843 0.354 . . . . 0.0 111.233 -179.288 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.548 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 15.0 mmtp . . . . . 0 C--O 1.266 1.934 0 CA-C-O 117.88 -1.057 . . . . 0.0 110.828 -177.452 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LYS . . . . . 0.469 ' HB2' ' HA3' ' A' ' 28' ' ' GLY . 31.5 mmmt . . . . . 0 N--CA 1.471 0.602 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.604 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 91.5 m -77.08 130.93 38.05 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 121.288 0.566 . . . . 0.0 112.16 -178.7 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 35.8 p -87.19 177.57 7.14 Favored 'General case' 0 N--CA 1.431 -1.393 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.253 -179.616 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.5 m -58.98 -27.02 64.99 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.753 -179.52 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.34 -45.0 77.68 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 120.856 0.36 . . . . 0.0 110.814 178.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.644 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 5.4 t -78.07 -26.0 47.97 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.065 0.46 . . . . 0.0 110.534 -178.84 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 32.7 mmt180 -74.66 -17.88 60.62 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.052 179.076 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.3 t -62.6 159.64 15.57 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.61 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.456 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 37.5 mt-10 -132.32 107.07 13.38 Favored Pre-proline 0 C--N 1.308 -1.2 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.887 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.456 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 73.1 Cg_endo -74.18 170.96 69.41 Favored 'Cis proline' 0 C--O 1.243 0.732 0 C-N-CA 123.517 -1.451 . . . . 0.0 112.476 0.106 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.632 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 21.5 t -55.98 143.67 31.36 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.867 -178.688 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -120.79 15.24 11.77 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.468 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.644 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 0.5 OUTLIER -70.8 -4.01 21.81 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.054 0.454 . . . . 0.0 110.94 179.535 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.77 -15.37 73.6 Favored Glycine 0 CA--C 1.521 0.454 0 C-N-CA 121.158 -0.544 . . . . 0.0 112.583 178.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 t -73.18 -47.51 43.12 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.649 -0.324 . . . . 0.0 110.76 179.376 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -140.91 -43.57 0.39 Allowed 'General case' 0 C--O 1.237 0.43 0 CA-C-N 116.66 -0.245 . . . . 0.0 111.247 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 16.0 t 74.02 100.84 0.07 Allowed 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.99 0.806 . . . . 0.0 110.988 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -125.52 13.14 8.12 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.894 -177.709 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.604 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 15.1 p -84.11 -175.53 5.84 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.254 0.549 . . . . 0.0 110.858 -178.204 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.469 ' HA3' ' HB2' ' A' ' 9' ' ' LYS . . . -88.59 130.92 10.39 Favored Glycine 0 N--CA 1.425 -2.085 0 N-CA-C 109.431 -1.468 . . . . 0.0 109.431 173.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.0 18.82 0.08 Allowed 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -176.249 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLY . . . . . 0.442 ' H ' ' C ' ' A' ' 28' ' ' GLY . . . -110.63 11.13 30.33 Favored Glycine 0 N--CA 1.436 -1.356 0 N-CA-C 111.151 -0.78 . . . . 0.0 111.151 177.9 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.839 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 15.4 p -80.49 -15.44 56.72 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 120.644 0.259 . . . . 0.0 110.415 179.552 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 82.8 p 57.34 26.53 12.54 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.868 0.867 . . . . 0.0 111.627 -177.879 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.839 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 6.6 t -62.86 127.9 33.38 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.822 179.615 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -92.15 32.18 1.19 Allowed 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.393 -177.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -128.65 -50.71 1.26 Allowed 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.174 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.496 ' CB ' ' HB3' ' A' ' 21' ' ' CYS . 25.3 p -98.09 -39.56 8.85 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.112 179.649 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -84.55 115.57 22.67 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-O 121.107 0.479 . . . . 0.0 110.891 -179.254 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.0 t -177.76 -178.34 0.71 Allowed 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 178.569 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -98.23 135.05 40.42 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 109.524 -0.546 . . . . 0.0 109.524 177.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -86.71 -6.01 58.96 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.208 -178.573 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.434 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 59.9 m -80.63 135.18 36.0 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.769 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 71.5 p -105.87 172.68 6.67 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.618 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 34.0 p -75.12 -10.0 59.07 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.167 0.508 . . . . 0.0 110.197 178.018 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -76.36 -40.99 49.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.971 177.764 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -169.01 136.96 4.3 Favored Glycine 0 N--CA 1.431 -1.659 0 C-N-CA 120.887 -0.673 . . . . 0.0 111.824 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 17.8 t -69.32 128.18 35.68 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.0 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.434 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 10.8 mmpt? -82.23 -40.03 22.21 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 -177.345 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.514 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 19.2 p -86.99 -36.5 18.21 Favored 'General case' 0 C--N 1.318 -0.804 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.908 -177.877 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 106.72 15.16 17.57 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.185 178.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.514 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 74.4 mmtt -94.75 1.59 55.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.954 0.407 . . . . 0.0 110.54 178.294 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 62.4 33.38 16.33 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.09 178.757 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.586 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.4 p -82.6 -47.35 12.19 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.985 177.407 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.3 p 52.69 37.74 24.39 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.942 0.897 . . . . 0.0 113.131 176.614 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 141.56 157.31 7.12 Favored Glycine 0 N--CA 1.437 -1.284 0 C-N-CA 120.161 -1.019 . . . . 0.0 112.302 178.784 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -61.24 -27.07 83.02 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.874 2.383 . . . . 0.0 112.709 -178.413 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -62.19 -54.58 38.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.84 0.352 . . . . 0.0 111.219 -179.549 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.7 m -99.69 20.12 14.65 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.291 -178.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.586 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 4.5 t -74.32 105.55 5.54 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-O 121.059 0.457 . . . . 0.0 110.514 -179.169 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -83.33 -22.05 33.0 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.92 -177.679 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.2 p -93.02 133.38 36.22 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 120.678 -0.409 . . . . 0.0 109.987 179.182 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -120.71 114.97 2.77 Favored Glycine 0 N--CA 1.439 -1.143 0 C-N-CA 120.602 -0.808 . . . . 0.0 112.126 -175.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.437 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 63.7 m 64.13 163.89 0.13 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 122.941 0.497 . . . . 0.0 112.163 -179.57 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.5 m 66.88 -24.37 0.11 Allowed 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 174.469 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 37.9 t -73.41 163.72 27.66 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 118.273 0.488 . . . . 0.0 111.414 -177.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.0 p -66.21 -26.7 67.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.03 -0.532 . . . . 0.0 112.048 -178.223 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.43 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 30.4 p -81.08 0.39 36.24 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.71 178.808 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.437 ' HD2' ' H ' ' A' ' 62' ' ' SER . 5.2 mmpp? . . . . . 0 C--O 1.262 1.743 0 CA-C-O 118.249 -0.882 . . . . 0.0 110.494 -179.588 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 50.3 mtpt . . . . . 0 N--CA 1.454 -0.238 0 CA-C-O 121.319 0.58 . . . . 0.0 109.49 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.567 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 67.8 m -122.07 160.77 24.32 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.742 -177.064 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 20.9 p -85.63 174.06 9.69 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.222 -179.018 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.7 m -57.61 -36.78 72.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.337 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.92 -46.06 89.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.416 -179.808 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.488 ' HB3' ' HB3' ' A' ' 10' ' ' CYS . 26.4 t -68.96 -30.29 68.7 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.101 0.477 . . . . 0.0 110.005 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 28.5 mmm180 -78.35 -2.82 40.05 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.551 178.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.8 m -84.06 165.57 18.43 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.664 0.269 . . . . 0.0 110.766 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -133.2 116.63 14.36 Favored Pre-proline 0 C--N 1.318 -0.767 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.164 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -70.81 173.29 48.99 Favored 'Cis proline' 0 C--O 1.235 0.327 0 C-N-CA 123.153 -1.603 . . . . 0.0 112.253 0.327 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.7 t -57.23 116.55 3.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.362 -178.306 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -102.39 13.56 34.26 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.001 0.429 . . . . 0.0 111.108 -176.381 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.684 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 4.7 t -70.4 -20.36 62.94 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.595 -179.41 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 59.02 -152.62 32.18 Favored Glycine 0 C--N 1.343 0.964 0 CA-C-N 115.284 -0.871 . . . . 0.0 113.04 177.834 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 67.1 m -95.69 -3.58 45.78 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-O 120.658 0.266 . . . . 0.0 110.464 177.638 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -71.6 -44.25 64.77 Favored 'General case' 0 CA--C 1.495 -1.136 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 176.78 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.661 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 4.8 t 55.58 92.82 0.03 OUTLIER 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 114.415 -1.266 . . . . 0.0 112.625 174.648 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -102.88 3.61 36.75 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.352 -179.492 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.493 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 29.1 p -87.89 174.92 8.05 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.697 179.292 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -98.07 -102.97 2.26 Favored Glycine 0 N--CA 1.44 -1.093 0 C-N-CA 120.607 -0.806 . . . . 0.0 111.359 178.04 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -139.66 161.73 36.83 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.435 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.89 28.05 7.57 Favored Glycine 0 N--CA 1.436 -1.344 0 C-N-CA 120.353 -0.927 . . . . 0.0 112.928 178.206 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.567 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 15.0 p -115.63 -23.89 8.53 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 117.044 0.422 . . . . 0.0 110.225 177.831 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 38.6 p 51.49 36.05 15.89 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.59 0.756 . . . . 0.0 112.281 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 74.2 m -75.21 171.9 13.35 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 121.083 0.468 . . . . 0.0 110.904 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -135.4 9.5 3.44 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 175.393 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.32 -58.87 1.8 Allowed 'General case' 0 CA--C 1.507 -0.69 0 CA-C-N 114.801 -1.09 . . . . 0.0 109.943 -178.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.684 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 31.8 p -86.41 -47.36 9.39 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.937 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -95.38 92.07 6.53 Favored 'General case' 0 N--CA 1.424 -1.756 0 CA-C-N 114.754 -1.112 . . . . 0.0 109.549 177.216 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.8 t -137.36 162.18 34.28 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 13.1 t -107.31 133.28 52.09 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 120.932 0.396 . . . . 0.0 110.057 -179.328 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -89.95 -6.32 55.8 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.16 0.505 . . . . 0.0 110.38 -177.714 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 38.0 m -79.3 145.1 33.68 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.97 -177.439 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 64.9 p -115.09 170.0 8.69 Favored 'General case' 0 N--CA 1.438 -1.058 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 178.436 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.444 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 2.8 p -73.62 -11.01 60.29 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.06 0.457 . . . . 0.0 111.151 178.914 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -90.59 -33.05 16.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.838 179.198 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -158.45 127.25 1.84 Allowed Glycine 0 N--CA 1.434 -1.499 0 C-N-CA 120.348 -0.929 . . . . 0.0 112.364 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 6.7 t -76.09 134.72 39.96 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.078 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp -96.15 -16.53 21.45 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -175.059 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.412 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 32.1 p -103.1 -39.34 6.92 Favored 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.277 178.8 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.36 5.34 26.48 Favored Glycine 0 N--CA 1.438 -1.176 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.74 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.412 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 75.1 mmtt -84.74 -2.25 57.36 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 120.935 0.398 . . . . 0.0 110.455 178.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 63.68 24.11 13.77 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.052 0.941 . . . . 0.0 111.179 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.488 ' O ' ' HB2' ' A' ' 57' ' ' SER . 3.9 p -70.77 -43.65 68.32 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 178.397 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.444 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 64.3 p 51.26 39.9 24.93 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.808 0.843 . . . . 0.0 112.899 176.842 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 145.04 149.37 5.01 Favored Glycine 0 N--CA 1.439 -1.162 0 C-N-CA 120.255 -0.974 . . . . 0.0 112.071 179.085 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -61.98 -26.13 78.4 Favored 'Trans proline' 0 CA--C 1.532 0.395 0 C-N-CA 123.021 2.481 . . . . 0.0 112.758 -177.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -71.28 -24.04 62.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.398 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.488 ' HB2' ' O ' ' A' ' 52' ' ' CYS . 23.6 m -119.14 15.99 13.22 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.226 0.536 . . . . 0.0 110.04 179.322 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.432 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 13.3 t -83.44 106.07 14.9 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.734 -176.96 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -95.8 -13.32 24.16 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.224 -177.544 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.2 p -89.58 148.93 23.08 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.915 -179.219 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -79.52 -167.08 33.65 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.934 -0.651 . . . . 0.0 113.837 -175.773 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.462 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 16.1 m -73.31 -13.45 61.12 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 123.299 0.64 . . . . 0.0 111.792 -177.567 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 45.4 m -86.62 18.37 3.4 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.777 0.323 . . . . 0.0 111.158 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 13.0 t -100.06 172.19 7.35 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 178.442 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 25.2 m -81.43 -11.04 59.38 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -176.745 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.422 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 25.9 p -93.29 15.97 14.32 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.835 0.35 . . . . 0.0 110.789 179.373 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.462 ' HG3' ' HA ' ' A' ' 62' ' ' SER . 9.0 mmtp . . . . . 0 C--O 1.263 1.782 0 CA-C-O 118.006 -0.997 . . . . 0.0 111.117 -177.389 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt . . . . . 0 N--CA 1.463 0.211 0 CA-C-O 120.951 0.405 . . . . 0.0 111.423 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.544 ' HB3' ' HB3' ' A' ' 14' ' ' CYS . 57.3 m -79.58 148.74 31.62 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.336 178.857 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.1 t -85.5 171.3 11.87 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.058 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.6 m -53.54 -32.08 49.12 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 123.205 0.602 . . . . 0.0 111.194 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.8 -45.35 94.24 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.429 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.712 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 29.4 t -75.23 -24.81 57.75 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.446 0.641 . . . . 0.0 110.256 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 77.5 mtp180 -84.62 4.99 29.76 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.72 -178.768 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.8 m -106.73 162.75 13.5 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.685 0.278 . . . . 0.0 110.725 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -126.87 117.98 22.34 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.184 178.206 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -74.1 178.06 35.24 Favored 'Cis proline' 0 C--O 1.239 0.553 0 C-N-CA 123.144 -1.607 . . . . 0.0 112.155 0.702 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.443 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 21.1 t -69.9 136.53 50.74 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.76 -176.996 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -112.36 6.91 19.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.49 -177.274 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.712 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 4.8 m -75.11 -11.2 60.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.661 0.267 . . . . 0.0 111.636 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.81 69.11 2.69 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.979 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.3 t -174.3 -61.72 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -115.13 -46.45 2.9 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.872 -0.603 . . . . 0.0 109.666 177.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 21' ' ' CYS . 38.3 t 60.96 100.41 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.163 -0.926 . . . . 0.0 112.466 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -100.56 23.78 9.89 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.212 178.824 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -63.27 148.29 48.64 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.94 178.322 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.27 163.09 37.23 Favored Glycine 0 N--CA 1.433 -1.549 0 N-CA-C 109.759 -1.336 . . . . 0.0 109.759 172.815 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -70.97 114.36 8.94 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 117.247 0.523 . . . . 0.0 110.09 -177.985 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 132.92 24.54 0.72 Allowed Glycine 0 N--CA 1.436 -1.321 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.269 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.413 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 45.9 t -91.68 146.42 23.79 Favored 'General case' 0 N--CA 1.439 -0.975 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 178.52 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.7 p -123.44 30.67 6.19 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.314 -179.112 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.413 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 21.0 t -68.76 163.9 23.03 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.258 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -117.17 25.27 10.59 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.022 0.439 . . . . 0.0 110.246 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -127.6 -59.42 1.21 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.439 -178.409 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 7.1 p -86.45 -39.58 16.19 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.007 0.432 . . . . 0.0 111.022 -179.186 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.2 tmtp? -104.21 91.68 4.03 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.025 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.6 t -173.96 -175.83 1.11 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.936 -179.049 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 39.2 t -113.82 137.44 51.65 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.916 0.388 . . . . 0.0 110.327 178.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 32.1 m-80 -93.97 -0.29 55.65 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.87 -178.387 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.499 ' HB3' ' HA ' ' A' ' 53' ' ' THR . 81.7 m -78.7 156.5 28.92 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.124 0.487 . . . . 0.0 111.525 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.3 p -137.81 169.55 17.59 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.261 178.829 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.0 m -67.9 -18.19 64.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.223 0.535 . . . . 0.0 110.469 178.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -68.22 -37.27 80.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.489 177.668 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -175.0 133.24 2.4 Favored Glycine 0 N--CA 1.434 -1.474 0 C-N-CA 120.85 -0.69 . . . . 0.0 111.912 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 4.8 t -72.63 116.29 12.93 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 178.272 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -74.43 -33.59 62.99 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.583 -174.247 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.561 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 28.2 p -86.8 -43.82 12.21 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.054 -0.659 . . . . 0.0 110.073 179.822 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.81 4.8 26.07 Favored Glycine 0 N--CA 1.436 -1.309 0 CA-C-N 115.74 -0.664 . . . . 0.0 112.432 -179.324 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.561 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 46.1 mmtm -79.51 -5.36 54.68 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.249 0.547 . . . . 0.0 109.696 177.694 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 68.76 30.41 4.86 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 114.772 -1.104 . . . . 0.0 110.884 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.508 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 5.3 p -80.3 -39.45 28.73 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.288 177.441 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.499 ' HA ' ' HB3' ' A' ' 41' ' ' CYS . 39.0 p 51.97 33.42 11.74 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 177.254 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 145.77 150.45 5.21 Favored Glycine 0 N--CA 1.441 -1.033 0 C-N-CA 120.168 -1.015 . . . . 0.0 112.268 178.794 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -55.98 -28.04 66.91 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.307 2.671 . . . . 0.0 113.407 -178.578 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -66.89 -34.44 77.8 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.759 0.314 . . . . 0.0 111.625 -178.701 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.471 ' HB2' ' O ' ' A' ' 52' ' ' CYS . 19.2 m -111.97 13.15 20.79 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.286 0.565 . . . . 0.0 110.264 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.508 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 28.0 t -78.42 119.53 21.86 Favored 'General case' 0 N--CA 1.438 -1.04 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.842 -179.208 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -115.77 1.11 13.38 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.584 -178.141 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.484 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 0.6 OUTLIER -97.2 110.01 22.65 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 176.864 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -99.11 114.66 5.09 Favored Glycine 0 CA--C 1.491 -1.422 0 C-N-CA 120.993 -0.623 . . . . 0.0 112.639 -173.589 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.505 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 43.6 t 61.89 161.63 0.07 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.065 0.546 . . . . 0.0 111.424 -179.057 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 19.1 t 73.14 -32.77 0.25 Allowed 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 175.214 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 33.3 t -67.98 162.75 23.71 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 119.736 -0.786 . . . . 0.0 111.801 -176.703 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.4 t -68.75 -21.75 64.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.832 -177.38 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.412 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 29.3 p -86.24 0.31 54.06 Favored 'General case' 0 C--O 1.219 -0.52 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.976 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.505 ' HD2' ' H ' ' A' ' 62' ' ' SER . 0.1 OUTLIER . . . . . 0 C--O 1.261 1.671 0 CA-C-O 117.998 -1.001 . . . . 0.0 111.051 -179.029 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt . . . . . 0 CA--C 1.514 -0.426 0 CA-C-O 121.03 0.443 . . . . 0.0 110.026 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.537 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 6.0 m -95.82 164.7 12.63 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-O 121.892 0.853 . . . . 0.0 112.726 -179.558 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' THR . . . . . 0.492 HG21 ' HB2' ' A' ' 26' ' ' GLN . 1.4 t -100.85 161.21 13.75 Favored 'General case' 0 N--CA 1.43 -1.453 0 CA-C-N 114.26 -1.336 . . . . 0.0 108.672 176.176 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.0 t -58.4 -30.62 66.99 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.94 0.4 . . . . 0.0 110.477 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.83 -35.01 79.07 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.124 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 10.4 t -86.44 -30.23 22.22 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.329 -176.908 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 42.2 ttp180 -77.38 -8.09 57.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.049 0.452 . . . . 0.0 110.281 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.9 t -89.26 161.84 16.19 Favored 'General case' 0 N--CA 1.435 -1.205 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 177.411 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.46 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 45.0 mt-10 -128.53 129.14 23.56 Favored Pre-proline 0 C--N 1.307 -1.259 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 -179.161 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.46 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 56.0 Cg_endo -68.5 173.16 40.85 Favored 'Cis proline' 0 C--N 1.348 0.52 0 C-N-CA 123.55 -1.438 . . . . 0.0 113.099 1.802 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.0 t -62.69 115.73 4.57 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.957 -178.846 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -107.2 14.43 26.19 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.079 -177.537 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.642 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 4.5 t -68.47 -20.7 64.63 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 179.068 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 61.86 -154.04 40.33 Favored Glycine 0 C--N 1.339 0.713 0 CA-C-N 115.076 -0.965 . . . . 0.0 114.411 174.568 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.6 m -89.81 -10.22 46.26 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.343 -0.429 . . . . 0.0 110.194 179.475 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -76.0 -40.01 54.62 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 177.854 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.632 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 10.9 t 56.33 86.61 0.06 Allowed 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.61 176.721 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.492 ' HB2' HG21 ' A' ' 11' ' ' THR . 11.2 mm100 -89.74 -7.04 55.39 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.489 -177.79 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.537 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 14.6 p -85.19 162.17 19.31 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-O 121.089 0.471 . . . . 0.0 110.676 -179.812 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.83 -159.59 35.5 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.698 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.5 mp0 -78.69 168.91 19.06 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.817 0.342 . . . . 0.0 110.396 179.784 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 87.21 -0.99 86.18 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.659 178.779 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 32.0 t -84.55 -48.56 9.43 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 122.768 -0.254 . . . . 0.0 111.356 -179.357 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 60.4 p 53.0 43.31 31.9 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.587 0.755 . . . . 0.0 112.401 -179.383 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.92 165.12 20.64 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.424 178.181 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -113.35 11.14 18.5 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.29 0.567 . . . . 0.0 110.051 179.141 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -117.46 -64.43 1.3 Allowed 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.608 -179.501 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.642 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 25.5 p -74.43 -42.92 58.34 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-O 121.134 0.492 . . . . 0.0 109.701 178.337 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.456 ' NZ ' ' SG ' ' A' ' 27' ' ' CYS . 14.0 mptt -83.76 87.6 7.07 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.027 176.068 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.5 t -142.21 154.76 45.05 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.64 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.428 ' H ' ' HB3' ' A' ' 55' ' ' PRO . 44.2 t -89.07 136.16 33.17 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -92.22 -3.75 55.1 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.116 -178.207 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 62.3 m -77.98 141.47 38.93 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.502 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 62.8 p -102.76 164.84 11.4 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.965 -177.182 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.4 m -67.93 -31.59 71.45 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.919 0.39 . . . . 0.0 110.681 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -71.67 -34.11 69.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.986 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -163.69 136.52 4.3 Favored Glycine 0 N--CA 1.435 -1.422 0 C-N-CA 120.284 -0.96 . . . . 0.0 112.705 -178.54 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 37.2 t -73.0 147.81 44.8 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 177.808 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.44 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 8.3 mtpm? -112.05 -19.6 12.26 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -177.789 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.435 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 17.4 p -96.99 -37.71 10.07 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 119.993 -0.683 . . . . 0.0 110.793 -179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.66 0.43 17.88 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.618 -0.801 . . . . 0.0 113.306 178.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.799 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 73.9 mmtt -84.6 -9.17 58.54 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 117.078 0.439 . . . . 0.0 110.703 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 66.4 27.94 9.81 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.16 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.582 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 0.8 OUTLIER -71.16 -47.46 57.58 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.312 178.197 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.5 p 55.89 35.99 26.47 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.182 0.993 . . . . 0.0 113.332 176.733 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 150.46 149.52 5.05 Favored Glycine 0 C--O 1.218 -0.899 0 C-N-CA 120.012 -1.09 . . . . 0.0 112.252 178.699 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.493 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 50.5 Cg_endo -70.82 -23.24 26.21 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.875 2.383 . . . . 0.0 113.068 -178.451 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -82.68 -21.21 34.99 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.212 0.53 . . . . 0.0 109.878 -178.845 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.8 m -121.77 22.86 10.36 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.546 179.097 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.582 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 8.2 t -75.34 142.29 43.21 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.116 -177.508 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 45.1 mtpt -110.7 1.38 17.87 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.496 -176.552 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.799 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 4.7 m -101.17 143.88 30.73 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.798 -177.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -110.03 70.84 0.21 Allowed Glycine 0 CA--C 1.507 -0.45 0 N-CA-C 111.23 -0.748 . . . . 0.0 111.23 -178.621 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.6 t 60.59 -179.61 0.1 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.205 0.602 . . . . 0.0 110.323 -177.037 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.7 m 62.92 -0.28 0.61 Allowed 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 177.732 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 36.2 t -93.77 162.68 13.83 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.285 178.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 51.0 m -70.1 -12.02 61.3 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -177.26 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.661 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 24.8 p -86.91 0.34 55.2 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 120.027 -0.669 . . . . 0.0 110.531 177.024 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.661 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 23.5 mmtp . . . . . 0 C--O 1.25 1.123 0 CA-C-O 117.767 -1.111 . . . . 0.0 110.532 -179.552 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 60.8 mttm . . . . . 0 C--O 1.232 0.144 0 CA-C-O 121.082 0.468 . . . . 0.0 109.992 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.566 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 60.4 m -99.97 163.65 12.35 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.371 0.605 . . . . 0.0 112.603 -176.167 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.8 p -100.02 175.5 5.74 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.657 -178.453 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.4 m -62.16 -31.52 72.02 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.22 179.235 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.0 -44.07 81.3 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 120.919 0.39 . . . . 0.0 110.536 179.431 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 41.9 t -70.89 -43.07 69.13 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.93 -178.834 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.437 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 40.6 ttt180 -79.17 3.45 17.67 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.025 0.441 . . . . 0.0 111.307 -178.741 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.5 t -73.33 165.0 25.88 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 178.748 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.454 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 6.5 mm-40 -119.77 105.78 42.69 Favored Pre-proline 0 C--N 1.312 -1.05 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -179.121 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' PRO . . . . . 0.454 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 93.3 Cg_endo -82.45 -177.02 17.89 Favored 'Cis proline' 0 C--N 1.352 0.715 0 C-N-CA 124.026 -1.239 . . . . 0.0 111.939 -0.456 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 37.5 t -61.62 129.68 42.25 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 120.949 0.404 . . . . 0.0 111.179 -177.634 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 76.4 mm-40 -114.58 13.61 17.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.575 -178.811 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.629 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 1.8 t -68.68 -31.77 71.12 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -179.574 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 60.3 -162.4 18.94 Favored Glycine 0 C--N 1.34 0.759 0 CA-C-N 115.091 -0.959 . . . . 0.0 114.627 175.087 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.0 m -76.49 -7.23 54.71 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 120.97 0.414 . . . . 0.0 110.818 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -78.53 -45.02 22.89 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 177.399 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.528 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 5.0 t 59.99 95.25 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.877 176.465 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -102.56 2.03 35.68 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.668 -178.255 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.566 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 14.8 p -90.49 -158.69 0.56 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.202 0.525 . . . . 0.0 111.298 -178.318 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -140.86 157.18 25.79 Favored Glycine 0 N--CA 1.438 -1.204 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 177.761 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -59.71 93.99 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.517 0.675 . . . . 0.0 112.055 -177.863 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -165.53 6.44 0.06 OUTLIER Glycine 0 N--CA 1.434 -1.445 0 N-CA-C 110.574 -1.011 . . . . 0.0 110.574 179.003 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.491 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 31.7 p -120.22 178.2 4.73 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.03 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.3 p -129.09 33.21 4.61 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 121.306 0.574 . . . . 0.0 110.538 -178.517 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 83.4 m -63.35 146.83 52.71 Favored 'General case' 0 CA--C 1.506 -0.727 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -177.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.549 ' C ' ' HB ' ' A' ' 38' ' ' THR . . . -114.95 21.67 14.09 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-N 114.069 -1.423 . . . . 0.0 107.254 173.698 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -113.48 -63.28 1.47 Allowed 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.702 -1.135 . . . . 0.0 110.476 -178.828 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.629 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 29.2 p -89.19 -45.66 9.39 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 121.588 0.708 . . . . 0.0 109.845 179.044 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.415 ' HG3' ' OG ' ' A' ' 62' ' ' SER . 2.0 ttpm? -95.97 44.81 1.07 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.059 -178.255 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.549 ' HB ' ' C ' ' A' ' 34' ' ' ALA . 14.1 t -100.91 142.07 32.91 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.731 -178.867 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.5 t -80.53 137.17 36.4 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.655 178.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -106.54 7.28 30.73 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 120.919 0.39 . . . . 0.0 111.308 -178.372 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' CYS . . . . . 0.573 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 85.2 m -80.91 133.28 35.53 Favored 'General case' 0 N--CA 1.435 -1.188 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.181 178.791 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 55.8 p -88.61 156.34 19.1 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.583 -177.567 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.433 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 14.5 m -65.18 -29.73 70.58 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.645 0.736 . . . . 0.0 109.133 176.606 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -65.24 -42.77 93.01 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.696 -1.138 . . . . 0.0 110.744 178.741 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -159.88 135.77 4.26 Favored Glycine 0 N--CA 1.44 -1.083 0 C-N-CA 121.048 -0.596 . . . . 0.0 111.906 -178.229 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 12.7 t -71.89 147.98 46.55 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -108.02 -31.74 7.84 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -177.407 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.462 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 20.7 p -89.75 -39.03 13.41 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.136 -0.625 . . . . 0.0 111.416 -177.61 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 118.48 -5.13 14.98 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.495 -0.859 . . . . 0.0 112.885 -179.804 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.675 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 74.0 mmtt -76.22 -13.42 60.17 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 120.8 0.333 . . . . 0.0 110.604 179.171 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 71.3 28.07 3.05 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.704 -179.766 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' CYS . . . . . 0.534 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.8 p -74.33 -43.88 54.8 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.268 178.587 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.433 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 55.0 p 54.03 31.96 14.64 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.087 0.955 . . . . 0.0 113.106 177.574 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 144.01 154.77 6.22 Favored Glycine 0 N--CA 1.442 -0.922 0 C-N-CA 120.353 -0.927 . . . . 0.0 112.299 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -60.47 -28.46 86.76 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.02 2.48 . . . . 0.0 112.677 -177.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -63.05 -29.29 70.7 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.104 -178.666 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 13.6 t -126.48 22.75 6.98 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.471 -178.643 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' CYS . . . . . 0.534 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 17.8 t -82.71 137.0 34.57 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.078 0.466 . . . . 0.0 110.871 -178.798 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -117.31 10.54 13.74 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.157 -178.471 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.675 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 2.6 m -102.01 156.3 17.63 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.154 -176.028 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -85.58 -115.68 0.83 Allowed Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 121.002 -0.618 . . . . 0.0 112.8 -178.643 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' SER . . . . . 0.415 ' OG ' ' HG3' ' A' ' 37' ' ' LYS . 14.9 m -123.49 -13.46 7.56 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 120.832 0.349 . . . . 0.0 111.073 -177.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 58.3 m -107.33 24.24 13.17 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -177.744 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' CYS . . . . . 0.42 ' SG ' ' N ' ' A' ' 65' ' ' SER . 42.4 t -93.3 171.98 8.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 177.537 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.42 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 19.4 m -67.33 -23.01 65.58 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -177.985 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.573 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 20.6 p -90.9 4.65 51.31 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.794 -0.362 . . . . 0.0 111.647 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.416 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 22.1 mmtp . . . . . 0 C--O 1.26 1.626 0 CA-C-O 117.574 -1.203 . . . . 0.0 110.676 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.156 0 N-CA-C 112.345 -0.302 . . . . 0.0 112.345 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.7 m -60.22 118.04 5.9 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 122.314 0.246 . . . . 0.0 110.558 179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -67.14 90.02 0.17 Allowed Glycine 0 C--N 1.33 0.216 0 C-N-CA 121.226 -0.511 . . . . 0.0 112.773 -179.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 60.5 pttt -150.32 156.48 41.61 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -165.4 111.32 0.45 Allowed Glycine 0 N--CA 1.44 -1.092 0 C-N-CA 120.217 -0.992 . . . . 0.0 112.392 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.9 mttt -114.43 -179.9 3.76 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -81.36 69.15 3.33 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.655 -0.783 . . . . 0.0 111.848 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -80.57 95.46 6.53 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-O 121.066 0.46 . . . . 0.0 110.517 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -80.78 -17.83 49.6 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.479 178.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.559 ' SG ' ' HB2' ' A' ' 27' ' ' CYS . 76.4 m -85.34 150.46 24.73 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.093 -178.255 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.9 t -81.22 166.94 20.13 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.565 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.2 m -54.52 -39.09 67.28 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.589 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.69 -45.62 89.07 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.253 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.633 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 44.6 t -69.38 -34.08 74.01 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.226 0.536 . . . . 0.0 110.373 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 77.5 mtp180 -84.46 14.82 4.13 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.716 -0.675 . . . . 0.0 112.043 -178.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.6 m -100.99 164.39 11.84 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.557 0.218 . . . . 0.0 110.636 178.365 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.436 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 11.4 mp0 -121.49 110.85 33.62 Favored Pre-proline 0 C--N 1.327 -0.384 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 177.377 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.436 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 91.0 Cg_endo -78.23 172.12 63.14 Favored 'Cis proline' 0 C--O 1.237 0.47 0 C-N-CA 123.72 -1.367 . . . . 0.0 111.74 0.35 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.647 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 43.3 t -62.34 134.62 56.73 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 121.127 0.489 . . . . 0.0 110.571 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 9.9 mm100 -113.34 23.78 12.91 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.933 -178.092 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.68 ' SG ' ' HA ' ' A' ' 25' ' ' CYS . 0.7 OUTLIER -73.97 -25.7 60.08 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 -178.908 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 59.45 -145.06 45.22 Favored Glycine 0 N--CA 1.443 -0.889 0 CA-C-N 115.172 -0.922 . . . . 0.0 113.24 177.035 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -95.03 -9.9 32.45 Favored 'General case' 0 N--CA 1.438 -1.038 0 CA-C-O 120.92 0.39 . . . . 0.0 110.164 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.439 ' CE ' ' HA ' ' A' ' 24' ' ' LYS . 5.4 mmpt? -72.94 -42.05 63.83 Favored 'General case' 0 CA--C 1.511 -0.555 0 N-CA-C 109.244 -0.651 . . . . 0.0 109.244 178.338 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.68 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 2.6 t 53.83 79.42 0.13 Allowed 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.861 175.05 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -99.91 16.67 23.06 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.749 -178.037 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.559 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 23.9 p -87.63 -163.57 0.96 Allowed 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.48 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -111.83 153.04 17.54 Favored Glycine 0 N--CA 1.441 -0.998 0 C-N-CA 120.554 -0.832 . . . . 0.0 112.485 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -71.98 120.2 17.23 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 120.807 0.337 . . . . 0.0 110.324 178.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 135.79 -3.35 3.83 Favored Glycine 0 N--CA 1.441 -1.021 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.601 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.551 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 9.1 p -89.31 -31.92 17.6 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.698 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 42.9 p 50.87 38.81 20.97 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.229 0.611 . . . . 0.0 111.306 -176.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.551 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 6.9 t -59.72 136.12 57.9 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.011 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.01 23.52 0.7 Allowed 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -174.053 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -125.7 -50.8 1.6 Allowed 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.134 0.493 . . . . 0.0 110.117 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.613 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 3.2 p -94.73 -43.1 8.41 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.621 179.063 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.439 ' HE3' ' OG ' ' A' ' 62' ' ' SER . 13.4 mptt -83.53 63.08 7.16 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.468 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.4 t -112.2 175.62 5.36 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.574 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 43.2 t -134.27 135.66 43.04 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -100.95 7.66 43.46 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.484 -175.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.487 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 62.8 m -82.85 134.87 35.08 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.637 178.691 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 53.2 p -101.91 167.91 9.76 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.165 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.3 m -69.75 -20.36 63.5 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.016 0.436 . . . . 0.0 110.289 178.082 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -74.64 -38.33 62.54 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.621 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -164.53 135.31 3.69 Favored Glycine 0 N--CA 1.428 -1.864 0 C-N-CA 120.455 -0.879 . . . . 0.0 112.285 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.2 t -73.23 129.55 38.29 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 179.048 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.487 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 75.1 mmtt -86.74 -25.51 24.67 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 112.068 0.395 . . . . 0.0 112.068 -176.496 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.449 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 19.1 p -97.77 -36.58 10.17 Favored 'General case' 0 C--N 1.313 -1.007 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.345 179.226 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 107.7 5.28 33.87 Favored Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.974 178.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.449 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 74.9 mmtt -83.96 -2.2 56.09 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-O 121.019 0.438 . . . . 0.0 110.542 178.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 67.16 23.91 9.41 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.721 177.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.433 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 1.7 p -73.78 -45.68 50.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.94 177.54 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 46.0 p 52.75 33.67 14.55 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.036 0.934 . . . . 0.0 113.375 176.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 156.74 144.13 3.85 Favored Glycine 0 N--CA 1.441 -1.032 0 C-N-CA 120.25 -0.976 . . . . 0.0 112.047 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.406 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 24.3 Cg_endo -63.18 -36.51 57.39 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.653 2.236 . . . . 0.0 112.406 -178.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -69.23 -14.93 63.24 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.938 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.6 m -125.47 22.56 7.66 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.038 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.433 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 4.6 t -83.33 137.98 33.73 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.298 -177.24 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 86.1 mttt -123.93 -4.83 8.02 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.384 -176.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.6 p -103.94 156.3 17.96 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 120.934 0.397 . . . . 0.0 111.911 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -71.34 -177.04 25.66 Favored Glycine 0 CA--C 1.52 0.361 0 CA-C-N 115.759 -0.655 . . . . 0.0 114.263 -176.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.465 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 41.3 m -78.21 -10.27 59.58 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -176.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 30.6 m -89.63 19.19 4.78 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.067 0.461 . . . . 0.0 110.365 178.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 29.6 t -96.97 166.44 11.61 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.825 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 49.3 m -66.32 -29.66 69.9 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -177.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.532 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 25.2 p -80.34 4.65 17.18 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.795 0.331 . . . . 0.0 111.383 -178.493 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.532 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 9.9 mmtp . . . . . 0 C--O 1.264 1.854 0 CA-C-O 117.939 -1.029 . . . . 0.0 110.832 -177.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 112.511 -0.236 . . . . 0.0 112.511 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.4 t -79.15 105.2 10.32 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.81 0.338 . . . . 0.0 110.553 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 69.17 42.18 77.15 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 121.028 -0.606 . . . . 0.0 112.317 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 36.2 mmtm -96.59 -179.46 4.61 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 120.854 0.359 . . . . 0.0 111.49 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -79.51 84.79 1.27 Allowed Glycine 0 N--CA 1.437 -1.275 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.865 -178.566 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -94.18 -9.81 35.12 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-O 121.412 0.625 . . . . 0.0 109.32 176.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.14 -98.46 2.45 Favored Glycine 0 N--CA 1.44 -1.086 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.849 178.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.561 ' HG2' ' SG ' ' A' ' 10' ' ' CYS . 28.8 tt0 -143.4 -67.0 0.36 Allowed 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.542 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt 59.14 33.75 22.94 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.929 -179.378 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.71 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 96.3 m -92.36 139.71 30.32 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-O 121.387 0.613 . . . . 0.0 111.932 -179.302 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 80.9 p -93.26 179.51 5.39 Favored 'General case' 0 N--CA 1.429 -1.479 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.459 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.1 m -64.23 -26.03 68.33 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.234 -178.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.43 -44.22 83.51 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.828 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.524 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 42.4 t -75.12 -32.87 61.49 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.231 0.539 . . . . 0.0 110.977 -179.12 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 36.4 ttm-85 -80.36 0.56 32.59 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.178 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.2 t -89.0 162.27 16.13 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -134.12 117.41 13.65 Favored Pre-proline 0 C--N 1.318 -0.802 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -68.5 166.64 69.03 Favored 'Cis proline' 0 N--CA 1.477 0.507 0 C-N-CA 123.498 -1.459 . . . . 0.0 112.555 0.467 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.419 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 4.4 t -62.47 133.0 54.38 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.425 -178.026 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 80.2 mm-40 -112.93 18.7 17.93 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -174.348 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.524 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 1.2 m -65.49 -30.49 71.27 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 120.239 -0.584 . . . . 0.0 111.358 179.459 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 58.99 -136.88 50.93 Favored Glycine 0 CA--C 1.52 0.363 0 CA-C-N 115.961 -0.563 . . . . 0.0 114.15 176.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.0 m -93.32 -8.17 42.8 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.866 0.365 . . . . 0.0 111.165 -177.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -88.01 -49.88 6.77 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.134 179.239 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.4 ' HA ' ' HB3' ' A' ' 21' ' ' CYS . 5.4 t 59.96 92.61 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.074 -178.628 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -85.14 -7.6 59.0 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.164 -0.925 . . . . 0.0 112.78 -174.146 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.567 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 22.6 p -101.07 -176.47 3.17 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.255 0.55 . . . . 0.0 111.686 -177.562 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -100.38 -147.9 21.67 Favored Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.981 177.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -109.13 18.05 20.99 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 121.157 0.504 . . . . 0.0 110.491 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -83.17 -9.12 84.48 Favored Glycine 0 C--N 1.309 -0.935 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.489 -177.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.71 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 29.8 p -94.27 -30.61 14.47 Favored 'General case' 0 C--N 1.318 -0.795 0 O-C-N 122.769 -0.253 . . . . 0.0 111.468 -178.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 41.1 p 49.61 41.23 21.23 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-O 121.709 0.766 . . . . 0.0 109.854 -173.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.622 ' O ' ' HB2' ' A' ' 37' ' ' LYS . 0.3 OUTLIER -58.77 159.19 7.06 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 114.528 -1.215 . . . . 0.0 111.214 -177.606 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -104.59 12.93 32.48 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.627 -178.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -121.72 -64.43 1.22 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.054 -178.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 14.7 p -82.11 -25.35 34.53 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.958 0.408 . . . . 0.0 111.275 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.622 ' HB2' ' O ' ' A' ' 33' ' ' CYS . 1.4 mmpp? -93.32 58.38 2.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.79 0.329 . . . . 0.0 111.208 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.7 t -127.72 159.97 33.14 Favored 'General case' 0 C--N 1.313 -1.017 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.735 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.3 t -93.35 139.52 30.58 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.352 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -95.15 -0.16 53.59 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 120.862 0.363 . . . . 0.0 111.384 -177.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.554 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 62.8 m -81.31 135.29 35.69 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.219 -0.446 . . . . 0.0 109.949 177.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 69.5 p -101.3 166.47 10.74 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.758 -178.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.7 m -71.72 -15.2 62.19 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.532 179.403 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -80.66 -35.32 33.94 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.508 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -166.61 130.04 2.05 Favored Glycine 0 N--CA 1.439 -1.151 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.091 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 18.6 t -67.88 133.87 49.89 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 32.8 mmmt -92.41 -30.85 15.55 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -176.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.1 p -91.62 -39.61 11.77 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.611 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 114.41 4.74 21.72 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.817 -0.706 . . . . 0.0 113.028 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.511 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 75.3 mmtt -86.32 -2.99 58.89 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.982 0.391 . . . . 0.0 111.507 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 67.94 18.31 9.56 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.311 0.577 . . . . 0.0 111.284 177.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.505 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 0.9 OUTLIER -65.83 -49.55 67.8 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.008 178.108 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 46.5 p 53.05 46.47 26.65 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.042 -0.981 . . . . 0.0 113.111 177.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 135.13 153.1 6.67 Favored Glycine 0 N--CA 1.442 -0.951 0 C-N-CA 120.212 -0.994 . . . . 0.0 112.687 177.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.09 -18.34 30.92 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.752 2.302 . . . . 0.0 112.68 -178.412 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -82.16 -4.83 57.78 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.158 0.504 . . . . 0.0 110.729 -178.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 49.3 m -148.07 26.44 0.98 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.317 0.58 . . . . 0.0 110.209 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.505 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 12.2 t -84.21 138.2 33.1 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.988 -177.403 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -110.82 12.43 22.38 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.445 0.641 . . . . 0.0 109.406 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.511 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 19.3 m -108.66 151.25 26.41 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.456 -178.473 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.401 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -89.18 -106.7 1.11 Allowed Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 121.106 -0.569 . . . . 0.0 112.558 -178.058 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 61.7 p -129.32 -9.0 4.71 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-O 120.9 0.381 . . . . 0.0 111.142 -178.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.1 m -104.38 20.61 18.14 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.88 -175.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 35.3 t -102.13 170.48 8.08 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.669 179.334 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.6 t -65.93 -28.94 69.3 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.186 -178.554 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.554 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 17.3 p -80.52 1.81 27.96 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 120.845 0.355 . . . . 0.0 111.488 -178.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 61' ' ' GLY . 23.5 mmtp . . . . . 0 C--O 1.258 1.525 0 CA-C-O 117.544 -1.217 . . . . 0.0 110.533 -179.104 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.225 0 N-CA-C 112.566 -0.213 . . . . 0.0 112.566 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.4 m -87.79 90.11 8.25 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.874 0.368 . . . . 0.0 110.367 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -66.31 149.82 51.6 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.772 -178.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -97.01 158.78 15.26 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.904 0.383 . . . . 0.0 110.414 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 176.65 70.95 0.06 OUTLIER Glycine 0 N--CA 1.436 -1.32 0 N-CA-C 111.252 -0.739 . . . . 0.0 111.252 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -86.81 179.14 6.8 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 110.419 -0.215 . . . . 0.0 110.419 -179.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -71.04 102.63 1.09 Allowed Glycine 0 N--CA 1.442 -0.955 0 C-N-CA 120.788 -0.72 . . . . 0.0 111.918 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -82.98 141.31 32.2 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 120.956 0.408 . . . . 0.0 110.563 -179.359 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.487 ' HD2' ' N ' ' A' ' 9' ' ' LYS . 11.5 mptt -99.25 13.02 34.55 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.091 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.854 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 79.7 m -100.35 146.33 27.09 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.271 -177.335 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.5 p -94.68 178.76 5.48 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.589 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.5 p -60.47 -29.35 68.99 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.385 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.27 -45.66 87.09 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.259 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.481 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 17.5 t -69.42 -35.27 75.57 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.006 0.432 . . . . 0.0 110.71 -178.694 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 15' ' ' ARG . 19.0 mtt180 -76.12 0.91 17.19 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.8 m -81.18 160.12 24.43 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.683 0.278 . . . . 0.0 111.064 -178.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.4 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 74.9 mm-40 -126.48 108.45 23.47 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.991 178.305 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.4 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 69.3 Cg_endo -74.44 173.12 58.74 Favored 'Cis proline' 0 C--O 1.241 0.634 0 C-N-CA 123.554 -1.436 . . . . 0.0 112.145 -2.12 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.481 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 8.7 t -57.66 139.92 52.5 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.871 -177.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 86.1 mm-40 -119.01 16.49 13.34 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -175.563 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -62.86 -29.86 71.07 Favored 'General case' 0 C--O 1.241 0.619 0 C-N-CA 120.269 -0.572 . . . . 0.0 110.412 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 59.33 -139.5 48.62 Favored Glycine 0 N--CA 1.448 -0.562 0 CA-C-N 115.663 -0.699 . . . . 0.0 113.032 176.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -99.17 10.69 40.94 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.133 0.492 . . . . 0.0 110.647 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -98.61 -50.23 4.33 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 177.474 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 t 57.3 94.6 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.0 179.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -97.36 9.61 41.84 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.562 -175.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.575 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 31.7 p -107.63 173.59 6.26 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.947 -179.335 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -102.06 178.45 26.93 Favored Glycine 0 N--CA 1.445 -0.742 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.798 178.094 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -82.14 78.23 8.84 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.221 0.534 . . . . 0.0 111.284 -178.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -159.14 23.09 0.31 Allowed Glycine 0 N--CA 1.444 -0.821 0 N-CA-C 111.265 -0.734 . . . . 0.0 111.265 178.002 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.854 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 25.1 p -116.52 -19.79 9.91 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 -178.255 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 71.7 p 50.92 30.41 5.22 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-O 121.573 0.702 . . . . 0.0 110.543 -175.589 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.429 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 1.9 t -76.84 116.41 17.48 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.008 -177.204 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -88.1 16.94 5.44 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.37 0.605 . . . . 0.0 110.607 -176.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.38 -54.07 2.67 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.216 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 28.6 p -98.44 -30.48 12.52 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.122 178.319 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.546 ' NZ ' ' HB2' ' A' ' 37' ' ' LYS . 0.3 OUTLIER -106.52 80.18 1.45 Allowed 'General case' 0 N--CA 1.435 -1.193 0 CA-C-O 121.448 0.642 . . . . 0.0 111.796 -175.17 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.5 t -157.17 161.75 39.32 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.035 178.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.6 t -89.96 146.91 24.03 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 120.835 0.35 . . . . 0.0 110.736 -179.495 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 -114.51 2.76 14.69 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.098 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.572 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 57.2 m -79.71 148.11 31.67 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.235 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 44.8 p -114.25 162.24 16.82 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.698 -179.132 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.446 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 6.6 p -63.8 -25.75 68.32 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.021 0.438 . . . . 0.0 111.312 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -73.4 -35.09 65.82 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.299 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -164.24 131.07 2.33 Favored Glycine 0 N--CA 1.442 -0.949 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.032 -179.052 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 27.4 t -76.96 133.65 39.13 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 120.743 0.306 . . . . 0.0 110.483 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -86.41 -41.06 14.77 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -178.127 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.451 ' HA ' ' HB2' ' A' ' 65' ' ' SER . 19.2 p -83.37 -39.23 20.97 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.033 -177.411 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.64 5.82 25.57 Favored Glycine 0 N--CA 1.44 -1.071 0 C-N-CA 120.47 -0.871 . . . . 0.0 113.029 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -84.58 -0.51 53.48 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.075 0.464 . . . . 0.0 110.264 178.301 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 63.66 21.23 12.62 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.215 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.56 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 3.2 p -70.04 -47.53 61.67 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.956 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.446 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 73.5 p 55.35 25.68 7.84 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 114.956 -1.02 . . . . 0.0 113.032 177.246 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 152.02 155.22 6.93 Favored Glycine 0 N--CA 1.441 -1.025 0 C-N-CA 120.297 -0.954 . . . . 0.0 112.518 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.455 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 20.8 Cg_endo -60.36 -26.64 83.18 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 123.258 2.639 . . . . 0.0 113.179 -179.075 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -70.74 -17.73 62.8 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.927 0.394 . . . . 0.0 111.656 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.1 m -135.43 25.15 3.48 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.008 0.432 . . . . 0.0 110.032 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.56 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 6.3 t -81.59 126.42 31.71 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.146 -176.767 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp -106.34 17.27 23.66 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.462 -178.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.3 m -109.5 159.38 17.11 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.197 -175.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -110.21 -77.04 0.91 Allowed Glycine 0 N--CA 1.439 -1.115 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.624 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 34.8 m -146.47 159.3 43.59 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 110.376 -0.231 . . . . 0.0 110.376 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.2 m 65.21 7.4 4.13 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 177.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' CYS . . . . . 0.433 ' HB3' ' HG2' ' A' ' 67' ' ' LYS . 45.3 t -75.46 167.47 21.84 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 176.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.451 ' HB2' ' HA ' ' A' ' 48' ' ' CYS . 15.4 m -64.34 -16.56 62.46 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 120.771 0.319 . . . . 0.0 111.771 -177.592 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.572 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 25.5 p -101.15 1.92 39.64 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 120.571 0.224 . . . . 0.0 111.29 178.433 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.52 ' HE2' ' SG ' ' A' ' 66' ' ' CYS . 71.9 mmtt . . . . . 0 C--O 1.261 1.708 0 CA-C-O 117.843 -1.075 . . . . 0.0 111.049 -177.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 N-CA-C 112.366 -0.294 . . . . 0.0 112.366 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.7 m -87.7 -21.18 25.37 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.776 0.322 . . . . 0.0 111.035 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.401 ' C ' ' HD2' ' A' ' 4' ' ' LYS . . . 81.32 -129.84 9.31 Favored Glycine 0 N--CA 1.444 -0.804 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.174 179.523 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.401 ' HD2' ' C ' ' A' ' 3' ' ' GLY . 13.3 mptt -121.12 170.17 9.81 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 128.33 109.15 1.46 Allowed Glycine 0 N--CA 1.442 -0.949 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.446 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -114.69 101.66 9.29 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.954 0.406 . . . . 0.0 110.627 179.108 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 79.62 -139.73 21.87 Favored Glycine 0 N--CA 1.443 -0.846 0 C-N-CA 120.73 -0.747 . . . . 0.0 111.603 -179.323 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -138.62 -82.39 0.3 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.061 0.458 . . . . 0.0 111.874 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -132.95 25.07 4.29 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.119 -177.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.55 ' SG ' ' HB2' ' A' ' 27' ' ' CYS . 78.6 m -95.86 147.86 23.21 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -176.429 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 74.8 p -100.51 179.6 4.39 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.805 -178.088 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.5 m -62.12 -20.07 63.68 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.31 -178.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.38 -50.14 48.94 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 120.956 0.408 . . . . 0.0 110.023 177.541 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 51.4 t -73.57 -35.68 65.48 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.009 178.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 27.7 mtm180 -69.35 -3.34 13.75 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.948 0.404 . . . . 0.0 111.649 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.5 t -83.62 163.97 20.01 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 176.455 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -132.86 111.43 13.37 Favored Pre-proline 0 C--N 1.306 -1.3 0 CA-C-O 120.884 0.373 . . . . 0.0 110.565 178.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -75.22 173.14 59.5 Favored 'Cis proline' 0 C--N 1.35 0.613 0 C-N-CA 123.444 -1.482 . . . . 0.0 112.238 -0.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 71.2 m -59.86 140.68 56.44 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.075 0.464 . . . . 0.0 111.164 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 28.7 mm-40 -114.29 21.1 14.99 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.004 -177.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.44 ' HB3' ' HA ' ' A' ' 25' ' ' CYS . 11.0 m -66.1 -33.14 75.1 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.84 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 79.75 -114.85 3.95 Favored Glycine 0 N--CA 1.438 -1.17 0 C-N-CA 120.775 -0.726 . . . . 0.0 111.445 -178.521 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.9 t -129.29 -3.27 4.97 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.043 0.449 . . . . 0.0 110.248 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -88.22 -40.81 13.39 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.086 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.538 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 0.6 OUTLIER 66.72 104.39 0.04 OUTLIER 'General case' 0 CA--C 1.505 -0.772 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.848 -179.615 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -88.3 -14.88 37.2 Favored 'General case' 0 C--N 1.305 -1.346 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.009 177.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.55 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 26.6 p -84.19 170.86 13.33 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.194 178.294 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.12 -126.68 2.87 Favored Glycine 0 N--CA 1.441 -0.987 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.29 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -137.36 77.41 1.64 Allowed 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 121.635 0.731 . . . . 0.0 110.556 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -172.36 43.21 0.17 Allowed Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.844 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.566 ' SG ' ' HE2' ' A' ' 37' ' ' LYS . 12.0 p -130.88 -28.63 1.97 Allowed 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 120.6 0.238 . . . . 0.0 111.178 -178.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.8 p 50.04 45.66 25.18 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 123.466 0.706 . . . . 0.0 112.8 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.637 ' O ' ' HB2' ' A' ' 37' ' ' LYS . 59.1 m -74.6 170.95 14.74 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.503 178.164 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -109.41 3.54 21.54 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.27 0.557 . . . . 0.0 110.08 178.174 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -104.62 -69.09 0.82 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.389 -178.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.538 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 25.3 p -88.68 0.23 56.63 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.139 -179.631 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.637 ' HB2' ' O ' ' A' ' 33' ' ' CYS . 34.1 mmtm -120.39 37.67 4.2 Favored 'General case' 0 CA--C 1.503 -0.832 0 CA-C-O 121.568 0.699 . . . . 0.0 111.454 -179.359 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.5 t -113.81 165.42 12.59 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.558 177.035 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 27.9 t -102.73 136.43 42.57 Favored 'General case' 0 C--N 1.307 -1.255 0 C-N-CA 120.633 -0.427 . . . . 0.0 109.922 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -87.31 -5.26 58.97 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.041 0.448 . . . . 0.0 110.806 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.426 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 69.3 m -80.03 136.01 36.49 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.176 178.345 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 61.1 p -92.59 152.91 19.34 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.448 -178.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.516 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 45.5 m -66.52 -13.0 60.35 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-O 121.215 0.531 . . . . 0.0 110.795 178.606 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -86.01 -19.81 29.8 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.248 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 178.2 134.8 2.15 Favored Glycine 0 N--CA 1.438 -1.17 0 C-N-CA 120.976 -0.63 . . . . 0.0 112.033 -178.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 30.9 t -69.03 142.24 54.62 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -112.18 -10.32 13.86 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.216 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.522 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 14.5 p -103.67 -39.48 6.67 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.121 -0.632 . . . . 0.0 109.962 177.158 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 122.9 -1.62 9.96 Favored Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.81 -0.709 . . . . 0.0 113.437 177.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.807 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 35.2 mmtp -84.71 -4.12 58.88 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 117.136 0.468 . . . . 0.0 111.526 -178.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 67.85 19.58 9.51 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.273 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.559 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.2 p -69.06 -44.29 72.88 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.132 -179.518 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.516 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 67.0 p 53.65 27.75 7.17 Favored 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 176.142 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.97 158.62 7.66 Favored Glycine 0 N--CA 1.443 -0.882 0 C-N-CA 120.095 -1.05 . . . . 0.0 112.151 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.91 -26.51 81.3 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 123.159 2.572 . . . . 0.0 113.065 -178.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -60.29 -50.25 74.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.873 0.368 . . . . 0.0 111.467 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.0 m -107.21 19.38 20.45 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.237 -177.271 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.559 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 41.8 t -84.87 135.47 34.06 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 121.183 0.516 . . . . 0.0 111.509 -178.27 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -122.28 13.19 10.31 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.154 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.807 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 3.7 m -99.71 116.72 32.46 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 178.547 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -106.37 89.38 0.6 Allowed Glycine 0 C--N 1.298 -1.549 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.916 -175.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.458 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 39.7 m 66.14 164.72 0.18 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.17 0.588 . . . . 0.0 111.339 -179.15 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.9 m 69.31 -14.32 0.33 Allowed 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 25.5 t -86.22 165.37 16.56 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 119.873 -0.731 . . . . 0.0 110.932 -178.104 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.8 m -64.2 -22.69 67.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.738 -178.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.426 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 27.4 p -90.29 4.22 51.36 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.81 178.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.458 ' HD2' ' H ' ' A' ' 62' ' ' SER . 0.3 OUTLIER . . . . . 0 C--O 1.256 1.403 0 CA-C-O 118.078 -0.963 . . . . 0.0 110.474 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.038 0 N-CA-C 112.168 -0.373 . . . . 0.0 112.168 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.9 t -106.54 148.99 27.58 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 179.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -72.52 -41.57 50.98 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.658 -179.074 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.413 ' HE3' ' HB2' ' A' ' 4' ' ' LYS . 51.2 mtmt -103.18 120.57 40.96 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.873 0.368 . . . . 0.0 111.881 -177.698 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.22 -39.83 2.65 Favored Glycine 0 N--CA 1.448 -0.545 0 CA-C-N 115.921 -0.582 . . . . 0.0 114.032 174.033 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.6 mptt 66.68 19.14 10.79 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 121.364 0.602 . . . . 0.0 109.982 -177.222 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -174.44 175.78 46.76 Favored Glycine 0 N--CA 1.433 -1.532 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.148 -179.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.5 ' HA ' ' O ' ' A' ' 29' ' ' GLU . 28.9 mt-10 -64.21 -53.42 49.48 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 120.67 0.271 . . . . 0.0 110.923 -179.367 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 50.4 mtpt 58.04 51.89 8.32 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.341 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.731 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 71.7 m -92.93 139.4 30.57 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.218 177.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 64.4 p -88.08 -179.06 6.11 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.758 -177.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.0 p -62.74 -30.59 71.55 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.196 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.45 -49.43 76.86 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.695 179.468 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.425 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 43.2 t -67.97 -29.29 68.3 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.431 0.634 . . . . 0.0 110.423 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.4 mmt180 -84.38 15.94 3.36 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.975 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.6 m -107.81 161.09 15.22 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 175.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -123.35 110.87 30.36 Favored Pre-proline 0 C--N 1.315 -0.908 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.724 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -79.17 171.27 65.69 Favored 'Cis proline' 0 C--O 1.239 0.544 0 C-N-CA 123.483 -1.465 . . . . 0.0 111.852 -0.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 95.9 m -55.31 129.06 37.01 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.391 0.615 . . . . 0.0 111.215 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 31.4 mm-40 -94.75 8.89 41.03 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.034 -178.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.611 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 7.4 m -62.26 -37.02 83.85 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.093 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 64.59 -144.56 48.52 Favored Glycine 0 N--CA 1.441 -1.011 0 CA-C-N 115.687 -0.688 . . . . 0.0 113.105 178.008 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.7 m -88.58 -8.51 54.59 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -178.009 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -86.66 -54.13 4.56 Favored 'General case' 0 CA--C 1.491 -1.29 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 178.222 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.685 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 8.6 t 63.48 101.18 0.03 OUTLIER 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 114.358 -1.292 . . . . 0.0 112.467 175.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -97.18 12.15 33.82 Favored 'General case' 0 C--N 1.308 -1.197 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -178.361 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.731 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 21.8 p -104.12 166.05 10.65 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 119.754 -0.779 . . . . 0.0 111.24 176.624 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -79.41 -112.49 0.24 Allowed Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.225 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.5 ' O ' ' HA ' ' A' ' 8' ' ' GLU . 46.8 mt-10 -139.84 -173.34 3.61 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -179.205 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.96 -33.8 5.67 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.472 -0.87 . . . . 0.0 113.095 177.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 18.5 p -69.37 -36.88 77.26 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.738 0.304 . . . . 0.0 110.814 -179.228 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 46.9 p 49.59 43.96 24.2 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.634 -179.071 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 72.3 m -64.81 172.38 2.85 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.926 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.39 3.29 23.17 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.539 0.685 . . . . 0.0 109.619 177.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -106.45 -72.06 0.73 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.542 -178.237 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.685 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 7.8 p -80.25 -23.43 40.83 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.183 0.516 . . . . 0.0 111.275 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.524 ' NZ ' ' SG ' ' A' ' 27' ' ' CYS . 11.2 mptt -95.36 105.52 17.48 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-O 121.473 0.654 . . . . 0.0 111.691 179.226 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.4 t -171.7 -173.04 1.11 Allowed 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 114.891 -1.049 . . . . 0.0 108.348 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.423 ' SG ' ' HB2' ' A' ' 41' ' ' CYS . 46.4 t -136.98 127.18 26.26 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 177.354 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 41.4 m-80 -72.48 -20.28 61.4 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.972 0.415 . . . . 0.0 110.705 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.488 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 49.5 m -68.59 137.15 54.04 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.712 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 77.9 p -117.9 173.38 6.8 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.434 -177.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.1 m -62.08 -20.27 63.84 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 121.04 0.448 . . . . 0.0 110.947 178.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -68.09 -39.59 82.83 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.391 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 176.22 146.51 6.01 Favored Glycine 0 N--CA 1.428 -1.855 0 C-N-CA 120.848 -0.691 . . . . 0.0 111.853 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 45.1 t -63.91 129.7 41.14 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 178.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.488 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 30.8 mmmt -96.23 -12.69 24.23 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -176.261 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.499 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 18.7 p -99.97 -41.4 7.21 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 119.654 -0.818 . . . . 0.0 109.928 177.123 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.46 15.82 9.3 Favored Glycine 0 N--CA 1.433 -1.531 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.816 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.499 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 75.7 mmtt -94.64 6.06 50.01 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 176.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 67.99 37.98 2.88 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.694 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.629 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 26.6 p -113.14 141.9 46.38 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.327 176.539 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.2 p -136.55 106.4 6.24 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.624 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 90.8 147.86 19.84 Favored Glycine 0 N--CA 1.437 -1.234 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.312 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -59.37 -30.26 92.28 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.327 2.018 . . . . 0.0 111.918 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -63.63 -47.01 83.1 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.565 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.4 m -101.52 19.62 17.59 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.257 -178.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.629 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 44.6 t -75.24 126.63 31.41 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 120.874 0.369 . . . . 0.0 110.375 179.594 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -99.58 -5.11 29.65 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.366 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.403 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 15.2 m -89.0 142.18 27.85 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.017 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -116.27 73.08 0.27 Allowed Glycine 0 C--N 1.316 -0.575 0 C-N-CA 120.808 -0.711 . . . . 0.0 113.074 -176.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.451 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 9.7 t 65.65 166.39 0.19 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.18 0.592 . . . . 0.0 111.355 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.3 t 70.21 -16.57 0.3 Allowed 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.411 0.684 . . . . 0.0 112.759 177.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 20.1 t -76.88 165.16 25.06 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 110.354 -0.239 . . . . 0.0 110.354 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 6.7 m -64.24 -24.59 67.72 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.87 -177.172 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.49 ' SG ' ' HE2' ' A' ' 67' ' ' LYS . 20.8 p -75.92 -4.09 39.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.922 0.392 . . . . 0.0 111.01 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.49 ' HE2' ' SG ' ' A' ' 66' ' ' CYS . 18.0 mmtt . . . . . 0 C--O 1.258 1.517 0 CA-C-O 117.485 -1.245 . . . . 0.0 110.34 -178.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.503 0 N-CA-C 112.333 -0.307 . . . . 0.0 112.333 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.3 p -65.26 -36.78 85.18 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.963 0.411 . . . . 0.0 111.173 179.639 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -104.91 36.51 4.35 Favored Glycine 0 N--CA 1.443 -0.859 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 179.035 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 61.4 tttm -78.99 108.19 12.29 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-O 121.043 0.449 . . . . 0.0 110.2 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 168.68 127.98 0.96 Allowed Glycine 0 N--CA 1.437 -1.293 0 N-CA-C 111.305 -0.718 . . . . 0.0 111.305 -179.237 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -119.99 146.85 45.46 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 120.603 0.239 . . . . 0.0 110.387 -179.505 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 150.49 -165.62 30.03 Favored Glycine 0 CA--C 1.49 -1.482 0 C-N-CA 120.918 -0.658 . . . . 0.0 111.955 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -137.89 179.76 6.24 Favored 'General case' 0 N--CA 1.427 -1.599 0 CA-C-O 121.41 0.624 . . . . 0.0 111.024 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -126.39 37.36 4.33 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 114.969 -1.014 . . . . 0.0 108.387 178.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.639 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 59.4 m -91.34 156.49 17.74 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.659 -1.155 . . . . 0.0 112.617 -176.224 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.3 p -94.16 177.76 5.86 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.465 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.7 m -57.75 -37.74 74.14 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.782 0.29 . . . . 0.0 111.782 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.97 -42.28 98.96 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 120.942 0.401 . . . . 0.0 111.517 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.56 ' HB3' ' HB3' ' A' ' 10' ' ' CYS . 11.7 t -73.83 -25.46 60.1 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.365 0.603 . . . . 0.0 109.635 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 42.2 mtt180 -89.78 12.83 15.98 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.411 178.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.6 m -89.05 177.71 6.58 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 179.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.469 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 3.4 tm-20 -131.84 111.08 14.61 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-O 120.707 0.289 . . . . 0.0 110.507 178.765 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.469 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 72.0 Cg_endo -77.94 -170.55 8.85 Favored 'Cis proline' 0 C--N 1.347 0.481 0 C-N-CA 122.926 -1.697 . . . . 0.0 110.924 -2.264 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.7 t -59.46 122.95 15.27 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 120.898 0.38 . . . . 0.0 110.575 -179.217 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 84.5 mm-40 -110.17 15.73 22.22 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.007 -177.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.857 ' SG ' ' HA ' ' A' ' 25' ' ' CYS . 3.4 t -65.62 -27.88 68.71 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 50.75 -139.01 23.94 Favored Glycine 0 C--N 1.341 0.826 0 CA-C-N 114.704 -1.135 . . . . 0.0 115.345 173.323 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.2 m -84.03 -15.39 47.74 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.101 -0.549 . . . . 0.0 111.293 -177.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.8 mmmt -73.95 -48.75 28.42 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.186 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.857 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 8.2 t 53.59 81.9 0.09 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.74 -179.13 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -86.61 -11.2 52.12 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.869 -175.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.639 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 30.8 p -82.92 175.52 10.0 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.0 0.428 . . . . 0.0 111.176 -178.529 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -123.04 -135.57 4.62 Favored Glycine 0 N--CA 1.437 -1.253 0 C-N-CA 120.474 -0.87 . . . . 0.0 112.499 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -74.58 152.29 39.31 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 122.899 0.48 . . . . 0.0 111.071 -179.029 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 94.84 15.92 43.89 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.021 -0.609 . . . . 0.0 112.944 178.143 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.69 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 16.1 t -114.77 -62.61 1.58 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.103 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 76.3 p 52.38 35.48 17.46 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.124 0.569 . . . . 0.0 111.8 -177.027 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.69 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -58.35 142.44 48.21 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.339 179.757 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -93.28 18.31 9.78 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 121.392 0.615 . . . . 0.0 109.681 178.21 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -120.71 -53.55 2.08 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.531 -177.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.649 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 29.8 p -98.24 -38.93 9.09 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.735 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 11.1 ttmm -107.18 36.01 2.84 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.471 0.653 . . . . 0.0 111.104 -174.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.424 ' O ' ' HD3' ' A' ' 67' ' ' LYS . 14.7 t -96.86 171.27 8.62 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.729 -177.601 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -99.8 148.59 24.25 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.663 178.656 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -110.28 3.89 20.36 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.656 -178.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.406 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 64.8 m -80.08 155.79 27.38 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-O 120.827 0.346 . . . . 0.0 110.712 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 54.7 p -122.87 159.15 28.79 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.403 -178.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.5 m -65.03 -27.97 69.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.148 0.499 . . . . 0.0 110.241 179.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -66.52 -32.18 73.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.896 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -174.44 128.36 1.44 Allowed Glycine 0 N--CA 1.437 -1.253 0 C-N-CA 120.89 -0.671 . . . . 0.0 111.759 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.9 t -63.31 144.23 57.12 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 178.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm -104.9 -21.58 13.29 Favored 'General case' 0 C--N 1.317 -0.848 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -175.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 25.7 p -98.12 -41.69 7.81 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.75 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.93 -2.38 19.54 Favored Glycine 0 N--CA 1.443 -0.893 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.094 -178.601 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.602 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 30.4 mmmt -79.65 -3.33 46.77 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.691 0.281 . . . . 0.0 110.405 178.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 70.16 17.06 7.3 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.513 176.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.572 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 3.4 p -69.5 -37.5 77.24 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.798 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 44.1 p 52.09 37.39 21.39 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.715 0.806 . . . . 0.0 112.797 177.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 134.44 159.59 8.88 Favored Glycine 0 N--CA 1.439 -1.129 0 C-N-CA 120.148 -1.025 . . . . 0.0 112.296 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.26 -25.52 76.79 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.968 2.445 . . . . 0.0 112.798 -178.399 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -62.01 -40.08 94.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.692 -178.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 40.2 m -115.53 18.35 15.95 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 121.035 0.445 . . . . 0.0 110.626 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.572 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 48.6 t -79.06 120.77 24.1 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.21 0.529 . . . . 0.0 111.067 -178.645 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -108.49 7.48 26.88 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.81 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.602 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 26.5 m -80.77 142.75 33.46 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.656 178.386 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -127.2 82.37 0.35 Allowed Glycine 0 C--N 1.311 -0.842 0 C-N-CA 120.925 -0.655 . . . . 0.0 111.771 -178.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 52.0 m 62.99 171.99 0.15 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.722 0.409 . . . . 0.0 110.992 -178.054 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 31.6 m 62.81 3.53 1.21 Allowed 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 176.429 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 33.1 t -101.74 167.26 10.21 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 122.032 -0.417 . . . . 0.0 110.376 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.9 t -68.46 -27.84 66.51 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.748 -177.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.406 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 25.6 p -82.55 -0.86 48.73 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.138 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.424 ' HD3' ' O ' ' A' ' 38' ' ' THR . 70.8 mmtt . . . . . 0 C--O 1.263 1.814 0 CA-C-O 117.676 -1.154 . . . . 0.0 110.786 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.365 0 N-CA-C 112.276 -0.33 . . . . 0.0 112.276 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.0 m -132.31 150.32 52.18 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 120.675 0.274 . . . . 0.0 110.503 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 166.95 101.31 0.15 Allowed Glycine 0 N--CA 1.443 -0.862 0 N-CA-C 111.533 -0.627 . . . . 0.0 111.533 -179.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.8 mmmt -83.69 115.24 22.09 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.186 0.517 . . . . 0.0 111.318 -179.2 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -96.06 -20.43 25.84 Favored Glycine 0 CA--C 1.495 -1.17 0 N-CA-C 109.932 -1.267 . . . . 0.0 109.932 177.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -142.52 122.58 13.7 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 114.908 -0.646 . . . . 0.0 109.309 177.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -97.95 -122.63 4.55 Favored Glycine 0 N--CA 1.441 -1.026 0 C-N-CA 120.374 -0.917 . . . . 0.0 112.738 -179.085 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.471 ' HB3' ' HD2' ' A' ' 9' ' ' LYS . 11.9 mm-40 -73.03 -85.7 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.328 0.585 . . . . 0.0 112.256 -178.448 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.471 ' HD2' ' HB3' ' A' ' 8' ' ' GLU . 10.8 mptt -127.24 25.25 6.2 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.764 -178.157 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.515 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 85.9 m -88.5 139.1 30.82 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.016 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.426 ' OG1' ' HB2' ' A' ' 26' ' ' GLN . 73.4 p -89.42 -177.62 5.39 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.396 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 11.3 m -64.13 -22.77 67.07 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.064 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.86 -49.39 58.73 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 120.837 0.351 . . . . 0.0 110.737 179.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 36.3 t -73.48 -31.16 63.6 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.002 0.43 . . . . 0.0 110.536 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.553 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 1.7 mmp_? -74.17 -11.39 60.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.857 179.252 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.9 t -82.11 165.27 20.71 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.406 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 8.0 pt-20 -126.37 115.08 23.36 Favored Pre-proline 0 C--N 1.316 -0.85 0 CA-C-O 120.81 0.338 . . . . 0.0 110.997 -179.294 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.406 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 1.8 Cg_endo -81.27 -174.07 13.4 Favored 'Cis proline' 0 C--N 1.348 0.514 0 C-N-CA 123.58 -1.425 . . . . 0.0 111.722 -0.163 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.5 m -56.63 126.56 27.25 Favored 'General case' 0 CA--C 1.504 -0.814 0 CA-C-O 121.644 0.735 . . . . 0.0 112.55 -178.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -101.92 12.82 36.33 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.738 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.405 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 15.1 m -60.99 -28.77 69.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.269 177.619 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 59.58 -112.6 4.45 Favored Glycine 0 C--N 1.34 0.791 0 CA-C-N 115.74 -0.663 . . . . 0.0 112.028 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 70.3 m -121.43 17.75 11.35 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.147 0.498 . . . . 0.0 110.211 177.525 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -102.31 -45.83 4.99 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.836 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 55.9 90.94 0.03 OUTLIER 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.608 0.718 . . . . 0.0 110.601 -176.715 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.426 ' HB2' ' OG1' ' A' ' 11' ' ' THR . 49.4 mt-30 -92.9 -6.08 49.44 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.298 -174.708 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.515 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 26.3 p -88.27 174.06 8.41 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-O 121.101 0.477 . . . . 0.0 111.501 -177.871 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -118.12 -134.29 5.05 Favored Glycine 0 N--CA 1.443 -0.892 0 C-N-CA 120.936 -0.649 . . . . 0.0 113.242 -179.115 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -74.25 176.8 6.31 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 123.189 0.595 . . . . 0.0 112.027 -177.178 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 62.46 31.7 80.49 Favored Glycine 0 CA--C 1.502 -0.76 0 CA-C-N 115.283 -0.871 . . . . 0.0 112.158 178.332 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 49.3 t -124.9 -76.7 0.59 Allowed 'General case' 0 N--CA 1.423 -1.823 0 C-N-CA 120.651 -0.419 . . . . 0.0 111.909 -177.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 75.1 p 48.73 41.12 17.42 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.548 0.689 . . . . 0.0 110.906 -178.001 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.424 ' HB2' ' SG ' ' A' ' 36' ' ' CYS . 0.5 OUTLIER -54.48 157.41 2.88 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 114.753 -1.112 . . . . 0.0 112.445 -178.66 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -95.57 21.03 8.75 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.341 0.591 . . . . 0.0 110.386 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -131.55 -63.81 0.82 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.371 -179.69 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.424 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 27.4 p -82.91 -45.2 14.49 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.705 -0.679 . . . . 0.0 112.16 -179.195 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.0 ttmt -118.79 50.94 1.15 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.192 0.52 . . . . 0.0 112.162 -170.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.7 t -97.62 162.66 13.18 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.707 179.004 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.413 ' SG ' ' HB2' ' A' ' 41' ' ' CYS . 51.6 t -94.96 140.56 29.78 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -99.64 0.61 42.4 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.837 -179.149 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.413 ' HB2' ' SG ' ' A' ' 39' ' ' CYS . 62.1 m -82.93 141.09 32.42 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.727 177.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 59.3 p -100.39 164.89 11.72 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 -178.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.452 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 7.9 m -69.55 -9.68 54.97 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 121.299 0.571 . . . . 0.0 110.539 178.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -99.44 -32.77 10.97 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.005 179.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -150.2 128.42 2.67 Favored Glycine 0 N--CA 1.438 -1.187 0 C-N-CA 120.289 -0.958 . . . . 0.0 112.843 -177.174 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.0 t -80.57 133.73 35.82 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.011 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -98.84 -24.78 14.86 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -176.005 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 23.2 p -93.43 -35.41 13.0 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.221 -0.592 . . . . 0.0 110.579 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 110.37 -2.24 29.51 Favored Glycine 0 N--CA 1.438 -1.204 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.932 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -78.4 -7.16 57.04 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.034 0.445 . . . . 0.0 110.47 179.15 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 64.16 33.6 11.72 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.173 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.494 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 3.1 p -75.1 -49.12 20.69 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.139 178.304 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.452 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 53.4 p 50.45 76.27 0.15 Allowed 'General case' 0 C--O 1.237 0.423 0 C-N-CA 123.941 0.896 . . . . 0.0 112.432 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 113.84 138.92 7.06 Favored Glycine 0 N--CA 1.436 -1.324 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.714 179.071 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.512 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 21.8 Cg_endo -62.12 -27.98 79.43 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.783 2.322 . . . . 0.0 112.524 -178.318 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -62.84 -39.51 94.58 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.106 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.4 m -107.05 24.23 13.14 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.487 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.512 ' HB2' ' HA ' ' A' ' 55' ' ' PRO . 0.5 OUTLIER -76.04 131.42 39.49 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.772 -178.272 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -106.73 3.77 26.98 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.219 0.533 . . . . 0.0 109.607 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 4.3 m -96.24 167.3 11.28 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.877 -175.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -98.59 -106.63 2.62 Favored Glycine 0 N--CA 1.442 -0.959 0 CA-C-N 115.815 -0.63 . . . . 0.0 112.222 179.243 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.9 m -131.43 -12.74 3.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.73 0.3 . . . . 0.0 111.591 -178.625 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 17.4 m -103.0 20.51 17.43 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -175.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 38.2 t -96.75 165.69 12.0 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.838 0.351 . . . . 0.0 110.963 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.6 m -64.18 -25.32 68.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.291 -178.111 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.502 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 26.7 p -89.84 13.53 14.26 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.725 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.502 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 39.5 mmtm . . . . . 0 C--O 1.264 1.822 0 CA-C-O 117.875 -1.059 . . . . 0.0 110.437 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.473 ' N ' ' HB3' ' A' ' 4' ' ' LYS . . . . . . . . 0 N--CA 1.489 2.201 0 N-CA-C 112.406 -0.278 . . . . 0.0 112.406 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.9 m -76.32 98.52 4.53 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.85 0.357 . . . . 0.0 111.115 -178.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 71.35 19.41 77.53 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.185 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.473 ' HB3' ' N ' ' A' ' 1' ' ' GLY . 28.3 tptp -97.17 -65.6 0.95 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -72.29 -48.52 24.5 Favored Glycine 0 N--CA 1.447 -0.581 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 176.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -162.43 179.68 7.62 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 177.185 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -104.52 106.31 2.72 Favored Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.189 -1.005 . . . . 0.0 113.807 -176.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -76.25 120.81 22.02 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 176.173 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 47.8 mtmt -90.89 52.12 2.1 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 121.36 0.6 . . . . 0.0 110.511 -177.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.523 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 78.1 m -80.53 134.9 36.01 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.682 178.202 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 61.2 p -80.87 177.32 9.12 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.126 -178.784 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.9 p -58.15 -37.16 74.15 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.211 178.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.02 -47.53 82.7 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.862 0.363 . . . . 0.0 110.839 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 47.4 t -68.13 -38.61 82.38 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.163 0.506 . . . . 0.0 110.406 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 29.3 ttt180 -73.05 -9.36 58.65 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.874 -179.094 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.2 m -71.99 164.57 25.88 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 122.107 -0.37 . . . . 0.0 110.594 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.431 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -125.23 114.08 25.99 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.654 178.442 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.431 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 74.4 Cg_endo -75.73 174.34 53.36 Favored 'Cis proline' 0 C--O 1.237 0.438 0 C-N-CA 123.394 -1.503 . . . . 0.0 112.066 -1.184 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.578 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 49.6 t -57.9 132.88 54.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.228 -178.819 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 79.5 mm-40 -117.59 17.35 14.47 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.958 -179.235 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.682 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.8 t -60.11 -29.23 68.47 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.966 -179.588 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 81.13 -153.1 33.58 Favored Glycine 0 N--CA 1.431 -1.66 0 CA-C-N 115.463 -0.79 . . . . 0.0 112.195 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.5 m -107.33 11.82 28.73 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -102.53 -30.58 10.89 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.862 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.67 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 1.1 m 65.59 103.78 0.04 OUTLIER 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.568 0.699 . . . . 0.0 112.799 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -95.48 -5.57 42.63 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 115.38 -0.827 . . . . 0.0 108.861 176.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.523 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 22.8 p -92.89 160.12 15.05 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.184 -178.834 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -79.96 162.15 46.35 Favored Glycine 0 N--CA 1.44 -1.049 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 174.632 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.24 163.04 23.69 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 117.529 0.664 . . . . 0.0 111.307 -178.283 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 98.19 0.88 58.31 Favored Glycine 0 N--CA 1.439 -1.151 0 N-CA-C 110.311 -1.116 . . . . 0.0 110.311 -175.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 43.2 t -75.46 142.19 42.99 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 75.7 p -103.8 14.18 31.45 Favored 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -175.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.7 m -67.33 133.03 48.86 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.032 175.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -99.69 12.91 35.35 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.645 0.736 . . . . 0.0 109.035 177.47 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.8 -57.01 2.12 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.403 -178.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.682 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 28.4 p -82.6 -43.62 16.79 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.746 177.538 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.2 ttpm? -101.8 81.15 2.1 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.519 178.564 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.3 t -121.73 155.41 35.3 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 -179.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.6 t -92.83 135.05 34.48 Favored 'General case' 0 N--CA 1.444 -0.725 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -92.85 1.34 57.34 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 121.1 0.476 . . . . 0.0 110.881 -178.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.51 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 56.3 m -88.81 133.7 34.17 Favored 'General case' 0 N--CA 1.437 -1.12 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.338 179.197 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 1.6 t -108.69 164.77 12.08 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.337 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.551 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 44.4 m -70.58 -9.88 57.94 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.707 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -88.33 -19.69 26.35 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.432 177.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -179.65 131.11 1.61 Allowed Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.058 -179.37 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.6 t -76.9 147.84 36.78 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -109.71 -30.89 7.66 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 112.324 0.491 . . . . 0.0 112.324 -177.567 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.53 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 29.1 p -87.89 -34.18 18.26 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.188 -0.605 . . . . 0.0 111.397 -177.574 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.28 -1.38 31.14 Favored Glycine 0 N--CA 1.445 -0.765 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.507 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.558 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 75.1 mmtt -80.58 -8.64 59.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.029 0.442 . . . . 0.0 109.902 178.625 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 67.82 30.87 6.08 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.062 -0.972 . . . . 0.0 111.144 178.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.411 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.6 p -72.66 -44.05 62.36 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.157 177.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.551 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 77.7 p 50.78 41.0 25.83 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.72 0.808 . . . . 0.0 112.859 177.146 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 147.4 136.38 2.8 Favored Glycine 0 N--CA 1.437 -1.276 0 C-N-CA 120.384 -0.912 . . . . 0.0 111.731 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.423 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 13.2 Cg_endo -57.2 -24.6 59.97 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.122 2.548 . . . . 0.0 113.621 -178.387 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -74.22 -35.86 63.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.923 0.392 . . . . 0.0 111.197 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 37.0 t -101.2 10.92 40.29 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.524 0.678 . . . . 0.0 109.746 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.423 ' HB2' ' HA ' ' A' ' 55' ' ' PRO . 13.8 t -79.87 110.27 15.07 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.69 -178.631 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -108.24 -6.95 16.11 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.725 -177.051 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.558 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.8 p -85.36 157.92 20.4 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.157 -0.617 . . . . 0.0 111.707 -179.165 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -64.6 175.34 12.41 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 115.234 0.854 . . . . 0.0 115.234 -174.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.53 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 14.2 m -77.94 -10.63 59.68 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 123.697 0.799 . . . . 0.0 111.121 -178.698 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.7 m -93.95 9.81 35.95 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.96 0.41 . . . . 0.0 110.676 179.077 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 44.2 t -81.35 169.63 17.01 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.205 -178.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.8 t -69.97 -24.76 63.37 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.956 -177.278 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.51 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 22.0 p -82.5 -3.87 56.57 Favored 'General case' 0 CA--C 1.512 -0.515 0 C-N-CA 120.466 -0.493 . . . . 0.0 110.815 -179.253 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.53 ' HG3' ' HA ' ' A' ' 62' ' ' SER . 38.5 mmtm . . . . . 0 C--O 1.26 1.657 0 CA-C-O 117.533 -1.222 . . . . 0.0 110.449 -177.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.263 0 N-CA-C 112.448 -0.261 . . . . 0.0 112.448 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.1 m -139.1 150.99 46.34 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.686 0.279 . . . . 0.0 110.561 -179.418 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -122.35 28.29 5.82 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.897 -0.668 . . . . 0.0 111.975 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 44.8 mttm -130.69 156.04 45.59 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.056 0.455 . . . . 0.0 111.326 -178.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -158.63 139.91 6.59 Favored Glycine 0 N--CA 1.437 -1.262 0 N-CA-C 110.294 -1.122 . . . . 0.0 110.294 177.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -122.48 139.19 54.15 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 117.091 0.445 . . . . 0.0 110.333 -179.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -81.52 -100.33 0.39 Allowed Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.423 -0.894 . . . . 0.0 111.29 178.246 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.453 ' HB2' ' HD2' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -100.43 -93.71 0.28 Allowed 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 120.796 0.332 . . . . 0.0 110.861 178.091 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.453 ' HD2' ' HB2' ' A' ' 8' ' ' GLU . 11.9 mptt -108.03 10.41 28.24 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 176.663 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.645 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 80.9 m -64.23 150.62 45.52 Favored 'General case' 0 N--CA 1.431 -1.408 0 CA-C-N 114.621 -1.172 . . . . 0.0 112.885 -176.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 65.2 p -109.76 -174.1 2.41 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.116 -179.415 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.9 t -67.19 -30.05 69.89 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.673 0.273 . . . . 0.0 110.809 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.87 -49.03 79.11 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 120.751 0.31 . . . . 0.0 110.667 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 42.6 t -64.07 -38.81 92.42 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.151 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 26.6 mtp180 -80.55 18.54 0.92 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.3 m -106.06 159.83 15.77 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 173.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.447 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 19.4 mm-40 -120.09 115.77 32.95 Favored Pre-proline 0 C--N 1.321 -0.661 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.633 -179.577 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.447 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 72.9 Cg_endo -77.61 169.2 74.37 Favored 'Cis proline' 0 C--N 1.346 0.41 0 C-N-CA 123.115 -1.619 . . . . 0.0 111.033 -2.252 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 74.6 m -54.02 122.33 9.91 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.088 0.471 . . . . 0.0 110.646 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 32.3 mm-40 -88.89 16.78 6.39 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.987 -175.167 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.526 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 2.3 m -64.53 -29.73 70.76 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.953 178.343 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 62.97 -138.86 44.35 Favored Glycine 0 N--CA 1.444 -0.802 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.838 -179.082 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.6 m -98.86 12.01 37.05 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 121.028 0.442 . . . . 0.0 110.233 178.387 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -97.51 -53.18 3.52 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.64 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 0.1 OUTLIER 64.84 99.36 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.916 -1.038 . . . . 0.0 112.355 178.23 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -90.65 -14.3 32.57 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.666 -178.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.645 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 31.6 p -87.68 -175.1 5.06 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.029 0.443 . . . . 0.0 111.698 -177.078 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.23 -110.01 0.6 Allowed Glycine 0 N--CA 1.442 -0.915 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.43 179.437 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -160.77 0.0 0.06 Allowed 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -176.132 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -86.76 -6.96 79.17 Favored Glycine 0 C--N 1.301 -1.377 0 C-N-CA 121.077 -0.583 . . . . 0.0 113.719 -175.148 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.503 ' SG ' ' HE2' ' A' ' 37' ' ' LYS . 3.8 p -75.71 -29.67 59.03 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 120.837 0.351 . . . . 0.0 110.917 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 63.6 p 50.06 42.12 24.4 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.492 0.717 . . . . 0.0 112.251 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.429 ' SG ' ' HB2' ' A' ' 31' ' ' CYS . 58.3 m -66.62 177.31 1.62 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.881 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -111.7 -0.27 16.07 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 121.243 0.544 . . . . 0.0 110.222 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.49 -67.23 0.88 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.569 -178.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.64 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 7.9 p -85.05 -13.45 50.37 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.222 0.534 . . . . 0.0 110.942 179.528 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.584 ' NZ ' ' SG ' ' A' ' 27' ' ' CYS . 11.2 mptt -105.71 45.19 0.98 Allowed 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 121.585 0.707 . . . . 0.0 110.982 178.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 8.8 t -91.31 128.44 37.14 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.595 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.9 t -92.27 135.28 34.14 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -89.06 -6.57 57.02 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-O 121.143 0.497 . . . . 0.0 110.704 -178.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.535 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 36.8 m -81.43 133.24 35.38 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.658 178.556 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 74.9 p -109.42 170.73 7.87 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.161 -177.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.9 m -71.75 -9.93 59.02 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.164 0.506 . . . . 0.0 110.403 178.249 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -80.43 -40.36 26.49 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.968 178.252 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -169.18 139.39 5.6 Favored Glycine 0 N--CA 1.437 -1.287 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.767 -179.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 19.1 t -79.97 129.75 34.74 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 120.702 0.287 . . . . 0.0 110.431 179.517 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -87.99 -39.7 14.48 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.331 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.481 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 16.6 p -78.01 -33.13 51.33 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 119.97 -0.692 . . . . 0.0 110.264 -178.313 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 104.72 0.22 42.55 Favored Glycine 0 N--CA 1.438 -1.192 0 C-N-CA 120.79 -0.719 . . . . 0.0 113.262 177.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.481 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 28.5 mmtp -82.4 -1.69 50.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 117.15 0.475 . . . . 0.0 110.991 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 68.88 23.07 6.91 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.44 176.197 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.405 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 1.8 p -70.74 -47.2 60.93 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.919 177.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 47.6 p 51.43 31.63 7.58 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.876 0.87 . . . . 0.0 112.864 177.379 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 159.16 145.84 4.37 Favored Glycine 0 N--CA 1.436 -1.343 0 C-N-CA 120.534 -0.841 . . . . 0.0 111.897 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.56 -30.87 51.53 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.903 2.402 . . . . 0.0 113.302 -177.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -76.16 -17.67 59.45 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.287 0.565 . . . . 0.0 110.485 -178.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.8 m -117.17 18.52 14.51 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.095 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.405 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 0.5 OUTLIER -73.11 130.26 39.89 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.645 -178.523 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -113.65 6.4 16.9 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.616 -177.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -122.9 159.07 29.0 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.754 -177.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -77.33 -164.82 22.88 Favored Glycine 0 C--N 1.332 0.327 0 CA-C-N 115.983 -0.553 . . . . 0.0 113.761 -177.574 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.474 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 4.0 m -85.7 -10.39 55.73 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 122.923 0.489 . . . . 0.0 111.753 -176.644 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.0 m -89.2 13.08 14.12 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.147 0.499 . . . . 0.0 110.353 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 11.5 t -90.68 170.06 10.46 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.355 -178.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.9 p -76.31 -16.18 59.83 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -176.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.546 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 21.6 p -87.15 2.66 49.2 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.988 0.423 . . . . 0.0 110.723 178.497 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.546 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 11.3 mmtp . . . . . 0 C--O 1.265 1.884 0 CA-C-O 117.686 -1.15 . . . . 0.0 110.91 -176.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 N-CA-C 112.354 -0.298 . . . . 0.0 112.354 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 43.0 m -81.81 150.44 27.86 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-O 120.76 0.314 . . . . 0.0 110.418 179.274 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 99.3 5.12 56.11 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.213 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.2 pttm -76.07 132.26 39.98 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.902 0.382 . . . . 0.0 110.562 179.118 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -79.04 83.99 1.26 Allowed Glycine 0 N--CA 1.442 -0.957 0 C-N-CA 121.192 -0.528 . . . . 0.0 112.217 -178.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -92.13 -27.41 17.75 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.648 0.261 . . . . 0.0 110.299 179.037 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 59.61 -117.64 11.86 Favored Glycine 0 CA--C 1.503 -0.71 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.303 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -146.47 137.48 24.26 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 178.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -77.77 -0.75 28.23 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.82 -178.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.682 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 93.6 m -82.09 143.66 31.33 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-O 121.191 0.52 . . . . 0.0 111.522 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 67.1 p -93.52 -179.28 4.98 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.348 -179.526 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.9 m -66.38 -21.39 66.23 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.959 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.57 -45.95 67.5 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-O 120.829 0.347 . . . . 0.0 111.042 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.448 ' HB2' ' HB3' ' A' ' 27' ' ' CYS . 22.6 t -68.1 -31.49 71.13 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.233 0.539 . . . . 0.0 110.226 -179.499 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 31.5 mmt180 -90.57 9.57 28.97 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.007 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.1 t -83.76 169.55 15.1 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.459 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 33.5 mm-40 -119.34 105.69 43.85 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.713 -0.222 . . . . 0.0 111.083 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.459 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 1.6 Cg_endo -83.85 -173.33 10.72 Favored 'Cis proline' 0 N--CA 1.456 -0.685 0 C-N-CA 123.888 -1.297 . . . . 0.0 111.314 -1.769 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 15.1 t -56.42 123.3 14.25 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.015 0.436 . . . . 0.0 110.54 -178.365 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -108.75 20.59 18.31 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.717 -176.349 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.67 -35.74 77.01 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 120.78 0.324 . . . . 0.0 111.205 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.26 -169.97 54.67 Favored Glycine 0 N--CA 1.44 -1.049 0 C-N-CA 121.131 -0.557 . . . . 0.0 112.83 178.191 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 24.5 m -77.53 -11.82 59.9 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.688 0.28 . . . . 0.0 111.301 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -86.55 -31.74 21.07 Favored 'General case' 0 CA--C 1.507 -0.688 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.0 t 66.54 105.83 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.805 -176.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -110.4 28.49 8.59 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.818 -173.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.613 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 9.1 p -124.25 -164.81 1.29 Allowed 'General case' 0 C--N 1.312 -1.062 0 CA-C-O 120.665 0.269 . . . . 0.0 110.555 178.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -114.25 153.95 17.28 Favored Glycine 0 N--CA 1.442 -0.91 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -79.09 84.07 5.11 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.489 0.662 . . . . 0.0 111.269 -176.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -168.82 23.89 0.1 Allowed Glycine 0 C--N 1.301 -1.373 0 N-CA-C 110.634 -0.986 . . . . 0.0 110.634 177.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.72 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 28.6 p -112.95 -21.29 11.19 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.682 -0.259 . . . . 0.0 111.572 -177.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 38.4 p 49.08 39.14 14.39 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.464 0.649 . . . . 0.0 109.951 -173.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.72 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 1.8 t -66.73 149.91 49.85 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.555 -176.81 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -104.52 22.61 14.67 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.148 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -126.17 -58.17 1.37 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.069 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 7.8 p -83.74 -44.45 14.42 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.318 0.58 . . . . 0.0 110.034 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -86.24 82.79 7.9 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.148 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.445 ' O ' ' HD3' ' A' ' 67' ' ' LYS . 14.1 t -142.88 174.28 10.8 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.83 -179.412 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.506 ' SG ' ' HB2' ' A' ' 66' ' ' CYS . 48.7 t -114.01 145.19 41.9 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.1 0.476 . . . . 0.0 110.939 -178.47 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -102.26 -4.79 25.14 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.87 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.622 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 61.7 m -77.98 151.07 33.81 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.798 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 63.2 p -121.23 169.47 10.53 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.453 -178.38 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.49 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 14.4 m -68.97 -27.07 65.39 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.172 0.51 . . . . 0.0 110.574 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -81.17 -34.4 32.4 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.28 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -153.84 131.86 3.38 Favored Glycine 0 N--CA 1.436 -1.304 0 C-N-CA 120.323 -0.942 . . . . 0.0 112.511 -177.184 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 4.4 t -86.27 135.86 33.38 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -93.47 -28.02 16.35 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -176.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 21.7 p -92.97 -30.68 15.23 Favored 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.829 -178.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.5 9.6 52.65 Favored Glycine 0 N--CA 1.444 -0.831 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.883 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -90.64 -4.6 56.68 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.956 0.407 . . . . 0.0 110.303 178.228 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 65.67 26.55 11.46 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.213 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.629 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 4.4 p -66.82 -46.94 73.59 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 176.446 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.49 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 52.0 p 50.78 72.79 0.32 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 114.915 -1.038 . . . . 0.0 113.184 176.051 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 111.96 140.26 8.0 Favored Glycine 0 N--CA 1.444 -0.816 0 C-N-CA 120.713 -0.756 . . . . 0.0 111.876 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.71 -29.61 86.2 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.103 2.536 . . . . 0.0 112.846 -177.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -64.16 -39.23 93.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.979 0.419 . . . . 0.0 111.229 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.6 t -106.16 17.34 23.66 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.288 0.565 . . . . 0.0 109.941 -179.348 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.629 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 19.3 t -86.64 111.01 20.24 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.124 -178.481 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -106.3 -2.5 22.24 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.716 -177.14 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.9 m -71.72 154.63 41.21 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.636 -179.206 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.537 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -74.53 -179.56 41.92 Favored Glycine 0 N--CA 1.443 -0.875 0 C-N-CA 120.477 -0.868 . . . . 0.0 111.258 176.587 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.416 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 6.6 m -80.31 4.28 18.3 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.893 0.377 . . . . 0.0 111.88 -178.177 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.0 m -109.98 12.7 23.62 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.917 0.389 . . . . 0.0 110.587 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 22.2 t -86.59 166.88 15.06 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.559 -178.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.5 m -62.62 -26.52 68.66 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -177.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.622 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 6.1 p -81.18 -6.71 59.15 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.779 0.323 . . . . 0.0 111.8 -178.741 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.537 ' HG3' ' O ' ' A' ' 61' ' ' GLY . 13.2 mmtp . . . . . 0 C--O 1.261 1.659 0 CA-C-O 117.955 -1.021 . . . . 0.0 111.326 -177.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.177 0 N-CA-C 112.553 -0.219 . . . . 0.0 112.553 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.6 t -80.64 -46.24 15.94 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.983 0.421 . . . . 0.0 110.562 -179.135 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 143.09 -172.81 24.44 Favored Glycine 0 N--CA 1.439 -1.147 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.074 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt -93.05 -66.78 0.9 Allowed 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 120.513 0.197 . . . . 0.0 111.249 -178.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.99 109.65 1.91 Allowed Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.858 -0.686 . . . . 0.0 111.665 -179.425 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.46 ' HG2' ' O ' ' A' ' 7' ' ' GLY . 21.2 ttpp -142.79 134.94 27.31 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 120.794 0.33 . . . . 0.0 110.984 -178.136 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLY . . . . . 0.46 ' O ' ' HG2' ' A' ' 6' ' ' LYS . . . -90.07 175.29 41.34 Favored Glycine 0 N--CA 1.438 -1.18 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 175.291 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 17.0 mp0 -59.04 -56.97 15.35 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 116.934 0.367 . . . . 0.0 111.168 178.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? 176.82 -40.48 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.59 ' SG ' ' HB2' ' A' ' 27' ' ' CYS . 88.5 m -57.82 139.81 53.23 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.481 -0.782 . . . . 0.0 111.217 178.721 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.8 p -80.69 174.22 11.83 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.793 -178.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.8 p -61.84 -28.55 69.57 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.126 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.85 -43.45 75.44 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.547 179.179 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.732 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 18.3 t -69.97 -36.33 75.14 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.033 -178.213 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.9 ttt180 -79.84 -9.24 59.64 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.437 -177.664 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.9 t -80.16 161.86 25.02 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.173 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.553 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 9.4 pt-20 -136.31 123.77 14.58 Favored Pre-proline 0 C--N 1.316 -0.886 0 CA-C-O 120.784 0.326 . . . . 0.0 111.437 -179.408 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.553 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 40.6 Cg_endo -64.36 157.9 71.89 Favored 'Cis proline' 0 C--N 1.348 0.525 0 C-N-CA 123.158 -1.601 . . . . 0.0 112.038 0.889 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.664 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 44.4 t -60.9 130.36 46.06 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.948 -177.578 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 78.3 mm-40 -101.94 13.75 33.9 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.897 -177.207 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.732 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -70.45 -16.49 62.94 Favored 'General case' 0 C--O 1.209 -1.043 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.057 -179.314 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.79 -30.26 56.3 Favored Glycine 0 CA--C 1.525 0.664 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.69 -179.243 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 53.1 p -64.64 -48.5 74.61 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -130.49 -46.18 1.08 Allowed 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 120.664 0.269 . . . . 0.0 111.384 -178.104 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.625 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 8.3 t 64.06 82.29 0.19 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.362 -179.713 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -117.51 20.07 13.7 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.491 -177.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.59 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 24.5 p -75.46 163.06 27.79 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.042 178.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -103.12 25.25 27.85 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.183 -1.008 . . . . 0.0 111.549 177.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.411 ' CD ' ' H ' ' A' ' 30' ' ' GLY . 0.0 OUTLIER 66.14 -175.19 0.19 Allowed 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.337 0.655 . . . . 0.0 110.444 -177.676 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.411 ' H ' ' CD ' ' A' ' 29' ' ' GLU . . . 87.28 10.29 71.44 Favored Glycine 0 N--CA 1.434 -1.442 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 -176.371 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.567 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 7.3 p -100.49 -26.45 13.85 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 114.651 -0.775 . . . . 0.0 109.685 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 46.6 p 53.06 36.43 22.18 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.945 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 62.6 m -66.14 167.34 10.22 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.701 179.535 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -117.91 11.87 13.59 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.316 -0.857 . . . . 0.0 108.841 176.48 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.404 ' HB3' ' HB3' ' A' ' 19' ' ' CYS . . . -110.68 -67.74 0.97 Allowed 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.467 -178.442 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.65 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 28.2 p -77.91 -44.62 26.43 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-O 121.368 0.604 . . . . 0.0 109.443 178.677 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.4 ' O ' ' HB ' ' A' ' 38' ' ' THR . 58.4 tttp -84.17 108.64 17.19 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.098 178.301 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.4 ' HB ' ' O ' ' A' ' 37' ' ' LYS . 10.0 t -179.26 164.16 1.34 Allowed 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 178.739 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.6 t -96.21 143.69 27.08 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.001 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -103.17 5.44 37.78 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.892 0.377 . . . . 0.0 111.48 -177.091 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.468 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 60.9 m -85.61 146.7 26.75 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.014 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 60.2 p -120.66 161.52 21.24 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.489 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 35.4 m -63.03 -27.76 69.63 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.091 0.472 . . . . 0.0 110.413 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.93 -36.01 79.42 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.952 178.433 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -164.01 128.98 1.91 Allowed Glycine 0 N--CA 1.437 -1.27 0 C-N-CA 120.351 -0.928 . . . . 0.0 112.73 -179.038 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 6.8 t -79.18 124.41 28.32 Favored 'General case' 0 N--CA 1.439 -1.005 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.519 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.468 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 33.4 mmtp -76.35 -42.82 43.48 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.719 -176.09 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 19.8 p -84.21 -38.3 20.76 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 120.901 0.381 . . . . 0.0 110.749 -177.261 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.12 3.44 27.88 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.819 -0.705 . . . . 0.0 113.107 179.287 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.645 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 73.5 mmtt -81.55 -3.9 54.52 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.981 0.391 . . . . 0.0 111.008 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 65.34 24.98 12.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.962 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.496 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.3 p -71.7 -47.63 52.75 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 176.806 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.489 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 82.5 p 51.94 28.92 5.56 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 115.135 -0.939 . . . . 0.0 113.472 175.511 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 164.09 140.77 2.95 Favored Glycine 0 N--CA 1.436 -1.325 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -56.36 -37.31 97.24 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.976 2.451 . . . . 0.0 113.532 -177.467 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -67.4 -40.88 85.66 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.848 0.356 . . . . 0.0 111.019 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 40.7 m -94.37 15.34 17.86 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.601 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.496 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 24.5 t -85.4 135.07 34.03 Favored 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.15 -179.082 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -113.15 -6.28 13.66 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.218 -179.21 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.645 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 13.9 m -77.52 157.51 30.36 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.836 -178.185 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -86.05 -108.99 0.76 Allowed Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.377 -179.024 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.2 m -135.16 -2.39 2.54 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 120.543 0.211 . . . . 0.0 111.414 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 18.6 m -106.27 5.11 29.47 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.941 0.401 . . . . 0.0 111.457 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 29.9 t -82.8 167.0 18.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.333 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.7 t -70.61 -16.33 62.83 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.798 -177.245 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.438 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 24.7 p -88.72 2.11 53.95 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.366 -0.533 . . . . 0.0 111.322 179.396 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 25.2 mmtp . . . . . 0 C--O 1.261 1.704 0 CA-C-O 117.67 -1.157 . . . . 0.0 110.866 -179.107 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.942 0 N-CA-C 112.563 -0.215 . . . . 0.0 112.563 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.2 m -96.35 -3.24 44.14 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.059 0.457 . . . . 0.0 110.992 -179.112 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 115.44 119.96 3.3 Favored Glycine 0 N--CA 1.44 -1.04 0 N-CA-C 111.087 -0.805 . . . . 0.0 111.087 -178.166 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.9 mtmt -70.74 84.9 0.65 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.377 0.608 . . . . 0.0 111.366 -178.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -162.02 25.22 0.23 Allowed Glycine 0 N--CA 1.442 -0.908 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.367 178.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -77.32 -21.15 53.89 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 121.254 0.549 . . . . 0.0 110.013 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -67.06 148.17 50.06 Favored Glycine 0 N--CA 1.432 -1.629 0 CA-C-N 115.243 -0.889 . . . . 0.0 112.037 179.136 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -66.97 -43.59 82.7 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 179.308 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt 58.81 31.02 20.82 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.197 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.571 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 91.5 m -85.65 152.87 22.76 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-O 121.371 0.605 . . . . 0.0 111.838 -179.591 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 81.3 p -92.02 176.27 6.57 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.81 -177.379 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.9 m -67.16 -21.73 65.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.148 0.499 . . . . 0.0 110.079 178.449 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.0 -47.56 36.26 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.32 178.712 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.649 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 10.2 t -66.44 -33.56 75.97 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.382 0.611 . . . . 0.0 109.667 179.478 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.7 mmt180 -91.22 21.27 4.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.844 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.6 t -94.45 -178.55 4.61 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 178.517 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.435 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 7.0 pt-20 -131.09 101.93 16.18 Favored Pre-proline 0 CA--C 1.543 0.687 0 CA-C-O 120.709 0.29 . . . . 0.0 111.292 -178.448 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.435 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 87.9 Cg_endo -81.41 -174.94 14.79 Favored 'Cis proline' 0 N--CA 1.461 -0.416 0 C-N-CA 123.625 -1.406 . . . . 0.0 111.072 -0.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.731 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 48.6 t -59.49 127.9 34.35 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.038 0.447 . . . . 0.0 110.829 -179.653 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -112.04 17.62 19.46 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 -179.344 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.731 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 0.5 OUTLIER -64.86 -23.15 67.15 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.348 -177.341 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.71 -12.04 9.18 Favored Glycine 0 CA--C 1.528 0.883 0 C-N-CA 121.303 -0.475 . . . . 0.0 113.723 -177.712 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.4 m -68.6 -35.58 77.53 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 122.727 -0.278 . . . . 0.0 110.992 179.078 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 69.3 mttm -146.19 -43.28 0.2 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 122.899 0.48 . . . . 0.0 110.323 178.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.666 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 10.5 t 67.24 74.12 0.32 Allowed 'General case' 0 CA--C 1.504 -0.8 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.051 -179.133 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -104.82 10.55 34.44 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 114.572 -1.195 . . . . 0.0 110.84 -175.327 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.552 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 21.0 p -75.75 -178.71 4.36 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.155 0.502 . . . . 0.0 111.072 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.92 -141.36 10.57 Favored Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 115.789 -0.642 . . . . 0.0 111.915 177.382 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.461 ' HA ' ' HE2' ' A' ' 37' ' ' LYS . 8.2 mp0 -123.77 13.65 9.28 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.168 0.508 . . . . 0.0 110.734 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -84.48 -30.79 26.43 Favored Glycine 0 C--N 1.306 -1.112 0 C-N-CA 120.819 -0.705 . . . . 0.0 113.183 -177.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.795 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 20.3 p -67.96 -34.13 75.97 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -176.288 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 58.9 p 53.1 33.7 15.64 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.8 0.809 . . . . 0.0 109.994 -173.237 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.795 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -62.56 117.04 5.68 Favored 'General case' 0 C--O 1.222 -0.365 0 CA-C-N 114.276 -1.329 . . . . 0.0 110.37 -178.655 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -86.11 20.25 2.37 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.385 0.612 . . . . 0.0 110.831 -177.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -109.42 -48.92 3.17 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.029 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.63 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 26.2 p -94.24 -41.5 9.44 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.569 177.673 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.589 ' HG3' ' SG ' ' A' ' 36' ' ' CYS . 26.3 mtpp -99.26 88.86 4.03 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.837 -178.508 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 12.3 t -144.83 172.2 13.35 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.738 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.481 ' HA ' ' O ' ' A' ' 66' ' ' CYS . 35.8 t -92.17 133.9 35.36 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -83.9 -17.7 39.89 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.155 0.502 . . . . 0.0 110.224 -177.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.431 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 37.4 m -69.57 136.34 51.17 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.001 -176.294 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 82.3 p -99.64 166.26 11.21 Favored 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 178.106 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.484 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 46.9 m -64.03 -26.79 68.72 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.922 0.392 . . . . 0.0 111.8 -178.858 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -88.47 -30.7 19.2 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.717 -179.531 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -143.34 119.29 1.32 Allowed Glycine 0 N--CA 1.445 -0.753 0 C-N-CA 119.784 -1.198 . . . . 0.0 113.697 -175.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.412 ' HA ' ' HB3' ' A' ' 41' ' ' CYS . 17.5 t -78.07 126.99 31.62 Favored 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 177.419 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.431 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 3.2 mmmp? -82.05 -36.57 27.56 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -176.696 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.508 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 21.5 p -91.95 -37.93 12.56 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.897 -177.474 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.2 11.36 13.74 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 120.739 -0.743 . . . . 0.0 113.816 178.505 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.755 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 32.4 mmtp -88.23 -3.2 58.9 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 117.331 0.565 . . . . 0.0 110.985 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 65.61 17.49 10.92 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.139 -177.738 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.56 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.2 p -64.57 -47.29 79.26 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 177.698 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.484 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 53.2 p 49.88 44.54 25.23 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.189 -0.914 . . . . 0.0 113.063 174.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.435 ' O ' ' HB2' ' A' ' 58' ' ' CYS . . . 135.1 150.28 6.02 Favored Glycine 0 N--CA 1.438 -1.206 0 C-N-CA 120.624 -0.798 . . . . 0.0 111.587 179.738 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -61.81 -22.53 74.56 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.845 2.363 . . . . 0.0 112.559 -177.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -63.12 -52.56 62.07 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.645 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.1 m -104.12 20.73 17.74 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.788 -177.602 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.56 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 48.8 t -86.91 137.58 32.26 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-O 121.213 0.53 . . . . 0.0 111.229 -178.499 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -118.67 3.26 11.71 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.569 -179.069 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.755 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 5.5 m -91.15 117.43 29.61 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 -179.664 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -97.56 82.4 0.69 Allowed Glycine 0 C--N 1.303 -1.257 0 CA-C-N 115.517 -0.765 . . . . 0.0 112.578 -175.006 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.448 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 50.8 m 63.77 170.28 0.16 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.016 0.526 . . . . 0.0 111.386 -178.429 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.4 m 70.87 -25.16 0.17 Allowed 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 176.554 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 38.0 t -72.05 167.73 19.58 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 121.919 -0.488 . . . . 0.0 111.288 -176.255 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 32.3 t -62.59 -27.44 69.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.592 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.481 ' O ' ' HA ' ' A' ' 39' ' ' CYS . 32.1 p -85.87 8.44 20.16 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.018 179.56 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.448 ' HD2' ' H ' ' A' ' 62' ' ' SER . 1.0 OUTLIER . . . . . 0 C--O 1.262 1.727 0 CA-C-O 118.037 -0.982 . . . . 0.0 111.064 -178.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.188 0 N-CA-C 112.317 -0.313 . . . . 0.0 112.317 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.9 m -135.83 115.15 12.54 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.759 0.314 . . . . 0.0 110.682 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -105.17 -76.73 1.08 Allowed Glycine 0 N--CA 1.443 -0.847 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 177.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -162.15 154.46 19.38 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 177.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -145.92 167.69 27.69 Favored Glycine 0 N--CA 1.441 -1.023 0 C-N-CA 120.559 -0.829 . . . . 0.0 111.816 -179.623 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp -125.87 178.87 5.47 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -104.4 -175.91 25.16 Favored Glycine 0 N--CA 1.44 -1.052 0 C-N-CA 120.58 -0.819 . . . . 0.0 111.4 178.725 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -83.41 117.52 23.1 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 121.095 0.474 . . . . 0.0 110.471 179.014 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -73.93 -13.64 60.92 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.246 -177.434 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.594 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 57.4 m -88.49 145.04 25.98 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-O 121.298 0.57 . . . . 0.0 112.27 -176.367 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.3 p -77.16 176.05 9.09 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.775 -178.15 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.8 m -62.45 -32.8 73.73 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.135 178.49 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.9 -52.22 64.97 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.271 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.669 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 43.5 t -67.15 -28.67 68.31 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.571 0.7 . . . . 0.0 110.81 -179.366 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.1 ttm180 -79.66 -5.13 54.49 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.371 -177.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.9 m -85.44 167.48 15.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.086 0.47 . . . . 0.0 111.924 -177.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.441 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 76.6 mm-40 -127.59 108.72 20.78 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.683 177.442 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.441 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 73.2 Cg_endo -76.15 169.67 73.86 Favored 'Cis proline' 0 C--O 1.237 0.458 0 C-N-CA 123.457 -1.476 . . . . 0.0 112.157 0.055 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.669 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 41.7 t -61.03 140.36 57.86 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.004 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 -117.28 19.81 13.95 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.296 -177.121 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.614 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.1 OUTLIER -67.46 -31.25 71.29 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.981 0.419 . . . . 0.0 109.922 179.899 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 72.58 -168.03 53.18 Favored Glycine 0 N--CA 1.442 -0.924 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.633 178.828 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.8 p -80.22 -11.98 59.68 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.825 0.345 . . . . 0.0 110.675 178.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -77.51 -42.08 36.92 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 178.336 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 8.7 t 65.53 99.22 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.516 -1.22 . . . . 0.0 111.296 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -100.83 -0.8 36.32 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.375 -0.829 . . . . 0.0 112.513 -176.085 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.594 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 7.3 p -91.94 164.13 13.76 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 120.837 0.351 . . . . 0.0 111.677 -176.408 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -86.21 148.33 22.17 Favored Glycine 0 N--CA 1.441 -1.014 0 N-CA-C 109.101 -1.6 . . . . 0.0 109.101 172.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -77.72 89.57 3.99 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 117.769 0.785 . . . . 0.0 112.163 -174.035 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -158.17 25.25 0.4 Allowed Glycine 0 N--CA 1.435 -1.383 0 N-CA-C 110.022 -1.231 . . . . 0.0 110.022 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.606 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 26.2 p -115.12 -28.73 6.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.143 -0.528 . . . . 0.0 112.121 -175.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 57.4 p 54.27 29.07 10.07 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.4 0.619 . . . . 0.0 110.015 -171.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.606 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 2.1 t -57.64 140.25 51.62 Favored 'General case' 0 C--N 1.346 0.453 0 CA-C-N 114.744 -1.116 . . . . 0.0 110.273 -177.744 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -93.8 16.8 13.24 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 120.922 0.391 . . . . 0.0 111.171 -176.592 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -116.53 -57.02 2.23 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.561 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.614 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 6.1 p -89.41 -43.15 11.08 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.717 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -84.39 74.21 10.39 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 121.683 0.754 . . . . 0.0 109.825 178.097 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.9 t -125.77 149.74 48.32 Favored 'General case' 0 N--CA 1.431 -1.412 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.988 -179.24 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.1 t -100.58 128.99 46.46 Favored 'General case' 0 N--CA 1.442 -0.869 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 177.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -90.99 -1.52 57.81 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.487 -178.471 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.566 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 61.6 m -75.93 136.68 40.07 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.637 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 61.0 p -102.74 165.01 11.3 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.091 -178.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.1 m -71.23 -10.35 59.61 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.182 0.515 . . . . 0.0 110.356 177.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -89.86 -32.31 16.95 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.745 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -164.71 132.82 2.79 Favored Glycine 0 N--CA 1.435 -1.399 0 C-N-CA 120.796 -0.716 . . . . 0.0 111.991 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 4.7 t -72.73 136.37 45.51 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 179.383 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.44 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 75.8 mmtt -95.97 -22.35 17.45 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 111.938 0.348 . . . . 0.0 111.938 -176.13 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.479 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 21.8 p -99.69 -39.97 8.0 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.499 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.65 3.62 25.24 Favored Glycine 0 N--CA 1.437 -1.258 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.948 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.479 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 46.3 mmtm -81.37 -6.04 58.5 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 120.964 0.411 . . . . 0.0 110.251 178.318 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 68.94 20.91 7.71 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.664 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.525 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 4.7 p -71.2 -41.57 70.11 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.418 178.756 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.1 p 52.93 29.48 7.89 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.857 0.863 . . . . 0.0 113.297 177.609 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 149.32 159.18 8.46 Favored Glycine 0 N--CA 1.44 -1.1 0 C-N-CA 119.887 -1.149 . . . . 0.0 112.838 178.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.429 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 58.0 Cg_endo -69.64 -11.95 32.09 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 123.113 2.542 . . . . 0.0 112.779 -178.229 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -84.08 -10.07 58.11 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.029 0.442 . . . . 0.0 110.835 -178.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.8 m -142.58 26.36 1.77 Allowed 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.146 0.498 . . . . 0.0 110.112 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.525 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 0.5 OUTLIER -71.11 122.76 20.69 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.998 -177.919 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -100.05 4.28 44.59 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.936 -178.334 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.445 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.2 p -137.91 157.45 46.38 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.05 -174.353 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -150.15 171.89 30.05 Favored Glycine 0 N--CA 1.439 -1.101 0 C-N-CA 120.022 -1.085 . . . . 0.0 113.563 -178.472 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.5 m 63.53 -84.79 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 124.489 1.116 . . . . 0.0 113.855 177.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.2 m -117.4 66.33 0.73 Allowed 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -174.355 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 41.3 t -112.84 166.61 11.22 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 173.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.447 ' HB2' ' HA ' ' A' ' 48' ' ' CYS . 7.4 m -64.61 -9.39 19.05 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 122.719 0.407 . . . . 0.0 112.028 -177.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.566 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 25.0 p -104.62 -11.02 17.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.722 0.296 . . . . 0.0 111.227 177.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.415 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 3.5 mmpp? . . . . . 0 C--O 1.251 1.164 0 CA-C-O 117.317 -1.325 . . . . 0.0 110.156 -178.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.393 0 N-CA-C 112.329 -0.309 . . . . 0.0 112.329 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.8 t -114.56 -0.13 13.79 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.946 0.403 . . . . 0.0 110.658 -179.262 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 124.73 138.6 5.09 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.676 -0.773 . . . . 0.0 111.946 -179.549 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.458 ' HE2' ' O ' ' A' ' 30' ' ' GLY . 14.3 mptt -98.92 140.41 33.12 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.014 0.435 . . . . 0.0 111.457 -179.323 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -91.2 -26.38 21.52 Favored Glycine 0 N--CA 1.44 -1.05 0 N-CA-C 109.898 -1.281 . . . . 0.0 109.898 174.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -79.32 130.05 35.06 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 115.049 -0.576 . . . . 0.0 110.334 177.771 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -82.0 86.33 1.43 Allowed Glycine 0 N--CA 1.433 -1.5 0 C-N-CA 120.714 -0.755 . . . . 0.0 111.454 178.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 63.3 mm-40 -65.38 -88.53 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.73 0.3 . . . . 0.0 111.0 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 42.7 mtmt -153.51 50.53 0.7 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.251 0.548 . . . . 0.0 110.202 179.516 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.477 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 85.6 m -98.68 130.91 45.19 Favored 'General case' 0 C--N 1.301 -1.503 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.003 178.065 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.6 p -76.35 178.09 6.79 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.085 0.469 . . . . 0.0 111.871 -176.252 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.517 ' HA ' ' HG2' ' A' ' 15' ' ' ARG . 16.6 m -57.37 -33.23 67.58 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.143 -179.867 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.5 -44.86 81.44 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.331 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.405 ' HB3' ' HB3' ' A' ' 10' ' ' CYS . 37.4 t -69.97 -34.49 73.46 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.096 0.474 . . . . 0.0 111.208 -177.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.517 ' HG2' ' HA ' ' A' ' 12' ' ' SER . 9.2 ptm85 -78.36 -6.81 56.24 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.519 -0.472 . . . . 0.0 111.475 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.3 m -79.5 153.43 29.58 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 179.41 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -126.41 119.75 23.29 Favored Pre-proline 0 C--N 1.312 -1.028 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.295 179.393 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -69.61 160.89 86.83 Favored 'Cis proline' 0 C--O 1.243 0.748 0 C-N-CA 123.438 -1.484 . . . . 0.0 111.966 -0.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -51.82 130.78 29.77 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.935 -177.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -105.52 8.7 33.49 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.602 -177.229 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.418 ' HB3' ' CB ' ' A' ' 36' ' ' CYS . 0.1 OUTLIER -62.02 -35.89 79.91 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.846 0.355 . . . . 0.0 110.635 179.944 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 62.12 -135.83 45.8 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.792 178.339 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.0 m -100.18 -6.75 25.66 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 120.648 0.261 . . . . 0.0 111.061 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -79.03 -45.3 20.47 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 178.263 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER 58.47 91.96 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.643 177.314 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -88.74 -12.96 40.74 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.908 -175.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.477 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 30.6 p -79.07 159.67 27.44 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.513 -0.475 . . . . 0.0 111.548 -177.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -87.45 -155.4 28.28 Favored Glycine 0 N--CA 1.448 -0.527 0 CA-C-N 115.913 -0.585 . . . . 0.0 112.673 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -83.21 157.89 22.53 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.962 0.411 . . . . 0.0 111.15 -178.347 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.458 ' O ' ' HE2' ' A' ' 4' ' ' LYS . . . 94.38 9.58 58.96 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.386 178.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.455 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 17.1 t -97.35 -61.64 1.37 Allowed 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.805 -179.401 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 81.6 p 49.41 39.09 15.64 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.239 0.616 . . . . 0.0 111.661 -177.612 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.455 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -54.73 147.73 14.2 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.723 178.921 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -85.58 28.44 0.76 Allowed 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.616 0.722 . . . . 0.0 110.205 -178.374 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -140.51 -61.06 0.51 Allowed 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.457 -179.048 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.418 ' CB ' ' HB3' ' A' ' 21' ' ' CYS . 20.7 p -88.27 -40.41 13.66 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -177.785 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.1 ttmt -116.75 53.99 0.87 Allowed 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.281 0.562 . . . . 0.0 111.741 -172.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.473 ' O ' ' HD3' ' A' ' 67' ' ' LYS . 13.9 t -121.5 179.32 4.48 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.772 178.512 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 35.1 t -93.52 156.89 16.48 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.2 0.524 . . . . 0.0 111.061 -178.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -117.33 0.18 12.16 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.481 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.456 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 69.1 m -80.6 149.48 29.87 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.118 179.289 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 68.0 p -118.87 168.52 10.69 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.346 -178.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.6 m -65.81 -25.73 67.36 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.221 0.534 . . . . 0.0 110.278 178.834 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -72.38 -36.24 68.67 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.361 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -166.65 135.47 3.69 Favored Glycine 0 N--CA 1.433 -1.535 0 C-N-CA 120.205 -0.997 . . . . 0.0 112.75 -178.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 5.1 t -77.6 124.64 28.19 Favored 'General case' 0 C--N 1.313 -1.02 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 177.749 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -84.35 -29.4 26.31 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -176.043 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.508 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 20.2 p -89.91 -39.88 12.74 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 120.191 -0.603 . . . . 0.0 110.273 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.99 0.34 30.14 Favored Glycine 0 N--CA 1.443 -0.877 0 C-N-CA 120.913 -0.66 . . . . 0.0 112.762 178.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.508 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 30.0 mmtp -81.31 -0.26 40.2 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.292 0.568 . . . . 0.0 110.188 179.43 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 64.41 36.57 8.86 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 114.647 -1.161 . . . . 0.0 112.131 176.166 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.487 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 0.8 OUTLIER -81.4 -46.61 14.38 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.088 176.271 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 48.2 p 52.94 34.65 17.28 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 177.197 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.484 ' O ' ' HB2' ' A' ' 58' ' ' CYS . . . 166.21 161.6 15.67 Favored Glycine 0 N--CA 1.425 -2.034 0 C-N-CA 120.339 -0.934 . . . . 0.0 111.653 178.341 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -75.55 -44.47 0.3 Allowed 'Trans proline' 0 N--CA 1.46 -0.451 0 C-N-CA 122.679 2.252 . . . . 0.0 112.683 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -77.38 -16.32 58.92 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.162 0.506 . . . . 0.0 110.553 -178.199 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 40.1 m -106.6 13.03 28.74 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.481 177.348 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.487 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 47.1 t -86.69 135.54 33.36 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.552 -179.277 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 32.0 mtmt -109.39 -7.85 15.15 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.04 -178.612 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 34.5 m -77.47 157.32 30.52 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.166 -177.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -90.59 -85.2 1.39 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.971 -0.633 . . . . 0.0 113.368 -178.168 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 54.3 p -147.42 -30.14 0.33 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -177.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 35.8 m -92.4 47.16 1.29 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.102 0.477 . . . . 0.0 111.637 -177.589 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 16.1 t -124.22 165.23 17.98 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 178.033 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 8.8 m -66.62 -19.7 65.83 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.885 -177.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.456 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 27.7 p -93.72 22.09 5.85 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.811 0.338 . . . . 0.0 111.03 -179.413 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.473 ' HD3' ' O ' ' A' ' 38' ' ' THR . 36.2 mmtm . . . . . 0 C--O 1.262 1.711 0 CA-C-O 117.285 -1.34 . . . . 0.0 110.598 -178.905 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.282 0 N-CA-C 112.227 -0.349 . . . . 0.0 112.227 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.2 m -66.8 -47.69 71.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.832 0.349 . . . . 0.0 111.05 -179.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -88.83 68.54 2.8 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.313 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.589 ' HD2' ' H ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -82.44 158.11 23.39 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.674 0.273 . . . . 0.0 110.51 179.806 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -88.32 145.08 18.85 Favored Glycine 0 N--CA 1.44 -1.053 0 C-N-CA 120.662 -0.78 . . . . 0.0 111.563 179.696 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . 0.458 ' HB2' ' NZ ' ' A' ' 6' ' ' LYS . 8.3 mtmp? -119.16 0.44 11.23 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.124 0.487 . . . . 0.0 110.636 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -147.42 148.35 19.86 Favored Glycine 0 N--CA 1.442 -0.91 0 N-CA-C 111.352 -0.699 . . . . 0.0 111.352 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -112.04 -118.85 0.3 Allowed 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 120.788 0.328 . . . . 0.0 111.875 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -95.02 34.73 1.34 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.817 -175.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.639 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 87.9 m -98.47 139.1 34.71 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 120.985 0.421 . . . . 0.0 111.722 179.414 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.2 p -89.66 -178.33 5.51 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.618 -179.382 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.3 m -64.33 -28.66 69.86 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.804 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.0 -44.86 91.38 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.882 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.557 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 48.9 t -77.21 -31.23 55.1 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.662 -179.747 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.658 ' HA ' ' NE ' ' A' ' 15' ' ' ARG . 1.8 mmp_? -74.25 -9.17 58.34 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.129 -0.487 . . . . 0.0 112.178 -179.839 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 52.7 m -88.23 159.28 18.2 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 177.076 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.434 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 43.3 mt-10 -126.54 119.13 22.98 Favored Pre-proline 0 C--N 1.309 -1.191 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.434 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 5.1 Cg_exo -77.09 -178.19 23.4 Favored 'Cis proline' 0 C--N 1.348 0.529 0 C-N-CA 123.191 -1.587 . . . . 0.0 112.126 1.518 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.5 m -65.57 139.62 58.46 Favored 'General case' 0 CA--C 1.503 -0.861 0 CA-C-O 121.535 0.683 . . . . 0.0 111.941 -178.298 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 -114.26 15.75 18.06 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.835 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.63 ' HB3' ' HA ' ' A' ' 25' ' ' CYS . 1.9 m -63.08 -31.53 72.69 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.843 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 72.17 -148.19 42.23 Favored Glycine 0 N--CA 1.438 -1.21 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.791 177.393 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.5 m -88.42 -18.53 28.14 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-O 120.922 0.391 . . . . 0.0 110.082 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -77.66 -48.19 17.39 Favored 'General case' 0 CA--C 1.499 -1.0 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.943 -179.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.63 ' HA ' ' HB3' ' A' ' 21' ' ' CYS . 1.3 t 72.42 98.17 0.07 Allowed 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 114.614 -1.175 . . . . 0.0 110.119 -176.773 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -80.69 -24.04 39.15 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.771 -1.104 . . . . 0.0 112.544 -175.563 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.639 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 18.6 p -79.28 156.23 28.17 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 119.929 -0.709 . . . . 0.0 110.477 -179.704 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -83.95 -66.77 1.47 Allowed Glycine 0 N--CA 1.433 -1.508 0 C-N-CA 120.215 -0.993 . . . . 0.0 111.442 179.315 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -169.88 168.16 8.87 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 -178.221 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 101.93 32.45 5.02 Favored Glycine 0 N--CA 1.441 -0.983 0 C-N-CA 120.579 -0.819 . . . . 0.0 113.557 177.261 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.412 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 30.1 p -139.72 -37.58 0.49 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 117.323 0.561 . . . . 0.0 111.767 178.093 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 46.3 p 49.65 46.43 23.74 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 121.226 0.536 . . . . 0.0 111.285 -178.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 68.4 m -63.98 168.66 4.99 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.781 -179.025 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.413 ' HA ' ' HB ' ' A' ' 38' ' ' THR . . . -102.82 16.81 25.49 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.443 177.58 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -124.85 -70.34 0.76 Allowed 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.698 -178.158 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.616 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 29.4 p -86.49 -38.65 17.05 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.222 0.534 . . . . 0.0 111.637 -178.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.08 41.03 1.54 Allowed 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.514 -173.857 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.413 ' HB ' ' HA ' ' A' ' 34' ' ' ALA . 7.8 t -114.67 163.27 15.68 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.488 -175.793 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 51.3 t -109.07 140.64 42.34 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 176.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -98.76 3.6 47.57 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 120.704 0.288 . . . . 0.0 111.498 -177.44 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.541 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 85.0 m -80.02 164.25 23.58 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-O 120.928 0.394 . . . . 0.0 110.954 178.751 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 29.7 p -131.22 162.47 29.9 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.516 -179.136 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.9 m -69.37 -22.18 63.75 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.948 0.404 . . . . 0.0 110.922 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -86.63 -2.24 58.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.388 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 169.65 128.52 1.02 Allowed Glycine 0 N--CA 1.44 -1.08 0 C-N-CA 120.301 -0.952 . . . . 0.0 112.529 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.8 t -78.59 128.08 33.02 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.541 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 32.1 mmmt -87.82 -30.5 20.17 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -175.117 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.449 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 19.6 p -88.79 -36.79 15.88 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.285 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 110.66 -0.51 29.06 Favored Glycine 0 N--CA 1.442 -0.923 0 C-N-CA 120.833 -0.699 . . . . 0.0 113.056 178.196 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.449 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 72.2 mmtt -80.24 -2.05 43.32 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 117.065 0.432 . . . . 0.0 110.907 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 67.88 21.93 8.85 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.131 177.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.518 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 3.0 p -72.54 -44.88 61.54 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.18 178.01 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 67.2 p 53.49 26.51 5.6 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.988 0.915 . . . . 0.0 113.114 176.526 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.46 ' O ' ' HB2' ' A' ' 58' ' ' CYS . . . 158.09 160.59 10.35 Favored Glycine 0 N--CA 1.439 -1.149 0 C-N-CA 120.76 -0.734 . . . . 0.0 111.335 -179.527 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.406 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 45.9 Cg_endo -69.04 -12.27 33.84 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.667 2.245 . . . . 0.0 113.533 -177.402 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -79.41 -50.73 10.36 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.864 0.364 . . . . 0.0 111.084 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 24.1 t -90.78 7.75 38.17 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 120.953 0.406 . . . . 0.0 110.1 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.518 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 4.5 t -70.13 109.49 4.63 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.82 179.719 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -110.28 1.42 18.56 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.452 -177.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.2 p -98.08 152.06 19.72 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.663 178.475 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.45 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -67.31 -177.6 10.12 Favored Glycine 0 CA--C 1.523 0.554 0 CA-C-N 116.082 -0.508 . . . . 0.0 114.239 -175.851 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 20.1 m -82.14 6.22 17.18 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 123.074 0.55 . . . . 0.0 111.76 -177.429 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.9 m -107.52 11.3 28.88 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.961 0.41 . . . . 0.0 110.34 178.645 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' CYS . . . . . 0.486 ' SG ' ' N ' ' A' ' 65' ' ' SER . 53.4 t -84.38 173.93 10.51 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.954 -179.288 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.486 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 8.9 m -64.82 -31.85 73.27 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.426 -179.163 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.548 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 26.0 p -81.6 10.63 5.67 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-O 120.843 0.354 . . . . 0.0 111.233 -179.288 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.548 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 15.0 mmtp . . . . . 0 C--O 1.266 1.934 0 CA-C-O 117.88 -1.057 . . . . 0.0 110.828 -177.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.446 0 N-CA-C 112.267 -0.333 . . . . 0.0 112.267 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.0 m -139.62 115.29 10.06 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.613 0.244 . . . . 0.0 110.35 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -163.9 38.07 0.31 Allowed Glycine 0 N--CA 1.446 -0.692 0 C-N-CA 120.584 -0.817 . . . . 0.0 112.446 179.241 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.593 ' H ' ' HD3' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -70.77 141.25 51.44 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 179.389 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -145.11 13.29 1.88 Allowed Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 119.946 -1.121 . . . . 0.0 113.285 -177.718 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -78.42 135.81 37.5 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.721 0.296 . . . . 0.0 110.4 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -128.74 134.35 8.01 Favored Glycine 0 N--CA 1.439 -1.117 0 C-N-CA 120.789 -0.719 . . . . 0.0 111.613 178.856 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.419 ' CD ' HH22 ' A' ' 15' ' ' ARG . 26.2 mt-10 -66.54 -33.32 75.41 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 122.354 0.262 . . . . 0.0 110.855 -179.02 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.469 ' HB2' ' HA3' ' A' ' 28' ' ' GLY . 31.5 mmmt 66.69 14.35 9.73 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.759 179.283 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.604 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 91.5 m -77.08 130.93 38.05 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 121.288 0.566 . . . . 0.0 112.16 -178.7 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 35.8 p -87.19 177.57 7.14 Favored 'General case' 0 N--CA 1.431 -1.393 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.253 -179.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.5 m -58.98 -27.02 64.99 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.753 -179.52 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.34 -45.0 77.68 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 120.856 0.36 . . . . 0.0 110.814 178.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.644 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 5.4 t -78.07 -26.0 47.97 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.065 0.46 . . . . 0.0 110.534 -178.84 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.419 HH22 ' CD ' ' A' ' 8' ' ' GLU . 32.7 mmt180 -74.66 -17.88 60.62 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.052 179.076 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.3 t -62.6 159.64 15.57 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.61 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.456 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 37.5 mt-10 -132.32 107.07 13.38 Favored Pre-proline 0 C--N 1.308 -1.2 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.887 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.456 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 73.1 Cg_endo -74.18 170.96 69.41 Favored 'Cis proline' 0 C--O 1.243 0.732 0 C-N-CA 123.517 -1.451 . . . . 0.0 112.476 0.106 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.632 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 21.5 t -55.98 143.67 31.36 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.867 -178.688 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -120.79 15.24 11.77 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.468 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.644 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 0.5 OUTLIER -70.8 -4.01 21.81 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.054 0.454 . . . . 0.0 110.94 179.535 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.77 -15.37 73.6 Favored Glycine 0 CA--C 1.521 0.454 0 C-N-CA 121.158 -0.544 . . . . 0.0 112.583 178.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 t -73.18 -47.51 43.12 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.649 -0.324 . . . . 0.0 110.76 179.376 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -140.91 -43.57 0.39 Allowed 'General case' 0 C--O 1.237 0.43 0 CA-C-N 116.66 -0.245 . . . . 0.0 111.247 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 16.0 t 74.02 100.84 0.07 Allowed 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.99 0.806 . . . . 0.0 110.988 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -125.52 13.14 8.12 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.894 -177.709 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.604 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 15.1 p -84.11 -175.53 5.84 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.254 0.549 . . . . 0.0 110.858 -178.204 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.469 ' HA3' ' HB2' ' A' ' 9' ' ' LYS . . . -88.59 130.92 10.39 Favored Glycine 0 N--CA 1.425 -2.085 0 N-CA-C 109.431 -1.468 . . . . 0.0 109.431 173.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.0 18.82 0.08 Allowed 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -176.249 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLY . . . . . 0.442 ' H ' ' C ' ' A' ' 28' ' ' GLY . . . -110.63 11.13 30.33 Favored Glycine 0 N--CA 1.436 -1.356 0 N-CA-C 111.151 -0.78 . . . . 0.0 111.151 177.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.839 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 15.4 p -80.49 -15.44 56.72 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 120.644 0.259 . . . . 0.0 110.415 179.552 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 82.8 p 57.34 26.53 12.54 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.868 0.867 . . . . 0.0 111.627 -177.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.839 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 6.6 t -62.86 127.9 33.38 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.822 179.615 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -92.15 32.18 1.19 Allowed 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.393 -177.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -128.65 -50.71 1.26 Allowed 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.174 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.496 ' CB ' ' HB3' ' A' ' 21' ' ' CYS . 25.3 p -98.09 -39.56 8.85 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.112 179.649 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -84.55 115.57 22.67 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-O 121.107 0.479 . . . . 0.0 110.891 -179.254 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.0 t -177.76 -178.34 0.71 Allowed 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 178.569 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -98.23 135.05 40.42 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 109.524 -0.546 . . . . 0.0 109.524 177.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -86.71 -6.01 58.96 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.208 -178.573 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.434 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 59.9 m -80.63 135.18 36.0 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.769 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 71.5 p -105.87 172.68 6.67 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.618 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 34.0 p -75.12 -10.0 59.07 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.167 0.508 . . . . 0.0 110.197 178.018 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -76.36 -40.99 49.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.971 177.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -169.01 136.96 4.3 Favored Glycine 0 N--CA 1.431 -1.659 0 C-N-CA 120.887 -0.673 . . . . 0.0 111.824 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 17.8 t -69.32 128.18 35.68 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.434 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 10.8 mmpt? -82.23 -40.03 22.21 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 -177.345 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.514 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 19.2 p -86.99 -36.5 18.21 Favored 'General case' 0 C--N 1.318 -0.804 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.908 -177.877 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 106.72 15.16 17.57 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.185 178.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.514 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 74.4 mmtt -94.75 1.59 55.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.954 0.407 . . . . 0.0 110.54 178.294 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 62.4 33.38 16.33 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.09 178.757 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.586 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.4 p -82.6 -47.35 12.19 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.985 177.407 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.3 p 52.69 37.74 24.39 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.942 0.897 . . . . 0.0 113.131 176.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 141.56 157.31 7.12 Favored Glycine 0 N--CA 1.437 -1.284 0 C-N-CA 120.161 -1.019 . . . . 0.0 112.302 178.784 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -61.24 -27.07 83.02 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.874 2.383 . . . . 0.0 112.709 -178.413 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -62.19 -54.58 38.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.84 0.352 . . . . 0.0 111.219 -179.549 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.7 m -99.69 20.12 14.65 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.291 -178.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.586 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 4.5 t -74.32 105.55 5.54 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-O 121.059 0.457 . . . . 0.0 110.514 -179.169 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -83.33 -22.05 33.0 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.92 -177.679 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.2 p -93.02 133.38 36.22 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 120.678 -0.409 . . . . 0.0 109.987 179.182 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -120.71 114.97 2.77 Favored Glycine 0 N--CA 1.439 -1.143 0 C-N-CA 120.602 -0.808 . . . . 0.0 112.126 -175.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.437 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 63.7 m 64.13 163.89 0.13 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 122.941 0.497 . . . . 0.0 112.163 -179.57 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.5 m 66.88 -24.37 0.11 Allowed 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 174.469 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 37.9 t -73.41 163.72 27.66 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 118.273 0.488 . . . . 0.0 111.414 -177.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.0 p -66.21 -26.7 67.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.03 -0.532 . . . . 0.0 112.048 -178.223 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.43 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 30.4 p -81.08 0.39 36.24 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.71 178.808 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.437 ' HD2' ' H ' ' A' ' 62' ' ' SER . 5.2 mmpp? . . . . . 0 C--O 1.262 1.743 0 CA-C-O 118.249 -0.882 . . . . 0.0 110.494 -179.588 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.223 0 N-CA-C 112.385 -0.286 . . . . 0.0 112.385 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.0 m -74.96 113.82 12.72 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.665 0.269 . . . . 0.0 110.368 179.801 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 79.54 73.54 1.13 Allowed Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.867 178.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -101.52 -178.24 3.67 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-O 120.818 0.342 . . . . 0.0 110.669 178.579 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 132.65 -29.39 3.27 Favored Glycine 0 N--CA 1.439 -1.113 0 C-N-CA 120.67 -0.776 . . . . 0.0 111.643 -178.627 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -115.71 107.15 14.72 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.922 0.391 . . . . 0.0 111.049 179.024 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -122.77 -8.25 6.91 Favored Glycine 0 CA--C 1.499 -0.934 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.109 178.793 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.5 mp0 -117.17 147.23 42.64 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 50.3 mtpt -100.14 29.88 4.07 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.49 178.42 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.567 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 67.8 m -122.07 160.77 24.32 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.742 -177.064 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 20.9 p -85.63 174.06 9.69 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.222 -179.018 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.7 m -57.61 -36.78 72.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.337 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.92 -46.06 89.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.416 -179.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.488 ' HB3' ' HB3' ' A' ' 10' ' ' CYS . 26.4 t -68.96 -30.29 68.7 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.101 0.477 . . . . 0.0 110.005 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 28.5 mmm180 -78.35 -2.82 40.05 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.551 178.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.8 m -84.06 165.57 18.43 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.664 0.269 . . . . 0.0 110.766 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -133.2 116.63 14.36 Favored Pre-proline 0 C--N 1.318 -0.767 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.164 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -70.81 173.29 48.99 Favored 'Cis proline' 0 C--O 1.235 0.327 0 C-N-CA 123.153 -1.603 . . . . 0.0 112.253 0.327 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.7 t -57.23 116.55 3.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.362 -178.306 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -102.39 13.56 34.26 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.001 0.429 . . . . 0.0 111.108 -176.381 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.684 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 4.7 t -70.4 -20.36 62.94 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.595 -179.41 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 59.02 -152.62 32.18 Favored Glycine 0 C--N 1.343 0.964 0 CA-C-N 115.284 -0.871 . . . . 0.0 113.04 177.834 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 67.1 m -95.69 -3.58 45.78 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-O 120.658 0.266 . . . . 0.0 110.464 177.638 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -71.6 -44.25 64.77 Favored 'General case' 0 CA--C 1.495 -1.136 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 176.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.661 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 4.8 t 55.58 92.82 0.03 OUTLIER 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 114.415 -1.266 . . . . 0.0 112.625 174.648 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -102.88 3.61 36.75 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.352 -179.492 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.493 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 29.1 p -87.89 174.92 8.05 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.697 179.292 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -98.07 -102.97 2.26 Favored Glycine 0 N--CA 1.44 -1.093 0 C-N-CA 120.607 -0.806 . . . . 0.0 111.359 178.04 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -139.66 161.73 36.83 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.435 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.89 28.05 7.57 Favored Glycine 0 N--CA 1.436 -1.344 0 C-N-CA 120.353 -0.927 . . . . 0.0 112.928 178.206 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.567 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 15.0 p -115.63 -23.89 8.53 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 117.044 0.422 . . . . 0.0 110.225 177.831 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 38.6 p 51.49 36.05 15.89 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.59 0.756 . . . . 0.0 112.281 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 74.2 m -75.21 171.9 13.35 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 121.083 0.468 . . . . 0.0 110.904 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -135.4 9.5 3.44 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 175.393 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.32 -58.87 1.8 Allowed 'General case' 0 CA--C 1.507 -0.69 0 CA-C-N 114.801 -1.09 . . . . 0.0 109.943 -178.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.684 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 31.8 p -86.41 -47.36 9.39 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -95.38 92.07 6.53 Favored 'General case' 0 N--CA 1.424 -1.756 0 CA-C-N 114.754 -1.112 . . . . 0.0 109.549 177.216 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.8 t -137.36 162.18 34.28 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 13.1 t -107.31 133.28 52.09 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 120.932 0.396 . . . . 0.0 110.057 -179.328 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -89.95 -6.32 55.8 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.16 0.505 . . . . 0.0 110.38 -177.714 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 38.0 m -79.3 145.1 33.68 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.97 -177.439 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 64.9 p -115.09 170.0 8.69 Favored 'General case' 0 N--CA 1.438 -1.058 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 178.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.444 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 2.8 p -73.62 -11.01 60.29 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.06 0.457 . . . . 0.0 111.151 178.914 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -90.59 -33.05 16.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.838 179.198 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -158.45 127.25 1.84 Allowed Glycine 0 N--CA 1.434 -1.499 0 C-N-CA 120.348 -0.929 . . . . 0.0 112.364 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 6.7 t -76.09 134.72 39.96 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.078 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp -96.15 -16.53 21.45 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -175.059 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.412 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 32.1 p -103.1 -39.34 6.92 Favored 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.277 178.8 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.36 5.34 26.48 Favored Glycine 0 N--CA 1.438 -1.176 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.74 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.412 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 75.1 mmtt -84.74 -2.25 57.36 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 120.935 0.398 . . . . 0.0 110.455 178.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 63.68 24.11 13.77 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.052 0.941 . . . . 0.0 111.179 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.488 ' O ' ' HB2' ' A' ' 57' ' ' SER . 3.9 p -70.77 -43.65 68.32 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 178.397 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.444 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 64.3 p 51.26 39.9 24.93 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.808 0.843 . . . . 0.0 112.899 176.842 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 145.04 149.37 5.01 Favored Glycine 0 N--CA 1.439 -1.162 0 C-N-CA 120.255 -0.974 . . . . 0.0 112.071 179.085 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -61.98 -26.13 78.4 Favored 'Trans proline' 0 CA--C 1.532 0.395 0 C-N-CA 123.021 2.481 . . . . 0.0 112.758 -177.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -71.28 -24.04 62.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.398 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.488 ' HB2' ' O ' ' A' ' 52' ' ' CYS . 23.6 m -119.14 15.99 13.22 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.226 0.536 . . . . 0.0 110.04 179.322 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.432 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 13.3 t -83.44 106.07 14.9 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.734 -176.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -95.8 -13.32 24.16 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.224 -177.544 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.2 p -89.58 148.93 23.08 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.915 -179.219 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -79.52 -167.08 33.65 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.934 -0.651 . . . . 0.0 113.837 -175.773 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.462 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 16.1 m -73.31 -13.45 61.12 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 123.299 0.64 . . . . 0.0 111.792 -177.567 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 45.4 m -86.62 18.37 3.4 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.777 0.323 . . . . 0.0 111.158 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 13.0 t -100.06 172.19 7.35 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 178.442 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 25.2 m -81.43 -11.04 59.38 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -176.745 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.422 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 25.9 p -93.29 15.97 14.32 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.835 0.35 . . . . 0.0 110.789 179.373 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.462 ' HG3' ' HA ' ' A' ' 62' ' ' SER . 9.0 mmtp . . . . . 0 C--O 1.263 1.782 0 CA-C-O 118.006 -0.997 . . . . 0.0 111.117 -177.389 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.305 0 N-CA-C 112.357 -0.297 . . . . 0.0 112.357 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.6 m -81.15 -2.2 47.55 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 120.957 0.408 . . . . 0.0 111.315 -179.03 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -71.11 -30.72 67.22 Favored Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 120.917 -0.659 . . . . 0.0 112.25 179.151 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 50.6 tptt 63.69 25.65 14.29 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.741 0.781 . . . . 0.0 110.461 179.157 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 145.18 -51.88 0.6 Allowed Glycine 0 N--CA 1.438 -1.172 0 N-CA-C 110.856 -0.897 . . . . 0.0 110.856 -179.669 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.9 mttp -119.19 114.31 22.24 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 120.664 0.269 . . . . 0.0 110.672 178.71 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -82.46 145.8 24.31 Favored Glycine 0 N--CA 1.441 -1.005 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 178.499 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 64.02 99.9 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.137 0.494 . . . . 0.0 110.634 -178.24 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -76.38 -2.3 31.19 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.423 -178.409 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.544 ' HB3' ' HB3' ' A' ' 14' ' ' CYS . 57.3 m -79.58 148.74 31.62 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.336 178.857 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.1 t -85.5 171.3 11.87 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.058 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.6 m -53.54 -32.08 49.12 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 123.205 0.602 . . . . 0.0 111.194 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.8 -45.35 94.24 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.429 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.712 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 29.4 t -75.23 -24.81 57.75 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.446 0.641 . . . . 0.0 110.256 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 77.5 mtp180 -84.62 4.99 29.76 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.72 -178.768 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.8 m -106.73 162.75 13.5 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.685 0.278 . . . . 0.0 110.725 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -126.87 117.98 22.34 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.184 178.206 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -74.1 178.06 35.24 Favored 'Cis proline' 0 C--O 1.239 0.553 0 C-N-CA 123.144 -1.607 . . . . 0.0 112.155 0.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.443 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 21.1 t -69.9 136.53 50.74 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.76 -176.996 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -112.36 6.91 19.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.49 -177.274 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.712 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 4.8 m -75.11 -11.2 60.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.661 0.267 . . . . 0.0 111.636 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.81 69.11 2.69 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.979 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.3 t -174.3 -61.72 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -115.13 -46.45 2.9 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.872 -0.603 . . . . 0.0 109.666 177.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 21' ' ' CYS . 38.3 t 60.96 100.41 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.163 -0.926 . . . . 0.0 112.466 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -100.56 23.78 9.89 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.212 178.824 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -63.27 148.29 48.64 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.94 178.322 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.27 163.09 37.23 Favored Glycine 0 N--CA 1.433 -1.549 0 N-CA-C 109.759 -1.336 . . . . 0.0 109.759 172.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -70.97 114.36 8.94 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 117.247 0.523 . . . . 0.0 110.09 -177.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 132.92 24.54 0.72 Allowed Glycine 0 N--CA 1.436 -1.321 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.269 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.413 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 45.9 t -91.68 146.42 23.79 Favored 'General case' 0 N--CA 1.439 -0.975 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 178.52 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.7 p -123.44 30.67 6.19 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.314 -179.112 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.413 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 21.0 t -68.76 163.9 23.03 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.258 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -117.17 25.27 10.59 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.022 0.439 . . . . 0.0 110.246 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -127.6 -59.42 1.21 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.439 -178.409 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 7.1 p -86.45 -39.58 16.19 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.007 0.432 . . . . 0.0 111.022 -179.186 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.2 tmtp? -104.21 91.68 4.03 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.025 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.6 t -173.96 -175.83 1.11 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.936 -179.049 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 39.2 t -113.82 137.44 51.65 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.916 0.388 . . . . 0.0 110.327 178.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 32.1 m-80 -93.97 -0.29 55.65 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.87 -178.387 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.499 ' HB3' ' HA ' ' A' ' 53' ' ' THR . 81.7 m -78.7 156.5 28.92 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.124 0.487 . . . . 0.0 111.525 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.3 p -137.81 169.55 17.59 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.261 178.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.0 m -67.9 -18.19 64.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.223 0.535 . . . . 0.0 110.469 178.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -68.22 -37.27 80.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.489 177.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -175.0 133.24 2.4 Favored Glycine 0 N--CA 1.434 -1.474 0 C-N-CA 120.85 -0.69 . . . . 0.0 111.912 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 4.8 t -72.63 116.29 12.93 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 178.272 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -74.43 -33.59 62.99 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.583 -174.247 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.561 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 28.2 p -86.8 -43.82 12.21 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.054 -0.659 . . . . 0.0 110.073 179.822 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.81 4.8 26.07 Favored Glycine 0 N--CA 1.436 -1.309 0 CA-C-N 115.74 -0.664 . . . . 0.0 112.432 -179.324 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.561 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 46.1 mmtm -79.51 -5.36 54.68 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.249 0.547 . . . . 0.0 109.696 177.694 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 68.76 30.41 4.86 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 114.772 -1.104 . . . . 0.0 110.884 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.508 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 5.3 p -80.3 -39.45 28.73 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.288 177.441 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.499 ' HA ' ' HB3' ' A' ' 41' ' ' CYS . 39.0 p 51.97 33.42 11.74 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 177.254 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 145.77 150.45 5.21 Favored Glycine 0 N--CA 1.441 -1.033 0 C-N-CA 120.168 -1.015 . . . . 0.0 112.268 178.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -55.98 -28.04 66.91 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.307 2.671 . . . . 0.0 113.407 -178.578 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -66.89 -34.44 77.8 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.759 0.314 . . . . 0.0 111.625 -178.701 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.471 ' HB2' ' O ' ' A' ' 52' ' ' CYS . 19.2 m -111.97 13.15 20.79 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.286 0.565 . . . . 0.0 110.264 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.508 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 28.0 t -78.42 119.53 21.86 Favored 'General case' 0 N--CA 1.438 -1.04 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.842 -179.208 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -115.77 1.11 13.38 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.584 -178.141 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.484 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 0.6 OUTLIER -97.2 110.01 22.65 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 176.864 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -99.11 114.66 5.09 Favored Glycine 0 CA--C 1.491 -1.422 0 C-N-CA 120.993 -0.623 . . . . 0.0 112.639 -173.589 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.505 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 43.6 t 61.89 161.63 0.07 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.065 0.546 . . . . 0.0 111.424 -179.057 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 19.1 t 73.14 -32.77 0.25 Allowed 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 175.214 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 33.3 t -67.98 162.75 23.71 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 119.736 -0.786 . . . . 0.0 111.801 -176.703 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.4 t -68.75 -21.75 64.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.832 -177.38 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.499 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 29.3 p -86.24 0.31 54.06 Favored 'General case' 0 C--O 1.219 -0.52 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.976 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.505 ' HD2' ' H ' ' A' ' 62' ' ' SER . 0.1 OUTLIER . . . . . 0 C--O 1.261 1.671 0 CA-C-O 117.998 -1.001 . . . . 0.0 111.051 -179.029 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.31 0 N-CA-C 112.479 -0.249 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 65.6 p 49.24 79.09 0.08 Allowed 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.467 0.707 . . . . 0.0 112.004 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -101.69 163.69 17.52 Favored Glycine 0 N--CA 1.44 -1.08 0 C-N-CA 120.644 -0.789 . . . . 0.0 111.779 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.402 ' N ' ' HD2' ' A' ' 4' ' ' LYS . 0.3 OUTLIER -91.81 97.35 10.93 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 179.258 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -112.71 65.25 0.26 Allowed Glycine 0 N--CA 1.441 -1.012 0 C-N-CA 120.414 -0.898 . . . . 0.0 112.414 -178.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -93.25 163.85 13.46 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.822 0.344 . . . . 0.0 110.632 179.039 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 162.77 70.0 0.02 OUTLIER Glycine 0 N--CA 1.443 -0.874 0 C-N-CA 121.028 -0.606 . . . . 0.0 111.597 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -81.77 -81.45 0.14 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.973 0.416 . . . . 0.0 110.818 -178.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -131.63 29.48 4.5 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.026 -179.393 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.537 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 6.0 m -95.82 164.7 12.63 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-O 121.892 0.853 . . . . 0.0 112.726 -179.558 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.492 HG21 ' HB2' ' A' ' 26' ' ' GLN . 1.4 t -100.85 161.21 13.75 Favored 'General case' 0 N--CA 1.43 -1.453 0 CA-C-N 114.26 -1.336 . . . . 0.0 108.672 176.176 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.0 t -58.4 -30.62 66.99 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.94 0.4 . . . . 0.0 110.477 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.83 -35.01 79.07 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.124 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 10.4 t -86.44 -30.23 22.22 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.329 -176.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 42.2 ttp180 -77.38 -8.09 57.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.049 0.452 . . . . 0.0 110.281 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.9 t -89.26 161.84 16.19 Favored 'General case' 0 N--CA 1.435 -1.205 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 177.411 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.46 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 45.0 mt-10 -128.53 129.14 23.56 Favored Pre-proline 0 C--N 1.307 -1.259 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 -179.161 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.46 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 56.0 Cg_endo -68.5 173.16 40.85 Favored 'Cis proline' 0 C--N 1.348 0.52 0 C-N-CA 123.55 -1.438 . . . . 0.0 113.099 1.802 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.0 t -62.69 115.73 4.57 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.957 -178.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -107.2 14.43 26.19 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.079 -177.537 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.642 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 4.5 t -68.47 -20.7 64.63 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 179.068 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 61.86 -154.04 40.33 Favored Glycine 0 C--N 1.339 0.713 0 CA-C-N 115.076 -0.965 . . . . 0.0 114.411 174.568 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.6 m -89.81 -10.22 46.26 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.343 -0.429 . . . . 0.0 110.194 179.475 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -76.0 -40.01 54.62 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 177.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.632 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 10.9 t 56.33 86.61 0.06 Allowed 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.61 176.721 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.492 ' HB2' HG21 ' A' ' 11' ' ' THR . 11.2 mm100 -89.74 -7.04 55.39 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.489 -177.79 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.537 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 14.6 p -85.19 162.17 19.31 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-O 121.089 0.471 . . . . 0.0 110.676 -179.812 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.83 -159.59 35.5 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.698 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.5 mp0 -78.69 168.91 19.06 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.817 0.342 . . . . 0.0 110.396 179.784 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 87.21 -0.99 86.18 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.659 178.779 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 32.0 t -84.55 -48.56 9.43 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 122.768 -0.254 . . . . 0.0 111.356 -179.357 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 60.4 p 53.0 43.31 31.9 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.587 0.755 . . . . 0.0 112.401 -179.383 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.92 165.12 20.64 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.424 178.181 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -113.35 11.14 18.5 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.29 0.567 . . . . 0.0 110.051 179.141 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -117.46 -64.43 1.3 Allowed 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.608 -179.501 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.642 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 25.5 p -74.43 -42.92 58.34 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-O 121.134 0.492 . . . . 0.0 109.701 178.337 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.456 ' NZ ' ' SG ' ' A' ' 27' ' ' CYS . 14.0 mptt -83.76 87.6 7.07 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.027 176.068 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.5 t -142.21 154.76 45.05 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.64 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.428 ' H ' ' HB3' ' A' ' 55' ' ' PRO . 44.2 t -89.07 136.16 33.17 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -92.22 -3.75 55.1 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.116 -178.207 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 62.3 m -77.98 141.47 38.93 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.502 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 62.8 p -102.76 164.84 11.4 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.965 -177.182 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.4 m -67.93 -31.59 71.45 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.919 0.39 . . . . 0.0 110.681 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -71.67 -34.11 69.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.986 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -163.69 136.52 4.3 Favored Glycine 0 N--CA 1.435 -1.422 0 C-N-CA 120.284 -0.96 . . . . 0.0 112.705 -178.54 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 37.2 t -73.0 147.81 44.8 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 177.808 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.44 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 8.3 mtpm? -112.05 -19.6 12.26 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -177.789 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.435 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 17.4 p -96.99 -37.71 10.07 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 119.993 -0.683 . . . . 0.0 110.793 -179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.66 0.43 17.88 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.618 -0.801 . . . . 0.0 113.306 178.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.799 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 73.9 mmtt -84.6 -9.17 58.54 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 117.078 0.439 . . . . 0.0 110.703 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 66.4 27.94 9.81 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.16 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.582 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 0.8 OUTLIER -71.16 -47.46 57.58 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.312 178.197 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.5 p 55.89 35.99 26.47 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.182 0.993 . . . . 0.0 113.332 176.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 150.46 149.52 5.05 Favored Glycine 0 C--O 1.218 -0.899 0 C-N-CA 120.012 -1.09 . . . . 0.0 112.252 178.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.493 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 50.5 Cg_endo -70.82 -23.24 26.21 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.875 2.383 . . . . 0.0 113.068 -178.451 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -82.68 -21.21 34.99 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.212 0.53 . . . . 0.0 109.878 -178.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.8 m -121.77 22.86 10.36 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.546 179.097 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.582 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 8.2 t -75.34 142.29 43.21 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.116 -177.508 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 45.1 mtpt -110.7 1.38 17.87 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.496 -176.552 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.799 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 4.7 m -101.17 143.88 30.73 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.798 -177.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -110.03 70.84 0.21 Allowed Glycine 0 CA--C 1.507 -0.45 0 N-CA-C 111.23 -0.748 . . . . 0.0 111.23 -178.621 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.6 t 60.59 -179.61 0.1 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.205 0.602 . . . . 0.0 110.323 -177.037 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.7 m 62.92 -0.28 0.61 Allowed 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 177.732 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 36.2 t -93.77 162.68 13.83 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.285 178.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 51.0 m -70.1 -12.02 61.3 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -177.26 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.661 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 24.8 p -86.91 0.34 55.2 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 120.027 -0.669 . . . . 0.0 110.531 177.024 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.661 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 23.5 mmtp . . . . . 0 C--O 1.25 1.123 0 CA-C-O 117.767 -1.111 . . . . 0.0 110.532 -179.552 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 N-CA-C 112.254 -0.338 . . . . 0.0 112.254 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.4 m -87.86 -34.23 18.27 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.176 0.513 . . . . 0.0 110.443 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 115.82 157.29 11.21 Favored Glycine 0 N--CA 1.438 -1.207 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 -178.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.9 pttt -154.65 18.47 0.46 Allowed 'General case' 0 C--N 1.312 -1.027 0 CA-C-O 120.959 0.409 . . . . 0.0 110.861 -178.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -167.63 -86.6 0.06 OUTLIER Glycine 0 N--CA 1.444 -0.808 0 C-N-CA 120.826 -0.702 . . . . 0.0 111.623 -179.424 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt 59.17 91.58 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.279 0.631 . . . . 0.0 112.679 178.849 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -104.41 -75.41 1.03 Allowed Glycine 0 N--CA 1.444 -0.813 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 176.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 58.23 101.36 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.879 0.872 . . . . 0.0 113.23 176.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 60.8 mttm -90.57 4.07 52.29 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.992 179.206 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.566 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 60.4 m -99.97 163.65 12.35 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.371 0.605 . . . . 0.0 112.603 -176.167 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.8 p -100.02 175.5 5.74 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.657 -178.453 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.4 m -62.16 -31.52 72.02 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.22 179.235 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.0 -44.07 81.3 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 120.919 0.39 . . . . 0.0 110.536 179.431 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 41.9 t -70.89 -43.07 69.13 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.93 -178.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.437 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 40.6 ttt180 -79.17 3.45 17.67 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.025 0.441 . . . . 0.0 111.307 -178.741 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.5 t -73.33 165.0 25.88 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 178.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.454 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 6.5 mm-40 -119.77 105.78 42.69 Favored Pre-proline 0 C--N 1.312 -1.05 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -179.121 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PRO . . . . . 0.454 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 93.3 Cg_endo -82.45 -177.02 17.89 Favored 'Cis proline' 0 C--N 1.352 0.715 0 C-N-CA 124.026 -1.239 . . . . 0.0 111.939 -0.456 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 37.5 t -61.62 129.68 42.25 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 120.949 0.404 . . . . 0.0 111.179 -177.634 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 76.4 mm-40 -114.58 13.61 17.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.575 -178.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.629 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 1.8 t -68.68 -31.77 71.12 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -179.574 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 60.3 -162.4 18.94 Favored Glycine 0 C--N 1.34 0.759 0 CA-C-N 115.091 -0.959 . . . . 0.0 114.627 175.087 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.0 m -76.49 -7.23 54.71 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 120.97 0.414 . . . . 0.0 110.818 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -78.53 -45.02 22.89 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 177.399 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.528 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 5.0 t 59.99 95.25 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.877 176.465 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -102.56 2.03 35.68 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.668 -178.255 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.566 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 14.8 p -90.49 -158.69 0.56 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.202 0.525 . . . . 0.0 111.298 -178.318 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -140.86 157.18 25.79 Favored Glycine 0 N--CA 1.438 -1.204 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 177.761 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -59.71 93.99 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.517 0.675 . . . . 0.0 112.055 -177.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -165.53 6.44 0.06 OUTLIER Glycine 0 N--CA 1.434 -1.445 0 N-CA-C 110.574 -1.011 . . . . 0.0 110.574 179.003 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.49 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 31.7 p -120.22 178.2 4.73 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.03 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.3 p -129.09 33.21 4.61 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 121.306 0.574 . . . . 0.0 110.538 -178.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 83.4 m -63.35 146.83 52.71 Favored 'General case' 0 CA--C 1.506 -0.727 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -177.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.549 ' C ' ' HB ' ' A' ' 38' ' ' THR . . . -114.95 21.67 14.09 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-N 114.069 -1.423 . . . . 0.0 107.254 173.698 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -113.48 -63.28 1.47 Allowed 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.702 -1.135 . . . . 0.0 110.476 -178.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.629 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 29.2 p -89.19 -45.66 9.39 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 121.588 0.708 . . . . 0.0 109.845 179.044 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.415 ' HG3' ' OG ' ' A' ' 62' ' ' SER . 2.0 ttpm? -95.97 44.81 1.07 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.059 -178.255 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.549 ' HB ' ' C ' ' A' ' 34' ' ' ALA . 14.1 t -100.91 142.07 32.91 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.731 -178.867 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.5 t -80.53 137.17 36.4 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.655 178.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -106.54 7.28 30.73 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 120.919 0.39 . . . . 0.0 111.308 -178.372 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' CYS . . . . . 0.573 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 85.2 m -80.91 133.28 35.53 Favored 'General case' 0 N--CA 1.435 -1.188 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.181 178.791 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 55.8 p -88.61 156.34 19.1 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.583 -177.567 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.433 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 14.5 m -65.18 -29.73 70.58 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.645 0.736 . . . . 0.0 109.133 176.606 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -65.24 -42.77 93.01 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.696 -1.138 . . . . 0.0 110.744 178.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -159.88 135.77 4.26 Favored Glycine 0 N--CA 1.44 -1.083 0 C-N-CA 121.048 -0.596 . . . . 0.0 111.906 -178.229 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 12.7 t -71.89 147.98 46.55 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -108.02 -31.74 7.84 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -177.407 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.462 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 20.7 p -89.75 -39.03 13.41 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.136 -0.625 . . . . 0.0 111.416 -177.61 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 118.48 -5.13 14.98 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.495 -0.859 . . . . 0.0 112.885 -179.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.675 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 74.0 mmtt -76.22 -13.42 60.17 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 120.8 0.333 . . . . 0.0 110.604 179.171 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 71.3 28.07 3.05 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.704 -179.766 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' CYS . . . . . 0.534 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.8 p -74.33 -43.88 54.8 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.268 178.587 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.433 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 55.0 p 54.03 31.96 14.64 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.087 0.955 . . . . 0.0 113.106 177.574 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 144.01 154.77 6.22 Favored Glycine 0 N--CA 1.442 -0.922 0 C-N-CA 120.353 -0.927 . . . . 0.0 112.299 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -60.47 -28.46 86.76 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.02 2.48 . . . . 0.0 112.677 -177.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -63.05 -29.29 70.7 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.104 -178.666 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 13.6 t -126.48 22.75 6.98 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.471 -178.643 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.534 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 17.8 t -82.71 137.0 34.57 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.078 0.466 . . . . 0.0 110.871 -178.798 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -117.31 10.54 13.74 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.157 -178.471 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.675 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 2.6 m -102.01 156.3 17.63 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.154 -176.028 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -85.58 -115.68 0.83 Allowed Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 121.002 -0.618 . . . . 0.0 112.8 -178.643 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' SER . . . . . 0.415 ' OG ' ' HG3' ' A' ' 37' ' ' LYS . 14.9 m -123.49 -13.46 7.56 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 120.832 0.349 . . . . 0.0 111.073 -177.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 58.3 m -107.33 24.24 13.17 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -177.744 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' CYS . . . . . 0.42 ' SG ' ' N ' ' A' ' 65' ' ' SER . 42.4 t -93.3 171.98 8.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 177.537 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.42 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 19.4 m -67.33 -23.01 65.58 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -177.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.573 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 20.6 p -90.9 4.65 51.31 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.794 -0.362 . . . . 0.0 111.647 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.416 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 22.1 mmtp . . . . . 0 C--O 1.26 1.626 0 CA-C-O 117.574 -1.203 . . . . 0.0 110.676 -178.76 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 92.7 mttt . . . . . 0 N--CA 1.451 -0.413 0 CA-C-O 121.454 0.645 . . . . 0.0 109.479 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.559 ' SG ' ' HB2' ' A' ' 27' ' ' CYS . 76.4 m -85.34 150.46 24.73 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.093 -178.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.9 t -81.22 166.94 20.13 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.565 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.2 m -54.52 -39.09 67.28 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.589 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.69 -45.62 89.07 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.253 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.633 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 44.6 t -69.38 -34.08 74.01 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.226 0.536 . . . . 0.0 110.373 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 77.5 mtp180 -84.46 14.82 4.13 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.716 -0.675 . . . . 0.0 112.043 -178.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.6 m -100.99 164.39 11.84 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.557 0.218 . . . . 0.0 110.636 178.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.436 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 11.4 mp0 -121.49 110.85 33.62 Favored Pre-proline 0 C--N 1.327 -0.384 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 177.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.436 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 91.0 Cg_endo -78.23 172.12 63.14 Favored 'Cis proline' 0 C--O 1.237 0.47 0 C-N-CA 123.72 -1.367 . . . . 0.0 111.74 0.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.647 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 43.3 t -62.34 134.62 56.73 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 121.127 0.489 . . . . 0.0 110.571 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -113.34 23.78 12.91 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.933 -178.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.68 ' SG ' ' HA ' ' A' ' 25' ' ' CYS . 0.7 OUTLIER -73.97 -25.7 60.08 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 -178.908 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 59.45 -145.06 45.22 Favored Glycine 0 N--CA 1.443 -0.889 0 CA-C-N 115.172 -0.922 . . . . 0.0 113.24 177.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -95.03 -9.9 32.45 Favored 'General case' 0 N--CA 1.438 -1.038 0 CA-C-O 120.92 0.39 . . . . 0.0 110.164 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.439 ' CE ' ' HA ' ' A' ' 24' ' ' LYS . 5.4 mmpt? -72.94 -42.05 63.83 Favored 'General case' 0 CA--C 1.511 -0.555 0 N-CA-C 109.244 -0.651 . . . . 0.0 109.244 178.338 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.68 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 2.6 t 53.83 79.42 0.13 Allowed 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.861 175.05 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -99.91 16.67 23.06 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.749 -178.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.559 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 23.9 p -87.63 -163.57 0.96 Allowed 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.48 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -111.83 153.04 17.54 Favored Glycine 0 N--CA 1.441 -0.998 0 C-N-CA 120.554 -0.832 . . . . 0.0 112.485 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -71.98 120.2 17.23 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 120.807 0.337 . . . . 0.0 110.324 178.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 135.79 -3.35 3.83 Favored Glycine 0 N--CA 1.441 -1.021 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.601 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.551 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 9.1 p -89.31 -31.92 17.6 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.698 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 42.9 p 50.87 38.81 20.97 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.229 0.611 . . . . 0.0 111.306 -176.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.551 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 6.9 t -59.72 136.12 57.9 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.011 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.01 23.52 0.7 Allowed 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -174.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -125.7 -50.8 1.6 Allowed 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.134 0.493 . . . . 0.0 110.117 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.616 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 3.2 p -94.73 -43.1 8.41 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.621 179.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.439 ' HE3' ' OG ' ' A' ' 62' ' ' SER . 13.4 mptt -83.53 63.08 7.16 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.468 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.4 t -112.2 175.62 5.36 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.574 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 43.2 t -134.27 135.66 43.04 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -100.95 7.66 43.46 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.484 -175.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.487 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 62.8 m -82.85 134.87 35.08 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.637 178.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 53.2 p -101.91 167.91 9.76 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.165 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.3 m -69.75 -20.36 63.5 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.016 0.436 . . . . 0.0 110.289 178.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -74.64 -38.33 62.54 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.621 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -164.53 135.31 3.69 Favored Glycine 0 N--CA 1.428 -1.864 0 C-N-CA 120.455 -0.879 . . . . 0.0 112.285 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.2 t -73.23 129.55 38.29 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 179.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.487 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 75.1 mmtt -86.74 -25.51 24.67 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 112.068 0.395 . . . . 0.0 112.068 -176.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.449 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 19.1 p -97.77 -36.58 10.17 Favored 'General case' 0 C--N 1.313 -1.007 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.345 179.226 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 107.7 5.28 33.87 Favored Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.974 178.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.449 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 74.9 mmtt -83.96 -2.2 56.09 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-O 121.019 0.438 . . . . 0.0 110.542 178.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 67.16 23.91 9.41 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.721 177.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.433 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 1.7 p -73.78 -45.68 50.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.94 177.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 46.0 p 52.75 33.67 14.55 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.036 0.934 . . . . 0.0 113.375 176.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 156.74 144.13 3.85 Favored Glycine 0 N--CA 1.441 -1.032 0 C-N-CA 120.25 -0.976 . . . . 0.0 112.047 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.406 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 24.3 Cg_endo -63.18 -36.51 57.39 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.653 2.236 . . . . 0.0 112.406 -178.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -69.23 -14.93 63.24 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.938 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.6 m -125.47 22.56 7.66 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.038 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.433 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 4.6 t -83.33 137.98 33.73 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.298 -177.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 86.1 mttt -123.93 -4.83 8.02 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.384 -176.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.6 p -103.94 156.3 17.96 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 120.934 0.397 . . . . 0.0 111.911 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -71.34 -177.04 25.66 Favored Glycine 0 CA--C 1.52 0.361 0 CA-C-N 115.759 -0.655 . . . . 0.0 114.263 -176.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.465 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 41.3 m -78.21 -10.27 59.58 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -176.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 30.6 m -89.63 19.19 4.78 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.067 0.461 . . . . 0.0 110.365 178.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 29.6 t -96.97 166.44 11.61 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.825 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 49.3 m -66.32 -29.66 69.9 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -177.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.532 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 25.2 p -80.34 4.65 17.18 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.795 0.331 . . . . 0.0 111.383 -178.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.532 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 9.9 mmtp . . . . . 0 C--O 1.264 1.854 0 CA-C-O 117.939 -1.029 . . . . 0.0 110.832 -177.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt . . . . . 0 C--O 1.227 -0.098 0 CA-C-O 120.995 0.426 . . . . 0.0 110.929 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.718 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 96.3 m -92.36 139.71 30.32 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-O 121.387 0.613 . . . . 0.0 111.932 -179.302 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 80.9 p -93.26 179.51 5.39 Favored 'General case' 0 N--CA 1.429 -1.479 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.459 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.1 m -64.23 -26.03 68.33 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.234 -178.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.43 -44.22 83.51 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.828 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.524 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 42.4 t -75.12 -32.87 61.49 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.231 0.539 . . . . 0.0 110.977 -179.12 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 36.4 ttm-85 -80.36 0.56 32.59 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.178 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.2 t -89.0 162.27 16.13 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -134.12 117.41 13.65 Favored Pre-proline 0 C--N 1.318 -0.802 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -68.5 166.64 69.03 Favored 'Cis proline' 0 N--CA 1.477 0.507 0 C-N-CA 123.498 -1.459 . . . . 0.0 112.555 0.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.419 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 4.4 t -62.47 133.0 54.38 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.425 -178.026 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 80.2 mm-40 -112.93 18.7 17.93 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -174.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.524 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 1.2 m -65.49 -30.49 71.27 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 120.239 -0.584 . . . . 0.0 111.358 179.459 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 58.99 -136.88 50.93 Favored Glycine 0 CA--C 1.52 0.363 0 CA-C-N 115.961 -0.563 . . . . 0.0 114.15 176.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.0 m -93.32 -8.17 42.8 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.866 0.365 . . . . 0.0 111.165 -177.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -88.01 -49.88 6.77 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.134 179.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.4 ' HA ' ' HB3' ' A' ' 21' ' ' CYS . 5.4 t 59.96 92.61 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.074 -178.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -85.14 -7.6 59.0 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.164 -0.925 . . . . 0.0 112.78 -174.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.567 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 22.6 p -101.07 -176.47 3.17 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.255 0.55 . . . . 0.0 111.686 -177.562 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -100.38 -147.9 21.67 Favored Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.981 177.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -109.13 18.05 20.99 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 121.157 0.504 . . . . 0.0 110.491 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -83.17 -9.12 84.48 Favored Glycine 0 C--N 1.309 -0.935 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.489 -177.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.718 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 29.8 p -94.27 -30.61 14.47 Favored 'General case' 0 C--N 1.318 -0.795 0 O-C-N 122.769 -0.253 . . . . 0.0 111.468 -178.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 41.1 p 49.61 41.23 21.23 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-O 121.709 0.766 . . . . 0.0 109.854 -173.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.622 ' O ' ' HB2' ' A' ' 37' ' ' LYS . 0.3 OUTLIER -58.77 159.19 7.06 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 114.528 -1.215 . . . . 0.0 111.214 -177.606 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -104.59 12.93 32.48 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.627 -178.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -121.72 -64.43 1.22 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.054 -178.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 14.7 p -82.11 -25.35 34.53 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.958 0.408 . . . . 0.0 111.275 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.622 ' HB2' ' O ' ' A' ' 33' ' ' CYS . 1.4 mmpp? -93.32 58.38 2.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.79 0.329 . . . . 0.0 111.208 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.7 t -127.72 159.97 33.14 Favored 'General case' 0 C--N 1.313 -1.017 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.735 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.3 t -93.35 139.52 30.58 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -95.15 -0.16 53.59 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 120.862 0.363 . . . . 0.0 111.384 -177.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.554 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 62.8 m -81.31 135.29 35.69 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.219 -0.446 . . . . 0.0 109.949 177.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 69.5 p -101.3 166.47 10.74 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.758 -178.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.7 m -71.72 -15.2 62.19 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.532 179.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -80.66 -35.32 33.94 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.508 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -166.61 130.04 2.05 Favored Glycine 0 N--CA 1.439 -1.151 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.091 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 18.6 t -67.88 133.87 49.89 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 32.8 mmmt -92.41 -30.85 15.55 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -176.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.1 p -91.62 -39.61 11.77 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.611 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 114.41 4.74 21.72 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.817 -0.706 . . . . 0.0 113.028 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.511 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 75.3 mmtt -86.32 -2.99 58.89 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.982 0.391 . . . . 0.0 111.507 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 67.94 18.31 9.56 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.311 0.577 . . . . 0.0 111.284 177.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.505 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 0.9 OUTLIER -65.83 -49.55 67.8 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.008 178.108 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 46.5 p 53.05 46.47 26.65 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.042 -0.981 . . . . 0.0 113.111 177.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 135.13 153.1 6.67 Favored Glycine 0 N--CA 1.442 -0.951 0 C-N-CA 120.212 -0.994 . . . . 0.0 112.687 177.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.09 -18.34 30.92 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.752 2.302 . . . . 0.0 112.68 -178.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -82.16 -4.83 57.78 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.158 0.504 . . . . 0.0 110.729 -178.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 49.3 m -148.07 26.44 0.98 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.317 0.58 . . . . 0.0 110.209 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.505 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 12.2 t -84.21 138.2 33.1 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.988 -177.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -110.82 12.43 22.38 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.445 0.641 . . . . 0.0 109.406 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.511 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 19.3 m -108.66 151.25 26.41 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.456 -178.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . 0.401 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -89.18 -106.7 1.11 Allowed Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 121.106 -0.569 . . . . 0.0 112.558 -178.058 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 61.7 p -129.32 -9.0 4.71 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-O 120.9 0.381 . . . . 0.0 111.142 -178.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.1 m -104.38 20.61 18.14 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.88 -175.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 35.3 t -102.13 170.48 8.08 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.669 179.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.6 t -65.93 -28.94 69.3 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.186 -178.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.554 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 17.3 p -80.52 1.81 27.96 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 120.845 0.355 . . . . 0.0 111.488 -178.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 61' ' ' GLY . 23.5 mmtp . . . . . 0 C--O 1.258 1.525 0 CA-C-O 117.544 -1.217 . . . . 0.0 110.533 -179.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.487 ' HD2' ' N ' ' A' ' 9' ' ' LYS . 11.5 mptt . . . . . 0 N--CA 1.45 -0.459 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.854 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 79.7 m -100.35 146.33 27.09 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.271 -177.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.5 p -94.68 178.76 5.48 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.589 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.5 p -60.47 -29.35 68.99 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.385 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.27 -45.66 87.09 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.259 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.481 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 17.5 t -69.42 -35.27 75.57 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.006 0.432 . . . . 0.0 110.71 -178.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 15' ' ' ARG . 19.0 mtt180 -76.12 0.91 17.19 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.8 m -81.18 160.12 24.43 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.683 0.278 . . . . 0.0 111.064 -178.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.4 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 74.9 mm-40 -126.48 108.45 23.47 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.991 178.305 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.4 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 69.3 Cg_endo -74.44 173.12 58.74 Favored 'Cis proline' 0 C--O 1.241 0.634 0 C-N-CA 123.554 -1.436 . . . . 0.0 112.145 -2.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.481 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 8.7 t -57.66 139.92 52.5 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.871 -177.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 86.1 mm-40 -119.01 16.49 13.34 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -175.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -62.86 -29.86 71.07 Favored 'General case' 0 C--O 1.241 0.619 0 C-N-CA 120.269 -0.572 . . . . 0.0 110.412 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 59.33 -139.5 48.62 Favored Glycine 0 N--CA 1.448 -0.562 0 CA-C-N 115.663 -0.699 . . . . 0.0 113.032 176.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -99.17 10.69 40.94 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.133 0.492 . . . . 0.0 110.647 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -98.61 -50.23 4.33 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 177.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 t 57.3 94.6 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.0 179.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -97.36 9.61 41.84 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.562 -175.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.575 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 31.7 p -107.63 173.59 6.26 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.947 -179.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -102.06 178.45 26.93 Favored Glycine 0 N--CA 1.445 -0.742 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.798 178.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -82.14 78.23 8.84 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.221 0.534 . . . . 0.0 111.284 -178.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -159.14 23.09 0.31 Allowed Glycine 0 N--CA 1.444 -0.821 0 N-CA-C 111.265 -0.734 . . . . 0.0 111.265 178.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.854 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 25.1 p -116.52 -19.79 9.91 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 -178.255 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 71.7 p 50.92 30.41 5.22 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-O 121.573 0.702 . . . . 0.0 110.543 -175.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.429 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 1.9 t -76.84 116.41 17.48 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.008 -177.204 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -88.1 16.94 5.44 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.37 0.605 . . . . 0.0 110.607 -176.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.38 -54.07 2.67 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.216 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 28.6 p -98.44 -30.48 12.52 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.122 178.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.546 ' NZ ' ' HB2' ' A' ' 37' ' ' LYS . 0.3 OUTLIER -106.52 80.18 1.45 Allowed 'General case' 0 N--CA 1.435 -1.193 0 CA-C-O 121.448 0.642 . . . . 0.0 111.796 -175.17 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.5 t -157.17 161.75 39.32 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.035 178.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.6 t -89.96 146.91 24.03 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 120.835 0.35 . . . . 0.0 110.736 -179.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 -114.51 2.76 14.69 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.098 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.572 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 57.2 m -79.71 148.11 31.67 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.235 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 44.8 p -114.25 162.24 16.82 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.698 -179.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.446 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 6.6 p -63.8 -25.75 68.32 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.021 0.438 . . . . 0.0 111.312 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -73.4 -35.09 65.82 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.299 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -164.24 131.07 2.33 Favored Glycine 0 N--CA 1.442 -0.949 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.032 -179.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 27.4 t -76.96 133.65 39.13 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 120.743 0.306 . . . . 0.0 110.483 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -86.41 -41.06 14.77 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -178.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.451 ' HA ' ' HB2' ' A' ' 65' ' ' SER . 19.2 p -83.37 -39.23 20.97 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.033 -177.411 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.64 5.82 25.57 Favored Glycine 0 N--CA 1.44 -1.071 0 C-N-CA 120.47 -0.871 . . . . 0.0 113.029 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -84.58 -0.51 53.48 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.075 0.464 . . . . 0.0 110.264 178.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 63.66 21.23 12.62 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.215 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.56 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 3.2 p -70.04 -47.53 61.67 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.956 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.446 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 73.5 p 55.35 25.68 7.84 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 114.956 -1.02 . . . . 0.0 113.032 177.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 152.02 155.22 6.93 Favored Glycine 0 N--CA 1.441 -1.025 0 C-N-CA 120.297 -0.954 . . . . 0.0 112.518 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.455 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 20.8 Cg_endo -60.36 -26.64 83.18 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 123.258 2.639 . . . . 0.0 113.179 -179.075 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -70.74 -17.73 62.8 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.927 0.394 . . . . 0.0 111.656 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.1 m -135.43 25.15 3.48 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.008 0.432 . . . . 0.0 110.032 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.56 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 6.3 t -81.59 126.42 31.71 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.146 -176.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp -106.34 17.27 23.66 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.462 -178.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.3 m -109.5 159.38 17.11 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.197 -175.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -110.21 -77.04 0.91 Allowed Glycine 0 N--CA 1.439 -1.115 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.624 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 34.8 m -146.47 159.3 43.59 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 110.376 -0.231 . . . . 0.0 110.376 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.2 m 65.21 7.4 4.13 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 177.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . 0.433 ' HB3' ' HG2' ' A' ' 67' ' ' LYS . 45.3 t -75.46 167.47 21.84 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 176.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.451 ' HB2' ' HA ' ' A' ' 48' ' ' CYS . 15.4 m -64.34 -16.56 62.46 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 120.771 0.319 . . . . 0.0 111.771 -177.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.572 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 25.5 p -101.15 1.92 39.64 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 120.571 0.224 . . . . 0.0 111.29 178.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.52 ' HE2' ' SG ' ' A' ' 66' ' ' CYS . 71.9 mmtt . . . . . 0 C--O 1.261 1.708 0 CA-C-O 117.843 -1.075 . . . . 0.0 111.049 -177.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.9 mttt . . . . . 0 CA--C 1.514 -0.412 0 CA-C-O 120.944 0.402 . . . . 0.0 110.119 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.563 ' SG ' ' HB2' ' A' ' 27' ' ' CYS . 78.6 m -95.86 147.86 23.21 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -176.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 74.8 p -100.51 179.6 4.39 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.805 -178.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.5 m -62.12 -20.07 63.68 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.31 -178.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.38 -50.14 48.94 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 120.956 0.408 . . . . 0.0 110.023 177.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 51.4 t -73.57 -35.68 65.48 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.009 178.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 27.7 mtm180 -69.35 -3.34 13.75 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.948 0.404 . . . . 0.0 111.649 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.5 t -83.62 163.97 20.01 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 176.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -132.86 111.43 13.37 Favored Pre-proline 0 C--N 1.306 -1.3 0 CA-C-O 120.884 0.373 . . . . 0.0 110.565 178.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -75.22 173.14 59.5 Favored 'Cis proline' 0 C--N 1.35 0.613 0 C-N-CA 123.444 -1.482 . . . . 0.0 112.238 -0.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 71.2 m -59.86 140.68 56.44 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.075 0.464 . . . . 0.0 111.164 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 28.7 mm-40 -114.29 21.1 14.99 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.004 -177.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.44 ' HB3' ' HA ' ' A' ' 25' ' ' CYS . 11.0 m -66.1 -33.14 75.1 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.84 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 79.75 -114.85 3.95 Favored Glycine 0 N--CA 1.438 -1.17 0 C-N-CA 120.775 -0.726 . . . . 0.0 111.445 -178.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.9 t -129.29 -3.27 4.97 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.043 0.449 . . . . 0.0 110.248 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -88.22 -40.81 13.39 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.086 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.538 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 0.6 OUTLIER 66.72 104.39 0.04 OUTLIER 'General case' 0 CA--C 1.505 -0.772 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.848 -179.615 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -88.3 -14.88 37.2 Favored 'General case' 0 C--N 1.305 -1.346 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.009 177.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.563 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 26.6 p -84.19 170.86 13.33 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.194 178.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.12 -126.68 2.87 Favored Glycine 0 N--CA 1.441 -0.987 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.29 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -137.36 77.41 1.64 Allowed 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 121.635 0.731 . . . . 0.0 110.556 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -172.36 43.21 0.17 Allowed Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.844 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.566 ' SG ' ' HE2' ' A' ' 37' ' ' LYS . 12.0 p -130.88 -28.63 1.97 Allowed 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 120.6 0.238 . . . . 0.0 111.178 -178.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.8 p 50.04 45.66 25.18 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 123.466 0.706 . . . . 0.0 112.8 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.637 ' O ' ' HB2' ' A' ' 37' ' ' LYS . 59.1 m -74.6 170.95 14.74 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.503 178.164 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -109.41 3.54 21.54 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.27 0.557 . . . . 0.0 110.08 178.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -104.62 -69.09 0.82 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.389 -178.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.538 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 25.3 p -88.68 0.23 56.63 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.139 -179.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.637 ' HB2' ' O ' ' A' ' 33' ' ' CYS . 34.1 mmtm -120.39 37.67 4.2 Favored 'General case' 0 CA--C 1.503 -0.832 0 CA-C-O 121.568 0.699 . . . . 0.0 111.454 -179.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.5 t -113.81 165.42 12.59 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.558 177.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 27.9 t -102.73 136.43 42.57 Favored 'General case' 0 C--N 1.307 -1.255 0 C-N-CA 120.633 -0.427 . . . . 0.0 109.922 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -87.31 -5.26 58.97 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.041 0.448 . . . . 0.0 110.806 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.426 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 69.3 m -80.03 136.01 36.49 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.176 178.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 61.1 p -92.59 152.91 19.34 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.448 -178.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.516 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 45.5 m -66.52 -13.0 60.35 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-O 121.215 0.531 . . . . 0.0 110.795 178.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -86.01 -19.81 29.8 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.248 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 178.2 134.8 2.15 Favored Glycine 0 N--CA 1.438 -1.17 0 C-N-CA 120.976 -0.63 . . . . 0.0 112.033 -178.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 30.9 t -69.03 142.24 54.62 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -112.18 -10.32 13.86 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.522 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 14.5 p -103.67 -39.48 6.67 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.121 -0.632 . . . . 0.0 109.962 177.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 122.9 -1.62 9.96 Favored Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.81 -0.709 . . . . 0.0 113.437 177.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.807 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 35.2 mmtp -84.71 -4.12 58.88 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 117.136 0.468 . . . . 0.0 111.526 -178.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 67.85 19.58 9.51 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.273 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.559 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.2 p -69.06 -44.29 72.88 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.132 -179.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.516 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 67.0 p 53.65 27.75 7.17 Favored 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 176.142 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.97 158.62 7.66 Favored Glycine 0 N--CA 1.443 -0.882 0 C-N-CA 120.095 -1.05 . . . . 0.0 112.151 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.91 -26.51 81.3 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 123.159 2.572 . . . . 0.0 113.065 -178.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -60.29 -50.25 74.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.873 0.368 . . . . 0.0 111.467 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.0 m -107.21 19.38 20.45 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.237 -177.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.559 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 41.8 t -84.87 135.47 34.06 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 121.183 0.516 . . . . 0.0 111.509 -178.27 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -122.28 13.19 10.31 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.154 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.807 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 3.7 m -99.71 116.72 32.46 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 178.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -106.37 89.38 0.6 Allowed Glycine 0 C--N 1.298 -1.549 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.916 -175.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.458 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 39.7 m 66.14 164.72 0.18 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.17 0.588 . . . . 0.0 111.339 -179.15 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.9 m 69.31 -14.32 0.33 Allowed 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 25.5 t -86.22 165.37 16.56 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 119.873 -0.731 . . . . 0.0 110.932 -178.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.8 m -64.2 -22.69 67.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.738 -178.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.426 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 27.4 p -90.29 4.22 51.36 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.81 178.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.458 ' HD2' ' H ' ' A' ' 62' ' ' SER . 0.3 OUTLIER . . . . . 0 C--O 1.256 1.403 0 CA-C-O 118.078 -0.963 . . . . 0.0 110.474 -179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 50.4 mtpt . . . . . 0 C--O 1.235 0.3 0 CA-C-O 121.437 0.637 . . . . 0.0 111.341 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.731 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 71.7 m -92.93 139.4 30.57 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.218 177.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 64.4 p -88.08 -179.06 6.11 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.758 -177.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.0 p -62.74 -30.59 71.55 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.196 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.45 -49.43 76.86 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.695 179.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.425 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 43.2 t -67.97 -29.29 68.3 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.431 0.634 . . . . 0.0 110.423 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.4 mmt180 -84.38 15.94 3.36 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.975 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.6 m -107.81 161.09 15.22 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 175.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -123.35 110.87 30.36 Favored Pre-proline 0 C--N 1.315 -0.908 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.724 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -79.17 171.27 65.69 Favored 'Cis proline' 0 C--O 1.239 0.544 0 C-N-CA 123.483 -1.465 . . . . 0.0 111.852 -0.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 95.9 m -55.31 129.06 37.01 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.391 0.615 . . . . 0.0 111.215 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 31.4 mm-40 -94.75 8.89 41.03 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.034 -178.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.611 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 7.4 m -62.26 -37.02 83.85 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.093 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 64.59 -144.56 48.52 Favored Glycine 0 N--CA 1.441 -1.011 0 CA-C-N 115.687 -0.688 . . . . 0.0 113.105 178.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.7 m -88.58 -8.51 54.59 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -178.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -86.66 -54.13 4.56 Favored 'General case' 0 CA--C 1.491 -1.29 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 178.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.685 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 8.6 t 63.48 101.18 0.03 OUTLIER 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 114.358 -1.292 . . . . 0.0 112.467 175.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -97.18 12.15 33.82 Favored 'General case' 0 C--N 1.308 -1.197 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -178.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.731 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 21.8 p -104.12 166.05 10.65 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 119.754 -0.779 . . . . 0.0 111.24 176.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -79.41 -112.49 0.24 Allowed Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.225 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -139.84 -173.34 3.61 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -179.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.96 -33.8 5.67 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.472 -0.87 . . . . 0.0 113.095 177.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 18.5 p -69.37 -36.88 77.26 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.738 0.304 . . . . 0.0 110.814 -179.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 46.9 p 49.59 43.96 24.2 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.634 -179.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 72.3 m -64.81 172.38 2.85 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.926 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.39 3.29 23.17 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.539 0.685 . . . . 0.0 109.619 177.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -106.45 -72.06 0.73 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.542 -178.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.685 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 7.8 p -80.25 -23.43 40.83 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.183 0.516 . . . . 0.0 111.275 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.469 ' NZ ' ' SG ' ' A' ' 27' ' ' CYS . 11.2 mptt -95.36 105.52 17.48 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-O 121.473 0.654 . . . . 0.0 111.691 179.226 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.4 t -171.7 -173.04 1.11 Allowed 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 114.891 -1.049 . . . . 0.0 108.348 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.423 ' SG ' ' HB2' ' A' ' 41' ' ' CYS . 46.4 t -136.98 127.18 26.26 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 177.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 41.4 m-80 -72.48 -20.28 61.4 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.972 0.415 . . . . 0.0 110.705 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.488 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 49.5 m -68.59 137.15 54.04 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.712 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 77.9 p -117.9 173.38 6.8 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.434 -177.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.1 m -62.08 -20.27 63.84 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 121.04 0.448 . . . . 0.0 110.947 178.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -68.09 -39.59 82.83 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.391 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 176.22 146.51 6.01 Favored Glycine 0 N--CA 1.428 -1.855 0 C-N-CA 120.848 -0.691 . . . . 0.0 111.853 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 45.1 t -63.91 129.7 41.14 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 178.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.488 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 30.8 mmmt -96.23 -12.69 24.23 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -176.261 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.499 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 18.7 p -99.97 -41.4 7.21 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 119.654 -0.818 . . . . 0.0 109.928 177.123 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.46 15.82 9.3 Favored Glycine 0 N--CA 1.433 -1.531 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.816 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.499 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 75.7 mmtt -94.64 6.06 50.01 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 176.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 67.99 37.98 2.88 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.694 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.629 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 26.6 p -113.14 141.9 46.38 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.327 176.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.2 p -136.55 106.4 6.24 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.624 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 90.8 147.86 19.84 Favored Glycine 0 N--CA 1.437 -1.234 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.312 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -59.37 -30.26 92.28 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.327 2.018 . . . . 0.0 111.918 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -63.63 -47.01 83.1 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.565 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.4 m -101.52 19.62 17.59 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.257 -178.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.629 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 44.6 t -75.24 126.63 31.41 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 120.874 0.369 . . . . 0.0 110.375 179.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -99.58 -5.11 29.65 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.366 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.403 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 15.2 m -89.0 142.18 27.85 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.017 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -116.27 73.08 0.27 Allowed Glycine 0 C--N 1.316 -0.575 0 C-N-CA 120.808 -0.711 . . . . 0.0 113.074 -176.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.451 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 9.7 t 65.65 166.39 0.19 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.18 0.592 . . . . 0.0 111.355 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.3 t 70.21 -16.57 0.3 Allowed 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.411 0.684 . . . . 0.0 112.759 177.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 20.1 t -76.88 165.16 25.06 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 110.354 -0.239 . . . . 0.0 110.354 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 6.7 m -64.24 -24.59 67.72 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.87 -177.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.49 ' SG ' ' HE2' ' A' ' 67' ' ' LYS . 20.8 p -75.92 -4.09 39.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.922 0.392 . . . . 0.0 111.01 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.49 ' HE2' ' SG ' ' A' ' 66' ' ' CYS . 18.0 mmtt . . . . . 0 C--O 1.258 1.517 0 CA-C-O 117.485 -1.245 . . . . 0.0 110.34 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt . . . . . 0 C--O 1.241 0.637 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.639 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 59.4 m -91.34 156.49 17.74 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.659 -1.155 . . . . 0.0 112.617 -176.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.3 p -94.16 177.76 5.86 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.465 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.7 m -57.75 -37.74 74.14 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.782 0.29 . . . . 0.0 111.782 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.97 -42.28 98.96 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 120.942 0.401 . . . . 0.0 111.517 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.56 ' HB3' ' HB3' ' A' ' 10' ' ' CYS . 11.7 t -73.83 -25.46 60.1 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.365 0.603 . . . . 0.0 109.635 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 42.2 mtt180 -89.78 12.83 15.98 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.411 178.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.6 m -89.05 177.71 6.58 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 179.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.469 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 3.4 tm-20 -131.84 111.08 14.61 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-O 120.707 0.289 . . . . 0.0 110.507 178.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.469 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 72.0 Cg_endo -77.94 -170.55 8.85 Favored 'Cis proline' 0 C--N 1.347 0.481 0 C-N-CA 122.926 -1.697 . . . . 0.0 110.924 -2.264 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.7 t -59.46 122.95 15.27 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 120.898 0.38 . . . . 0.0 110.575 -179.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 84.5 mm-40 -110.17 15.73 22.22 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.007 -177.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.857 ' SG ' ' HA ' ' A' ' 25' ' ' CYS . 3.4 t -65.62 -27.88 68.71 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 50.75 -139.01 23.94 Favored Glycine 0 C--N 1.341 0.826 0 CA-C-N 114.704 -1.135 . . . . 0.0 115.345 173.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.2 m -84.03 -15.39 47.74 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.101 -0.549 . . . . 0.0 111.293 -177.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.8 mmmt -73.95 -48.75 28.42 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.186 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.857 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 8.2 t 53.59 81.9 0.09 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.74 -179.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -86.61 -11.2 52.12 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.869 -175.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.639 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 30.8 p -82.92 175.52 10.0 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.0 0.428 . . . . 0.0 111.176 -178.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -123.04 -135.57 4.62 Favored Glycine 0 N--CA 1.437 -1.253 0 C-N-CA 120.474 -0.87 . . . . 0.0 112.499 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -74.58 152.29 39.31 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 122.899 0.48 . . . . 0.0 111.071 -179.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 94.84 15.92 43.89 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.021 -0.609 . . . . 0.0 112.944 178.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.69 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 16.1 t -114.77 -62.61 1.58 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.103 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 76.3 p 52.38 35.48 17.46 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.124 0.569 . . . . 0.0 111.8 -177.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.69 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -58.35 142.44 48.21 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.339 179.757 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -93.28 18.31 9.78 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 121.392 0.615 . . . . 0.0 109.681 178.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -120.71 -53.55 2.08 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.531 -177.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.649 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 29.8 p -98.24 -38.93 9.09 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.735 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 11.1 ttmm -107.18 36.01 2.84 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.471 0.653 . . . . 0.0 111.104 -174.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.424 ' O ' ' HD3' ' A' ' 67' ' ' LYS . 14.7 t -96.86 171.27 8.62 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.729 -177.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -99.8 148.59 24.25 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.663 178.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -110.28 3.89 20.36 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.656 -178.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.406 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 64.8 m -80.08 155.79 27.38 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-O 120.827 0.346 . . . . 0.0 110.712 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 54.7 p -122.87 159.15 28.79 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.403 -178.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.5 m -65.03 -27.97 69.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.148 0.499 . . . . 0.0 110.241 179.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -66.52 -32.18 73.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.896 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -174.44 128.36 1.44 Allowed Glycine 0 N--CA 1.437 -1.253 0 C-N-CA 120.89 -0.671 . . . . 0.0 111.759 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.9 t -63.31 144.23 57.12 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 178.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm -104.9 -21.58 13.29 Favored 'General case' 0 C--N 1.317 -0.848 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -175.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 25.7 p -98.12 -41.69 7.81 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.75 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.93 -2.38 19.54 Favored Glycine 0 N--CA 1.443 -0.893 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.094 -178.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.602 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 30.4 mmmt -79.65 -3.33 46.77 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.691 0.281 . . . . 0.0 110.405 178.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 70.16 17.06 7.3 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.513 176.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.572 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 3.4 p -69.5 -37.5 77.24 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.798 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 44.1 p 52.09 37.39 21.39 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.715 0.806 . . . . 0.0 112.797 177.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 134.44 159.59 8.88 Favored Glycine 0 N--CA 1.439 -1.129 0 C-N-CA 120.148 -1.025 . . . . 0.0 112.296 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.26 -25.52 76.79 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.968 2.445 . . . . 0.0 112.798 -178.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -62.01 -40.08 94.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.692 -178.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 40.2 m -115.53 18.35 15.95 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 121.035 0.445 . . . . 0.0 110.626 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.572 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 48.6 t -79.06 120.77 24.1 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.21 0.529 . . . . 0.0 111.067 -178.645 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -108.49 7.48 26.88 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.81 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.602 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 26.5 m -80.77 142.75 33.46 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.656 178.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -127.2 82.37 0.35 Allowed Glycine 0 C--N 1.311 -0.842 0 C-N-CA 120.925 -0.655 . . . . 0.0 111.771 -178.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 52.0 m 62.99 171.99 0.15 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.722 0.409 . . . . 0.0 110.992 -178.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 31.6 m 62.81 3.53 1.21 Allowed 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 176.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 33.1 t -101.74 167.26 10.21 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 122.032 -0.417 . . . . 0.0 110.376 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.9 t -68.46 -27.84 66.51 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.748 -177.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.406 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 25.6 p -82.55 -0.86 48.73 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.138 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.424 ' HD3' ' O ' ' A' ' 38' ' ' THR . 70.8 mmtt . . . . . 0 C--O 1.263 1.814 0 CA-C-O 117.676 -1.154 . . . . 0.0 110.786 -178.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.8 mptt . . . . . 0 N--CA 1.446 -0.659 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.515 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 85.9 m -88.5 139.1 30.82 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.016 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.426 ' OG1' ' HB2' ' A' ' 26' ' ' GLN . 73.4 p -89.42 -177.62 5.39 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.396 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 11.3 m -64.13 -22.77 67.07 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.064 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.86 -49.39 58.73 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 120.837 0.351 . . . . 0.0 110.737 179.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 36.3 t -73.48 -31.16 63.6 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.002 0.43 . . . . 0.0 110.536 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.553 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 1.7 mmp_? -74.17 -11.39 60.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.857 179.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.9 t -82.11 165.27 20.71 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.406 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 8.0 pt-20 -126.37 115.08 23.36 Favored Pre-proline 0 C--N 1.316 -0.85 0 CA-C-O 120.81 0.338 . . . . 0.0 110.997 -179.294 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.406 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 1.8 Cg_endo -81.27 -174.07 13.4 Favored 'Cis proline' 0 C--N 1.348 0.514 0 C-N-CA 123.58 -1.425 . . . . 0.0 111.722 -0.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.5 m -56.63 126.56 27.25 Favored 'General case' 0 CA--C 1.504 -0.814 0 CA-C-O 121.644 0.735 . . . . 0.0 112.55 -178.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -101.92 12.82 36.33 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.738 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.405 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 15.1 m -60.99 -28.77 69.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.269 177.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 59.58 -112.6 4.45 Favored Glycine 0 C--N 1.34 0.791 0 CA-C-N 115.74 -0.663 . . . . 0.0 112.028 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 70.3 m -121.43 17.75 11.35 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.147 0.498 . . . . 0.0 110.211 177.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -102.31 -45.83 4.99 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.836 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 55.9 90.94 0.03 OUTLIER 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.608 0.718 . . . . 0.0 110.601 -176.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.426 ' HB2' ' OG1' ' A' ' 11' ' ' THR . 49.4 mt-30 -92.9 -6.08 49.44 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.298 -174.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.515 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 26.3 p -88.27 174.06 8.41 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-O 121.101 0.477 . . . . 0.0 111.501 -177.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -118.12 -134.29 5.05 Favored Glycine 0 N--CA 1.443 -0.892 0 C-N-CA 120.936 -0.649 . . . . 0.0 113.242 -179.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -74.25 176.8 6.31 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 123.189 0.595 . . . . 0.0 112.027 -177.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 62.46 31.7 80.49 Favored Glycine 0 CA--C 1.502 -0.76 0 CA-C-N 115.283 -0.871 . . . . 0.0 112.158 178.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 49.3 t -124.9 -76.7 0.59 Allowed 'General case' 0 N--CA 1.423 -1.823 0 C-N-CA 120.651 -0.419 . . . . 0.0 111.909 -177.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 75.1 p 48.73 41.12 17.42 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.548 0.689 . . . . 0.0 110.906 -178.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.426 ' HB2' ' SG ' ' A' ' 36' ' ' CYS . 0.5 OUTLIER -54.48 157.41 2.88 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 114.753 -1.112 . . . . 0.0 112.445 -178.66 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -95.57 21.03 8.75 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.341 0.591 . . . . 0.0 110.386 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -131.55 -63.81 0.82 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.371 -179.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.426 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 27.4 p -82.91 -45.2 14.49 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.705 -0.679 . . . . 0.0 112.16 -179.195 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.0 ttmt -118.79 50.94 1.15 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.192 0.52 . . . . 0.0 112.162 -170.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.7 t -97.62 162.66 13.18 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.707 179.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.413 ' SG ' ' HB2' ' A' ' 41' ' ' CYS . 51.6 t -94.96 140.56 29.78 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -99.64 0.61 42.4 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.837 -179.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.413 ' HB2' ' SG ' ' A' ' 39' ' ' CYS . 62.1 m -82.93 141.09 32.42 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.727 177.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 59.3 p -100.39 164.89 11.72 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 -178.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.452 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 7.9 m -69.55 -9.68 54.97 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 121.299 0.571 . . . . 0.0 110.539 178.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -99.44 -32.77 10.97 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.005 179.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -150.2 128.42 2.67 Favored Glycine 0 N--CA 1.438 -1.187 0 C-N-CA 120.289 -0.958 . . . . 0.0 112.843 -177.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.0 t -80.57 133.73 35.82 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -98.84 -24.78 14.86 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -176.005 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 23.2 p -93.43 -35.41 13.0 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.221 -0.592 . . . . 0.0 110.579 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 110.37 -2.24 29.51 Favored Glycine 0 N--CA 1.438 -1.204 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.932 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -78.4 -7.16 57.04 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.034 0.445 . . . . 0.0 110.47 179.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 64.16 33.6 11.72 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.173 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.494 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 3.1 p -75.1 -49.12 20.69 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.139 178.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.452 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 53.4 p 50.45 76.27 0.15 Allowed 'General case' 0 C--O 1.237 0.423 0 C-N-CA 123.941 0.896 . . . . 0.0 112.432 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 113.84 138.92 7.06 Favored Glycine 0 N--CA 1.436 -1.324 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.714 179.071 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.512 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 21.8 Cg_endo -62.12 -27.98 79.43 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.783 2.322 . . . . 0.0 112.524 -178.318 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -62.84 -39.51 94.58 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.106 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.4 m -107.05 24.23 13.14 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.487 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.512 ' HB2' ' HA ' ' A' ' 55' ' ' PRO . 0.5 OUTLIER -76.04 131.42 39.49 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.772 -178.272 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -106.73 3.77 26.98 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.219 0.533 . . . . 0.0 109.607 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 4.3 m -96.24 167.3 11.28 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.877 -175.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -98.59 -106.63 2.62 Favored Glycine 0 N--CA 1.442 -0.959 0 CA-C-N 115.815 -0.63 . . . . 0.0 112.222 179.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.9 m -131.43 -12.74 3.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.73 0.3 . . . . 0.0 111.591 -178.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 17.4 m -103.0 20.51 17.43 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -175.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 38.2 t -96.75 165.69 12.0 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.838 0.351 . . . . 0.0 110.963 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.6 m -64.18 -25.32 68.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.291 -178.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.502 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 26.7 p -89.84 13.53 14.26 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.725 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.502 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 39.5 mmtm . . . . . 0 C--O 1.264 1.822 0 CA-C-O 117.875 -1.059 . . . . 0.0 110.437 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 47.8 mtmt . . . . . 0 CA--C 1.511 -0.55 0 CA-C-O 121.36 0.6 . . . . 0.0 110.511 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.523 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 78.1 m -80.53 134.9 36.01 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.682 178.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 61.2 p -80.87 177.32 9.12 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.126 -178.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.9 p -58.15 -37.16 74.15 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.211 178.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.02 -47.53 82.7 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.862 0.363 . . . . 0.0 110.839 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 47.4 t -68.13 -38.61 82.38 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.163 0.506 . . . . 0.0 110.406 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 29.3 ttt180 -73.05 -9.36 58.65 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.874 -179.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.2 m -71.99 164.57 25.88 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 122.107 -0.37 . . . . 0.0 110.594 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.431 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -125.23 114.08 25.99 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.654 178.442 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.431 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 74.4 Cg_endo -75.73 174.34 53.36 Favored 'Cis proline' 0 C--O 1.237 0.438 0 C-N-CA 123.394 -1.503 . . . . 0.0 112.066 -1.184 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.578 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 49.6 t -57.9 132.88 54.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.228 -178.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 79.5 mm-40 -117.59 17.35 14.47 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.958 -179.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.682 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.8 t -60.11 -29.23 68.47 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.966 -179.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 81.13 -153.1 33.58 Favored Glycine 0 N--CA 1.431 -1.66 0 CA-C-N 115.463 -0.79 . . . . 0.0 112.195 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.5 m -107.33 11.82 28.73 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -102.53 -30.58 10.89 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.862 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.67 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 1.1 m 65.59 103.78 0.04 OUTLIER 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.568 0.699 . . . . 0.0 112.799 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -95.48 -5.57 42.63 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 115.38 -0.827 . . . . 0.0 108.861 176.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.523 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 22.8 p -92.89 160.12 15.05 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.184 -178.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -79.96 162.15 46.35 Favored Glycine 0 N--CA 1.44 -1.049 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 174.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.24 163.04 23.69 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 117.529 0.664 . . . . 0.0 111.307 -178.283 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 98.19 0.88 58.31 Favored Glycine 0 N--CA 1.439 -1.151 0 N-CA-C 110.311 -1.116 . . . . 0.0 110.311 -175.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 43.2 t -75.46 142.19 42.99 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 75.7 p -103.8 14.18 31.45 Favored 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -175.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.7 m -67.33 133.03 48.86 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.032 175.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -99.69 12.91 35.35 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.645 0.736 . . . . 0.0 109.035 177.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.8 -57.01 2.12 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.403 -178.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.682 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 28.4 p -82.6 -43.62 16.79 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.746 177.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.2 ttpm? -101.8 81.15 2.1 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.519 178.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.3 t -121.73 155.41 35.3 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 -179.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.6 t -92.83 135.05 34.48 Favored 'General case' 0 N--CA 1.444 -0.725 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -92.85 1.34 57.34 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 121.1 0.476 . . . . 0.0 110.881 -178.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.51 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 56.3 m -88.81 133.7 34.17 Favored 'General case' 0 N--CA 1.437 -1.12 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.338 179.197 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 1.6 t -108.69 164.77 12.08 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.337 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.551 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 44.4 m -70.58 -9.88 57.94 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.707 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -88.33 -19.69 26.35 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.432 177.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -179.65 131.11 1.61 Allowed Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.058 -179.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.6 t -76.9 147.84 36.78 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -109.71 -30.89 7.66 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 112.324 0.491 . . . . 0.0 112.324 -177.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.53 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 29.1 p -87.89 -34.18 18.26 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.188 -0.605 . . . . 0.0 111.397 -177.574 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.28 -1.38 31.14 Favored Glycine 0 N--CA 1.445 -0.765 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.507 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.558 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 75.1 mmtt -80.58 -8.64 59.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.029 0.442 . . . . 0.0 109.902 178.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 67.82 30.87 6.08 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.062 -0.972 . . . . 0.0 111.144 178.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.411 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.6 p -72.66 -44.05 62.36 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.157 177.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.551 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 77.7 p 50.78 41.0 25.83 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.72 0.808 . . . . 0.0 112.859 177.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 147.4 136.38 2.8 Favored Glycine 0 N--CA 1.437 -1.276 0 C-N-CA 120.384 -0.912 . . . . 0.0 111.731 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.423 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 13.2 Cg_endo -57.2 -24.6 59.97 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.122 2.548 . . . . 0.0 113.621 -178.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -74.22 -35.86 63.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.923 0.392 . . . . 0.0 111.197 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 37.0 t -101.2 10.92 40.29 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.524 0.678 . . . . 0.0 109.746 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.423 ' HB2' ' HA ' ' A' ' 55' ' ' PRO . 13.8 t -79.87 110.27 15.07 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.69 -178.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -108.24 -6.95 16.11 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.725 -177.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.558 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.8 p -85.36 157.92 20.4 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.157 -0.617 . . . . 0.0 111.707 -179.165 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -64.6 175.34 12.41 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 115.234 0.854 . . . . 0.0 115.234 -174.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.53 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 14.2 m -77.94 -10.63 59.68 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 123.697 0.799 . . . . 0.0 111.121 -178.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.7 m -93.95 9.81 35.95 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.96 0.41 . . . . 0.0 110.676 179.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 44.2 t -81.35 169.63 17.01 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.205 -178.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.8 t -69.97 -24.76 63.37 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.956 -177.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.51 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 22.0 p -82.5 -3.87 56.57 Favored 'General case' 0 CA--C 1.512 -0.515 0 C-N-CA 120.466 -0.493 . . . . 0.0 110.815 -179.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.53 ' HG3' ' HA ' ' A' ' 62' ' ' SER . 38.5 mmtm . . . . . 0 C--O 1.26 1.657 0 CA-C-O 117.533 -1.222 . . . . 0.0 110.449 -177.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 11.9 mptt . . . . . 0 CA--C 1.503 -0.854 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.645 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 80.9 m -64.23 150.62 45.52 Favored 'General case' 0 N--CA 1.431 -1.408 0 CA-C-N 114.621 -1.172 . . . . 0.0 112.885 -176.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 65.2 p -109.76 -174.1 2.41 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.116 -179.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.9 t -67.19 -30.05 69.89 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.673 0.273 . . . . 0.0 110.809 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.87 -49.03 79.11 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 120.751 0.31 . . . . 0.0 110.667 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 42.6 t -64.07 -38.81 92.42 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.151 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 26.6 mtp180 -80.55 18.54 0.92 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.3 m -106.06 159.83 15.77 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 173.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.447 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 19.4 mm-40 -120.09 115.77 32.95 Favored Pre-proline 0 C--N 1.321 -0.661 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.633 -179.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.447 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 72.9 Cg_endo -77.61 169.2 74.37 Favored 'Cis proline' 0 C--N 1.346 0.41 0 C-N-CA 123.115 -1.619 . . . . 0.0 111.033 -2.252 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 74.6 m -54.02 122.33 9.91 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.088 0.471 . . . . 0.0 110.646 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 32.3 mm-40 -88.89 16.78 6.39 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.987 -175.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.526 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 2.3 m -64.53 -29.73 70.76 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.953 178.343 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 62.97 -138.86 44.35 Favored Glycine 0 N--CA 1.444 -0.802 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.838 -179.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.6 m -98.86 12.01 37.05 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 121.028 0.442 . . . . 0.0 110.233 178.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -97.51 -53.18 3.52 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.64 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 0.1 OUTLIER 64.84 99.36 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.916 -1.038 . . . . 0.0 112.355 178.23 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -90.65 -14.3 32.57 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.666 -178.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.645 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 31.6 p -87.68 -175.1 5.06 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.029 0.443 . . . . 0.0 111.698 -177.078 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.23 -110.01 0.6 Allowed Glycine 0 N--CA 1.442 -0.915 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.43 179.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -160.77 0.0 0.06 Allowed 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -176.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -86.76 -6.96 79.17 Favored Glycine 0 C--N 1.301 -1.377 0 C-N-CA 121.077 -0.583 . . . . 0.0 113.719 -175.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.503 ' SG ' ' HE2' ' A' ' 37' ' ' LYS . 3.8 p -75.71 -29.67 59.03 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 120.837 0.351 . . . . 0.0 110.917 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 63.6 p 50.06 42.12 24.4 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.492 0.717 . . . . 0.0 112.251 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.429 ' SG ' ' HB2' ' A' ' 31' ' ' CYS . 58.3 m -66.62 177.31 1.62 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.881 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -111.7 -0.27 16.07 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 121.243 0.544 . . . . 0.0 110.222 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.49 -67.23 0.88 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.569 -178.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.64 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 7.9 p -85.05 -13.45 50.37 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.222 0.534 . . . . 0.0 110.942 179.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.542 ' NZ ' ' SG ' ' A' ' 27' ' ' CYS . 11.2 mptt -105.71 45.19 0.98 Allowed 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 121.585 0.707 . . . . 0.0 110.982 178.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 8.8 t -91.31 128.44 37.14 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.595 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.9 t -92.27 135.28 34.14 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -89.06 -6.57 57.02 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-O 121.143 0.497 . . . . 0.0 110.704 -178.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.535 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 36.8 m -81.43 133.24 35.38 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.658 178.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 74.9 p -109.42 170.73 7.87 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.161 -177.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.9 m -71.75 -9.93 59.02 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.164 0.506 . . . . 0.0 110.403 178.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -80.43 -40.36 26.49 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.968 178.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -169.18 139.39 5.6 Favored Glycine 0 N--CA 1.437 -1.287 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.767 -179.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 19.1 t -79.97 129.75 34.74 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 120.702 0.287 . . . . 0.0 110.431 179.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -87.99 -39.7 14.48 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.481 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 16.6 p -78.01 -33.13 51.33 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 119.97 -0.692 . . . . 0.0 110.264 -178.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 104.72 0.22 42.55 Favored Glycine 0 N--CA 1.438 -1.192 0 C-N-CA 120.79 -0.719 . . . . 0.0 113.262 177.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.481 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 28.5 mmtp -82.4 -1.69 50.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 117.15 0.475 . . . . 0.0 110.991 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 68.88 23.07 6.91 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.44 176.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.405 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 1.8 p -70.74 -47.2 60.93 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.919 177.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 47.6 p 51.43 31.63 7.58 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.876 0.87 . . . . 0.0 112.864 177.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 159.16 145.84 4.37 Favored Glycine 0 N--CA 1.436 -1.343 0 C-N-CA 120.534 -0.841 . . . . 0.0 111.897 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.56 -30.87 51.53 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.903 2.402 . . . . 0.0 113.302 -177.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -76.16 -17.67 59.45 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.287 0.565 . . . . 0.0 110.485 -178.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.8 m -117.17 18.52 14.51 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.095 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.405 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 0.5 OUTLIER -73.11 130.26 39.89 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.645 -178.523 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -113.65 6.4 16.9 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.616 -177.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -122.9 159.07 29.0 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.754 -177.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -77.33 -164.82 22.88 Favored Glycine 0 C--N 1.332 0.327 0 CA-C-N 115.983 -0.553 . . . . 0.0 113.761 -177.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.474 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 4.0 m -85.7 -10.39 55.73 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 122.923 0.489 . . . . 0.0 111.753 -176.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.0 m -89.2 13.08 14.12 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.147 0.499 . . . . 0.0 110.353 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 11.5 t -90.68 170.06 10.46 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.355 -178.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.9 p -76.31 -16.18 59.83 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -176.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.546 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 21.6 p -87.15 2.66 49.2 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.988 0.423 . . . . 0.0 110.723 178.497 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.546 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 11.3 mmtp . . . . . 0 C--O 1.265 1.884 0 CA-C-O 117.686 -1.15 . . . . 0.0 110.91 -176.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt . . . . . 0 C--O 1.233 0.223 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.699 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 93.6 m -82.09 143.66 31.33 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-O 121.191 0.52 . . . . 0.0 111.522 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 67.1 p -93.52 -179.28 4.98 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.348 -179.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.9 m -66.38 -21.39 66.23 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.959 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.57 -45.95 67.5 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-O 120.829 0.347 . . . . 0.0 111.042 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.448 ' HB2' ' HB3' ' A' ' 27' ' ' CYS . 22.6 t -68.1 -31.49 71.13 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.233 0.539 . . . . 0.0 110.226 -179.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 31.5 mmt180 -90.57 9.57 28.97 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.007 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.1 t -83.76 169.55 15.1 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.459 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 33.5 mm-40 -119.34 105.69 43.85 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.713 -0.222 . . . . 0.0 111.083 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.459 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 1.6 Cg_endo -83.85 -173.33 10.72 Favored 'Cis proline' 0 N--CA 1.456 -0.685 0 C-N-CA 123.888 -1.297 . . . . 0.0 111.314 -1.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 15.1 t -56.42 123.3 14.25 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.015 0.436 . . . . 0.0 110.54 -178.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -108.75 20.59 18.31 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.717 -176.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.67 -35.74 77.01 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 120.78 0.324 . . . . 0.0 111.205 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.26 -169.97 54.67 Favored Glycine 0 N--CA 1.44 -1.049 0 C-N-CA 121.131 -0.557 . . . . 0.0 112.83 178.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 24.5 m -77.53 -11.82 59.9 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.688 0.28 . . . . 0.0 111.301 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -86.55 -31.74 21.07 Favored 'General case' 0 CA--C 1.507 -0.688 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.0 t 66.54 105.83 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.805 -176.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -110.4 28.49 8.59 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.818 -173.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.613 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 9.1 p -124.25 -164.81 1.29 Allowed 'General case' 0 C--N 1.312 -1.062 0 CA-C-O 120.665 0.269 . . . . 0.0 110.555 178.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -114.25 153.95 17.28 Favored Glycine 0 N--CA 1.442 -0.91 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -79.09 84.07 5.11 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.489 0.662 . . . . 0.0 111.269 -176.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -168.82 23.89 0.1 Allowed Glycine 0 C--N 1.301 -1.373 0 N-CA-C 110.634 -0.986 . . . . 0.0 110.634 177.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.72 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 28.6 p -112.95 -21.29 11.19 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.682 -0.259 . . . . 0.0 111.572 -177.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 38.4 p 49.08 39.14 14.39 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.464 0.649 . . . . 0.0 109.951 -173.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.72 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 1.8 t -66.73 149.91 49.85 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.555 -176.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -104.52 22.61 14.67 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.148 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -126.17 -58.17 1.37 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.069 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 7.8 p -83.74 -44.45 14.42 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.318 0.58 . . . . 0.0 110.034 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -86.24 82.79 7.9 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.148 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.445 ' O ' ' HD3' ' A' ' 67' ' ' LYS . 14.1 t -142.88 174.28 10.8 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.83 -179.412 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.508 ' SG ' ' HB2' ' A' ' 66' ' ' CYS . 48.7 t -114.01 145.19 41.9 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.1 0.476 . . . . 0.0 110.939 -178.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -102.26 -4.79 25.14 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.87 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.622 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 61.7 m -77.98 151.07 33.81 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.798 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 63.2 p -121.23 169.47 10.53 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.453 -178.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.49 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 14.4 m -68.97 -27.07 65.39 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.172 0.51 . . . . 0.0 110.574 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -81.17 -34.4 32.4 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.28 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -153.84 131.86 3.38 Favored Glycine 0 N--CA 1.436 -1.304 0 C-N-CA 120.323 -0.942 . . . . 0.0 112.511 -177.184 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 4.4 t -86.27 135.86 33.38 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -93.47 -28.02 16.35 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -176.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 21.7 p -92.97 -30.68 15.23 Favored 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.829 -178.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.5 9.6 52.65 Favored Glycine 0 N--CA 1.444 -0.831 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.883 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -90.64 -4.6 56.68 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.956 0.407 . . . . 0.0 110.303 178.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 65.67 26.55 11.46 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.213 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.629 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 4.4 p -66.82 -46.94 73.59 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 176.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.49 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 52.0 p 50.78 72.79 0.32 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 114.915 -1.038 . . . . 0.0 113.184 176.051 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 111.96 140.26 8.0 Favored Glycine 0 N--CA 1.444 -0.816 0 C-N-CA 120.713 -0.756 . . . . 0.0 111.876 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.71 -29.61 86.2 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.103 2.536 . . . . 0.0 112.846 -177.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -64.16 -39.23 93.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.979 0.419 . . . . 0.0 111.229 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.6 t -106.16 17.34 23.66 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.288 0.565 . . . . 0.0 109.941 -179.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.629 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 19.3 t -86.64 111.01 20.24 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.124 -178.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -106.3 -2.5 22.24 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.716 -177.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.9 m -71.72 154.63 41.21 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.636 -179.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . 0.537 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -74.53 -179.56 41.92 Favored Glycine 0 N--CA 1.443 -0.875 0 C-N-CA 120.477 -0.868 . . . . 0.0 111.258 176.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.416 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 6.6 m -80.31 4.28 18.3 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.893 0.377 . . . . 0.0 111.88 -178.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.0 m -109.98 12.7 23.62 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.917 0.389 . . . . 0.0 110.587 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 22.2 t -86.59 166.88 15.06 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.559 -178.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.5 m -62.62 -26.52 68.66 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -177.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.622 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 6.1 p -81.18 -6.71 59.15 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.779 0.323 . . . . 0.0 111.8 -178.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.537 ' HG3' ' O ' ' A' ' 61' ' ' GLY . 13.2 mmtp . . . . . 0 C--O 1.261 1.659 0 CA-C-O 117.955 -1.021 . . . . 0.0 111.326 -177.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? . . . . . 0 CA--C 1.514 -0.416 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.59 ' SG ' ' HB2' ' A' ' 27' ' ' CYS . 88.5 m -57.82 139.81 53.23 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.481 -0.782 . . . . 0.0 111.217 178.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.8 p -80.69 174.22 11.83 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.793 -178.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.8 p -61.84 -28.55 69.57 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.126 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.85 -43.45 75.44 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.547 179.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.732 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 18.3 t -69.97 -36.33 75.14 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.033 -178.213 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.9 ttt180 -79.84 -9.24 59.64 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.437 -177.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.9 t -80.16 161.86 25.02 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.553 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 9.4 pt-20 -136.31 123.77 14.58 Favored Pre-proline 0 C--N 1.316 -0.886 0 CA-C-O 120.784 0.326 . . . . 0.0 111.437 -179.408 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.553 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 40.6 Cg_endo -64.36 157.9 71.89 Favored 'Cis proline' 0 C--N 1.348 0.525 0 C-N-CA 123.158 -1.601 . . . . 0.0 112.038 0.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.664 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 44.4 t -60.9 130.36 46.06 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.948 -177.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 78.3 mm-40 -101.94 13.75 33.9 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.897 -177.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.732 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -70.45 -16.49 62.94 Favored 'General case' 0 C--O 1.209 -1.043 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.057 -179.314 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.79 -30.26 56.3 Favored Glycine 0 CA--C 1.525 0.664 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.69 -179.243 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 53.1 p -64.64 -48.5 74.61 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -130.49 -46.18 1.08 Allowed 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 120.664 0.269 . . . . 0.0 111.384 -178.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.625 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 8.3 t 64.06 82.29 0.19 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.362 -179.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -117.51 20.07 13.7 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.491 -177.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.59 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 24.5 p -75.46 163.06 27.79 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.042 178.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -103.12 25.25 27.85 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.183 -1.008 . . . . 0.0 111.549 177.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.411 ' CD ' ' H ' ' A' ' 30' ' ' GLY . 0.0 OUTLIER 66.14 -175.19 0.19 Allowed 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.337 0.655 . . . . 0.0 110.444 -177.676 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.411 ' H ' ' CD ' ' A' ' 29' ' ' GLU . . . 87.28 10.29 71.44 Favored Glycine 0 N--CA 1.434 -1.442 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 -176.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.579 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 7.3 p -100.49 -26.45 13.85 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 114.651 -0.775 . . . . 0.0 109.685 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 46.6 p 53.06 36.43 22.18 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.945 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 62.6 m -66.14 167.34 10.22 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.701 179.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -117.91 11.87 13.59 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.316 -0.857 . . . . 0.0 108.841 176.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.404 ' HB3' ' HB3' ' A' ' 19' ' ' CYS . . . -110.68 -67.74 0.97 Allowed 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.467 -178.442 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.65 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 28.2 p -77.91 -44.62 26.43 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-O 121.368 0.604 . . . . 0.0 109.443 178.677 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.4 ' O ' ' HB ' ' A' ' 38' ' ' THR . 58.4 tttp -84.17 108.64 17.19 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.098 178.301 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.4 ' HB ' ' O ' ' A' ' 37' ' ' LYS . 10.0 t -179.26 164.16 1.34 Allowed 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 178.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.6 t -96.21 143.69 27.08 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -103.17 5.44 37.78 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.892 0.377 . . . . 0.0 111.48 -177.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.468 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 60.9 m -85.61 146.7 26.75 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.014 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 60.2 p -120.66 161.52 21.24 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.489 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 35.4 m -63.03 -27.76 69.63 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.091 0.472 . . . . 0.0 110.413 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.93 -36.01 79.42 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.952 178.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -164.01 128.98 1.91 Allowed Glycine 0 N--CA 1.437 -1.27 0 C-N-CA 120.351 -0.928 . . . . 0.0 112.73 -179.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 6.8 t -79.18 124.41 28.32 Favored 'General case' 0 N--CA 1.439 -1.005 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.468 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 33.4 mmtp -76.35 -42.82 43.48 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.719 -176.09 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 19.8 p -84.21 -38.3 20.76 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 120.901 0.381 . . . . 0.0 110.749 -177.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.12 3.44 27.88 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.819 -0.705 . . . . 0.0 113.107 179.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.645 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 73.5 mmtt -81.55 -3.9 54.52 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.981 0.391 . . . . 0.0 111.008 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 65.34 24.98 12.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.962 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.496 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.3 p -71.7 -47.63 52.75 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 176.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.489 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 82.5 p 51.94 28.92 5.56 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 115.135 -0.939 . . . . 0.0 113.472 175.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 164.09 140.77 2.95 Favored Glycine 0 N--CA 1.436 -1.325 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -56.36 -37.31 97.24 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.976 2.451 . . . . 0.0 113.532 -177.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -67.4 -40.88 85.66 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.848 0.356 . . . . 0.0 111.019 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 40.7 m -94.37 15.34 17.86 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.601 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.496 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 24.5 t -85.4 135.07 34.03 Favored 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.15 -179.082 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -113.15 -6.28 13.66 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.218 -179.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.645 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 13.9 m -77.52 157.51 30.36 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.836 -178.185 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -86.05 -108.99 0.76 Allowed Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.377 -179.024 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.2 m -135.16 -2.39 2.54 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 120.543 0.211 . . . . 0.0 111.414 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 18.6 m -106.27 5.11 29.47 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.941 0.401 . . . . 0.0 111.457 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 29.9 t -82.8 167.0 18.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.333 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.7 t -70.61 -16.33 62.83 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.798 -177.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.438 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 24.7 p -88.72 2.11 53.95 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.366 -0.533 . . . . 0.0 111.322 179.396 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 25.2 mmtp . . . . . 0 C--O 1.261 1.704 0 CA-C-O 117.67 -1.157 . . . . 0.0 110.866 -179.107 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt . . . . . 0 N--CA 1.468 0.468 0 CA-C-O 121.044 0.449 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.571 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 91.5 m -85.65 152.87 22.76 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-O 121.371 0.605 . . . . 0.0 111.838 -179.591 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 81.3 p -92.02 176.27 6.57 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.81 -177.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.9 m -67.16 -21.73 65.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.148 0.499 . . . . 0.0 110.079 178.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.0 -47.56 36.26 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.32 178.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.649 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 10.2 t -66.44 -33.56 75.97 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.382 0.611 . . . . 0.0 109.667 179.478 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.7 mmt180 -91.22 21.27 4.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.844 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.6 t -94.45 -178.55 4.61 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 178.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.435 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 7.0 pt-20 -131.09 101.93 16.18 Favored Pre-proline 0 CA--C 1.543 0.687 0 CA-C-O 120.709 0.29 . . . . 0.0 111.292 -178.448 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.435 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 87.9 Cg_endo -81.41 -174.94 14.79 Favored 'Cis proline' 0 N--CA 1.461 -0.416 0 C-N-CA 123.625 -1.406 . . . . 0.0 111.072 -0.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.731 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 48.6 t -59.49 127.9 34.35 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.038 0.447 . . . . 0.0 110.829 -179.653 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -112.04 17.62 19.46 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 -179.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.731 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 0.5 OUTLIER -64.86 -23.15 67.15 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.348 -177.341 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.71 -12.04 9.18 Favored Glycine 0 CA--C 1.528 0.883 0 C-N-CA 121.303 -0.475 . . . . 0.0 113.723 -177.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.4 m -68.6 -35.58 77.53 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 122.727 -0.278 . . . . 0.0 110.992 179.078 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 69.3 mttm -146.19 -43.28 0.2 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 122.899 0.48 . . . . 0.0 110.323 178.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.666 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 10.5 t 67.24 74.12 0.32 Allowed 'General case' 0 CA--C 1.504 -0.8 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.051 -179.133 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -104.82 10.55 34.44 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 114.572 -1.195 . . . . 0.0 110.84 -175.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.552 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 21.0 p -75.75 -178.71 4.36 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.155 0.502 . . . . 0.0 111.072 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.92 -141.36 10.57 Favored Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 115.789 -0.642 . . . . 0.0 111.915 177.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.461 ' HA ' ' HE2' ' A' ' 37' ' ' LYS . 8.2 mp0 -123.77 13.65 9.28 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.168 0.508 . . . . 0.0 110.734 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -84.48 -30.79 26.43 Favored Glycine 0 C--N 1.306 -1.112 0 C-N-CA 120.819 -0.705 . . . . 0.0 113.183 -177.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.795 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 20.3 p -67.96 -34.13 75.97 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -176.288 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 58.9 p 53.1 33.7 15.64 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.8 0.809 . . . . 0.0 109.994 -173.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.795 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -62.56 117.04 5.68 Favored 'General case' 0 C--O 1.222 -0.365 0 CA-C-N 114.276 -1.329 . . . . 0.0 110.37 -178.655 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -86.11 20.25 2.37 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.385 0.612 . . . . 0.0 110.831 -177.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -109.42 -48.92 3.17 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.029 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.63 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 26.2 p -94.24 -41.5 9.44 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.569 177.673 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.589 ' HG3' ' SG ' ' A' ' 36' ' ' CYS . 26.3 mtpp -99.26 88.86 4.03 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.837 -178.508 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 12.3 t -144.83 172.2 13.35 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.738 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.481 ' HA ' ' O ' ' A' ' 66' ' ' CYS . 35.8 t -92.17 133.9 35.36 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -83.9 -17.7 39.89 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.155 0.502 . . . . 0.0 110.224 -177.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.431 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 37.4 m -69.57 136.34 51.17 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.001 -176.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 82.3 p -99.64 166.26 11.21 Favored 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 178.106 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.484 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 46.9 m -64.03 -26.79 68.72 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.922 0.392 . . . . 0.0 111.8 -178.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -88.47 -30.7 19.2 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.717 -179.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -143.34 119.29 1.32 Allowed Glycine 0 N--CA 1.445 -0.753 0 C-N-CA 119.784 -1.198 . . . . 0.0 113.697 -175.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.412 ' HA ' ' HB3' ' A' ' 41' ' ' CYS . 17.5 t -78.07 126.99 31.62 Favored 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 177.419 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.431 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 3.2 mmmp? -82.05 -36.57 27.56 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -176.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.508 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 21.5 p -91.95 -37.93 12.56 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.897 -177.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.2 11.36 13.74 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 120.739 -0.743 . . . . 0.0 113.816 178.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.755 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 32.4 mmtp -88.23 -3.2 58.9 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 117.331 0.565 . . . . 0.0 110.985 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 65.61 17.49 10.92 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.139 -177.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.56 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.2 p -64.57 -47.29 79.26 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 177.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.484 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 53.2 p 49.88 44.54 25.23 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.189 -0.914 . . . . 0.0 113.063 174.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.435 ' O ' ' HB2' ' A' ' 58' ' ' CYS . . . 135.1 150.28 6.02 Favored Glycine 0 N--CA 1.438 -1.206 0 C-N-CA 120.624 -0.798 . . . . 0.0 111.587 179.738 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -61.81 -22.53 74.56 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.845 2.363 . . . . 0.0 112.559 -177.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -63.12 -52.56 62.07 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.645 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.1 m -104.12 20.73 17.74 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.788 -177.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.56 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 48.8 t -86.91 137.58 32.26 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-O 121.213 0.53 . . . . 0.0 111.229 -178.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -118.67 3.26 11.71 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.569 -179.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.755 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 5.5 m -91.15 117.43 29.61 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 -179.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -97.56 82.4 0.69 Allowed Glycine 0 C--N 1.303 -1.257 0 CA-C-N 115.517 -0.765 . . . . 0.0 112.578 -175.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.448 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 50.8 m 63.77 170.28 0.16 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.016 0.526 . . . . 0.0 111.386 -178.429 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.4 m 70.87 -25.16 0.17 Allowed 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 176.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 38.0 t -72.05 167.73 19.58 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 121.919 -0.488 . . . . 0.0 111.288 -176.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 32.3 t -62.59 -27.44 69.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.592 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.481 ' O ' ' HA ' ' A' ' 39' ' ' CYS . 32.1 p -85.87 8.44 20.16 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.018 179.56 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.448 ' HD2' ' H ' ' A' ' 62' ' ' SER . 1.0 OUTLIER . . . . . 0 C--O 1.262 1.727 0 CA-C-O 118.037 -0.982 . . . . 0.0 111.064 -178.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt . . . . . 0 CA--C 1.519 -0.246 0 CA-C-O 120.963 0.411 . . . . 0.0 111.246 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.807 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 57.4 m -88.49 145.04 25.98 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-O 121.298 0.57 . . . . 0.0 112.27 -176.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.3 p -77.16 176.05 9.09 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.775 -178.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.8 m -62.45 -32.8 73.73 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.135 178.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.9 -52.22 64.97 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.271 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.669 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 43.5 t -67.15 -28.67 68.31 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.571 0.7 . . . . 0.0 110.81 -179.366 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.1 ttm180 -79.66 -5.13 54.49 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.371 -177.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.9 m -85.44 167.48 15.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.086 0.47 . . . . 0.0 111.924 -177.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.441 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 76.6 mm-40 -127.59 108.72 20.78 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.683 177.442 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.441 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 73.2 Cg_endo -76.15 169.67 73.86 Favored 'Cis proline' 0 C--O 1.237 0.458 0 C-N-CA 123.457 -1.476 . . . . 0.0 112.157 0.055 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.669 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 41.7 t -61.03 140.36 57.86 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.004 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 -117.28 19.81 13.95 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.296 -177.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.614 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.1 OUTLIER -67.46 -31.25 71.29 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.981 0.419 . . . . 0.0 109.922 179.899 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 72.58 -168.03 53.18 Favored Glycine 0 N--CA 1.442 -0.924 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.633 178.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.8 p -80.22 -11.98 59.68 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.825 0.345 . . . . 0.0 110.675 178.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -77.51 -42.08 36.92 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 178.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 8.7 t 65.53 99.22 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.516 -1.22 . . . . 0.0 111.296 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -100.83 -0.8 36.32 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.375 -0.829 . . . . 0.0 112.513 -176.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.594 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 7.3 p -91.94 164.13 13.76 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 120.837 0.351 . . . . 0.0 111.677 -176.408 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -86.21 148.33 22.17 Favored Glycine 0 N--CA 1.441 -1.014 0 N-CA-C 109.101 -1.6 . . . . 0.0 109.101 172.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -77.72 89.57 3.99 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 117.769 0.785 . . . . 0.0 112.163 -174.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -158.17 25.25 0.4 Allowed Glycine 0 N--CA 1.435 -1.383 0 N-CA-C 110.022 -1.231 . . . . 0.0 110.022 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.807 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 26.2 p -115.12 -28.73 6.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.143 -0.528 . . . . 0.0 112.121 -175.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 57.4 p 54.27 29.07 10.07 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.4 0.619 . . . . 0.0 110.015 -171.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.606 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 2.1 t -57.64 140.25 51.62 Favored 'General case' 0 C--N 1.346 0.453 0 CA-C-N 114.744 -1.116 . . . . 0.0 110.273 -177.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -93.8 16.8 13.24 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 120.922 0.391 . . . . 0.0 111.171 -176.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -116.53 -57.02 2.23 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.561 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.614 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 6.1 p -89.41 -43.15 11.08 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.717 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -84.39 74.21 10.39 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 121.683 0.754 . . . . 0.0 109.825 178.097 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.9 t -125.77 149.74 48.32 Favored 'General case' 0 N--CA 1.431 -1.412 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.988 -179.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.1 t -100.58 128.99 46.46 Favored 'General case' 0 N--CA 1.442 -0.869 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 177.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -90.99 -1.52 57.81 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.487 -178.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.566 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 61.6 m -75.93 136.68 40.07 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.637 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 61.0 p -102.74 165.01 11.3 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.091 -178.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.1 m -71.23 -10.35 59.61 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.182 0.515 . . . . 0.0 110.356 177.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -89.86 -32.31 16.95 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.745 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -164.71 132.82 2.79 Favored Glycine 0 N--CA 1.435 -1.399 0 C-N-CA 120.796 -0.716 . . . . 0.0 111.991 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 4.7 t -72.73 136.37 45.51 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 179.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.44 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 75.8 mmtt -95.97 -22.35 17.45 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 111.938 0.348 . . . . 0.0 111.938 -176.13 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.479 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 21.8 p -99.69 -39.97 8.0 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.499 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.65 3.62 25.24 Favored Glycine 0 N--CA 1.437 -1.258 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.948 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.479 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 46.3 mmtm -81.37 -6.04 58.5 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 120.964 0.411 . . . . 0.0 110.251 178.318 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 68.94 20.91 7.71 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.664 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.525 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 4.7 p -71.2 -41.57 70.11 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.418 178.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.1 p 52.93 29.48 7.89 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.857 0.863 . . . . 0.0 113.297 177.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 149.32 159.18 8.46 Favored Glycine 0 N--CA 1.44 -1.1 0 C-N-CA 119.887 -1.149 . . . . 0.0 112.838 178.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.429 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 58.0 Cg_endo -69.64 -11.95 32.09 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 123.113 2.542 . . . . 0.0 112.779 -178.229 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -84.08 -10.07 58.11 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.029 0.442 . . . . 0.0 110.835 -178.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.8 m -142.58 26.36 1.77 Allowed 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.146 0.498 . . . . 0.0 110.112 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.525 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 0.5 OUTLIER -71.11 122.76 20.69 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.998 -177.919 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -100.05 4.28 44.59 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.936 -178.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.445 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.2 p -137.91 157.45 46.38 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.05 -174.353 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -150.15 171.89 30.05 Favored Glycine 0 N--CA 1.439 -1.101 0 C-N-CA 120.022 -1.085 . . . . 0.0 113.563 -178.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.5 m 63.53 -84.79 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 124.489 1.116 . . . . 0.0 113.855 177.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.2 m -117.4 66.33 0.73 Allowed 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -174.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 41.3 t -112.84 166.61 11.22 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 173.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.447 ' HB2' ' HA ' ' A' ' 48' ' ' CYS . 7.4 m -64.61 -9.39 19.05 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 122.719 0.407 . . . . 0.0 112.028 -177.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.566 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 25.0 p -104.62 -11.02 17.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.722 0.296 . . . . 0.0 111.227 177.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.5 mmpp? . . . . . 0 C--O 1.251 1.164 0 CA-C-O 117.317 -1.325 . . . . 0.0 110.156 -178.9 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 42.7 mtmt . . . . . 0 CA--C 1.515 -0.4 0 CA-C-O 121.251 0.548 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.477 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 85.6 m -98.68 130.91 45.19 Favored 'General case' 0 C--N 1.301 -1.503 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.003 178.065 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.6 p -76.35 178.09 6.79 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.085 0.469 . . . . 0.0 111.871 -176.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.517 ' HA ' ' HG2' ' A' ' 15' ' ' ARG . 16.6 m -57.37 -33.23 67.58 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.143 -179.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.5 -44.86 81.44 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.331 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.405 ' HB3' ' HB3' ' A' ' 10' ' ' CYS . 37.4 t -69.97 -34.49 73.46 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.096 0.474 . . . . 0.0 111.208 -177.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.517 ' HG2' ' HA ' ' A' ' 12' ' ' SER . 9.2 ptm85 -78.36 -6.81 56.24 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.519 -0.472 . . . . 0.0 111.475 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.3 m -79.5 153.43 29.58 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 179.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -126.41 119.75 23.29 Favored Pre-proline 0 C--N 1.312 -1.028 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.295 179.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -69.61 160.89 86.83 Favored 'Cis proline' 0 C--O 1.243 0.748 0 C-N-CA 123.438 -1.484 . . . . 0.0 111.966 -0.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -51.82 130.78 29.77 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.935 -177.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -105.52 8.7 33.49 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.602 -177.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.418 ' HB3' ' CB ' ' A' ' 36' ' ' CYS . 0.1 OUTLIER -62.02 -35.89 79.91 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.846 0.355 . . . . 0.0 110.635 179.944 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 62.12 -135.83 45.8 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.792 178.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.0 m -100.18 -6.75 25.66 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 120.648 0.261 . . . . 0.0 111.061 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -79.03 -45.3 20.47 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 178.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER 58.47 91.96 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.643 177.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -88.74 -12.96 40.74 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.908 -175.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.477 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 30.6 p -79.07 159.67 27.44 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.513 -0.475 . . . . 0.0 111.548 -177.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -87.45 -155.4 28.28 Favored Glycine 0 N--CA 1.448 -0.527 0 CA-C-N 115.913 -0.585 . . . . 0.0 112.673 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -83.21 157.89 22.53 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.962 0.411 . . . . 0.0 111.15 -178.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 94.38 9.58 58.96 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.386 178.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.455 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 17.1 t -97.35 -61.64 1.37 Allowed 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.805 -179.401 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 81.6 p 49.41 39.09 15.64 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.239 0.616 . . . . 0.0 111.661 -177.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.455 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -54.73 147.73 14.2 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.723 178.921 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -85.58 28.44 0.76 Allowed 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.616 0.722 . . . . 0.0 110.205 -178.374 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -140.51 -61.06 0.51 Allowed 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.457 -179.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.418 ' CB ' ' HB3' ' A' ' 21' ' ' CYS . 20.7 p -88.27 -40.41 13.66 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -177.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.1 ttmt -116.75 53.99 0.87 Allowed 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.281 0.562 . . . . 0.0 111.741 -172.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.473 ' O ' ' HD3' ' A' ' 67' ' ' LYS . 13.9 t -121.5 179.32 4.48 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.772 178.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.467 ' HA ' ' HZ2' ' A' ' 67' ' ' LYS . 35.1 t -93.52 156.89 16.48 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.2 0.524 . . . . 0.0 111.061 -178.578 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -117.33 0.18 12.16 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.481 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.456 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 69.1 m -80.6 149.48 29.87 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.118 179.289 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 68.0 p -118.87 168.52 10.69 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.346 -178.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.6 m -65.81 -25.73 67.36 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.221 0.534 . . . . 0.0 110.278 178.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -72.38 -36.24 68.67 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.361 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -166.65 135.47 3.69 Favored Glycine 0 N--CA 1.433 -1.535 0 C-N-CA 120.205 -0.997 . . . . 0.0 112.75 -178.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 5.1 t -77.6 124.64 28.19 Favored 'General case' 0 C--N 1.313 -1.02 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 177.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -84.35 -29.4 26.31 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -176.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.508 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 20.2 p -89.91 -39.88 12.74 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 120.191 -0.603 . . . . 0.0 110.273 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.99 0.34 30.14 Favored Glycine 0 N--CA 1.443 -0.877 0 C-N-CA 120.913 -0.66 . . . . 0.0 112.762 178.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.508 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 30.0 mmtp -81.31 -0.26 40.2 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.292 0.568 . . . . 0.0 110.188 179.43 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 64.41 36.57 8.86 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 114.647 -1.161 . . . . 0.0 112.131 176.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.487 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 0.8 OUTLIER -81.4 -46.61 14.38 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.088 176.271 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 48.2 p 52.94 34.65 17.28 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 177.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.484 ' O ' ' HB2' ' A' ' 58' ' ' CYS . . . 166.21 161.6 15.67 Favored Glycine 0 N--CA 1.425 -2.034 0 C-N-CA 120.339 -0.934 . . . . 0.0 111.653 178.341 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -75.55 -44.47 0.3 Allowed 'Trans proline' 0 N--CA 1.46 -0.451 0 C-N-CA 122.679 2.252 . . . . 0.0 112.683 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -77.38 -16.32 58.92 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.162 0.506 . . . . 0.0 110.553 -178.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 40.1 m -106.6 13.03 28.74 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.481 177.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.487 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 47.1 t -86.69 135.54 33.36 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.552 -179.277 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 32.0 mtmt -109.39 -7.85 15.15 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.04 -178.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 34.5 m -77.47 157.32 30.52 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.166 -177.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -90.59 -85.2 1.39 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.971 -0.633 . . . . 0.0 113.368 -178.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 54.3 p -147.42 -30.14 0.33 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -177.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 35.8 m -92.4 47.16 1.29 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.102 0.477 . . . . 0.0 111.637 -177.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 16.1 t -124.22 165.23 17.98 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 178.033 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 8.8 m -66.62 -19.7 65.83 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.885 -177.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.456 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 27.7 p -93.72 22.09 5.85 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.811 0.338 . . . . 0.0 111.03 -179.413 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.473 ' HD3' ' O ' ' A' ' 38' ' ' THR . 36.2 mmtm . . . . . 0 C--O 1.262 1.711 0 CA-C-O 117.285 -1.34 . . . . 0.0 110.598 -178.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp . . . . . 0 N--CA 1.455 -0.207 0 CA-C-O 120.797 0.332 . . . . 0.0 111.817 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.639 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 87.9 m -98.47 139.1 34.71 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 120.985 0.421 . . . . 0.0 111.722 179.414 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.2 p -89.66 -178.33 5.51 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.618 -179.382 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.3 m -64.33 -28.66 69.86 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.804 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.0 -44.86 91.38 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.882 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.557 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 48.9 t -77.21 -31.23 55.1 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.662 -179.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.658 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 1.8 mmp_? -74.25 -9.17 58.34 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.129 -0.487 . . . . 0.0 112.178 -179.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 52.7 m -88.23 159.28 18.2 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 177.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.434 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 43.3 mt-10 -126.54 119.13 22.98 Favored Pre-proline 0 C--N 1.309 -1.191 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.434 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 5.1 Cg_exo -77.09 -178.19 23.4 Favored 'Cis proline' 0 C--N 1.348 0.529 0 C-N-CA 123.191 -1.587 . . . . 0.0 112.126 1.518 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.5 m -65.57 139.62 58.46 Favored 'General case' 0 CA--C 1.503 -0.861 0 CA-C-O 121.535 0.683 . . . . 0.0 111.941 -178.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 -114.26 15.75 18.06 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.835 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.63 ' HB3' ' HA ' ' A' ' 25' ' ' CYS . 1.9 m -63.08 -31.53 72.69 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.843 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 72.17 -148.19 42.23 Favored Glycine 0 N--CA 1.438 -1.21 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.791 177.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.5 m -88.42 -18.53 28.14 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-O 120.922 0.391 . . . . 0.0 110.082 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -77.66 -48.19 17.39 Favored 'General case' 0 CA--C 1.499 -1.0 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.943 -179.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.63 ' HA ' ' HB3' ' A' ' 21' ' ' CYS . 1.3 t 72.42 98.17 0.07 Allowed 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 114.614 -1.175 . . . . 0.0 110.119 -176.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -80.69 -24.04 39.15 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.771 -1.104 . . . . 0.0 112.544 -175.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.639 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 18.6 p -79.28 156.23 28.17 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 119.929 -0.709 . . . . 0.0 110.477 -179.704 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -83.95 -66.77 1.47 Allowed Glycine 0 N--CA 1.433 -1.508 0 C-N-CA 120.215 -0.993 . . . . 0.0 111.442 179.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -169.88 168.16 8.87 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 -178.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 101.93 32.45 5.02 Favored Glycine 0 N--CA 1.441 -0.983 0 C-N-CA 120.579 -0.819 . . . . 0.0 113.557 177.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.412 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 30.1 p -139.72 -37.58 0.49 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 117.323 0.561 . . . . 0.0 111.767 178.093 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 46.3 p 49.65 46.43 23.74 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 121.226 0.536 . . . . 0.0 111.285 -178.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 68.4 m -63.98 168.66 4.99 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.781 -179.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.413 ' HA ' ' HB ' ' A' ' 38' ' ' THR . . . -102.82 16.81 25.49 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.443 177.58 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -124.85 -70.34 0.76 Allowed 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.698 -178.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.616 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 29.4 p -86.49 -38.65 17.05 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.222 0.534 . . . . 0.0 111.637 -178.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.08 41.03 1.54 Allowed 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.514 -173.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.413 ' HB ' ' HA ' ' A' ' 34' ' ' ALA . 7.8 t -114.67 163.27 15.68 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.488 -175.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 51.3 t -109.07 140.64 42.34 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 176.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -98.76 3.6 47.57 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 120.704 0.288 . . . . 0.0 111.498 -177.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.541 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 85.0 m -80.02 164.25 23.58 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-O 120.928 0.394 . . . . 0.0 110.954 178.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 29.7 p -131.22 162.47 29.9 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.516 -179.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.9 m -69.37 -22.18 63.75 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.948 0.404 . . . . 0.0 110.922 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -86.63 -2.24 58.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.388 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 169.65 128.52 1.02 Allowed Glycine 0 N--CA 1.44 -1.08 0 C-N-CA 120.301 -0.952 . . . . 0.0 112.529 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.8 t -78.59 128.08 33.02 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.541 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 32.1 mmmt -87.82 -30.5 20.17 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -175.117 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.449 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 19.6 p -88.79 -36.79 15.88 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.285 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 110.66 -0.51 29.06 Favored Glycine 0 N--CA 1.442 -0.923 0 C-N-CA 120.833 -0.699 . . . . 0.0 113.056 178.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.449 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 72.2 mmtt -80.24 -2.05 43.32 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 117.065 0.432 . . . . 0.0 110.907 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 67.88 21.93 8.85 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.131 177.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.518 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 3.0 p -72.54 -44.88 61.54 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.18 178.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 67.2 p 53.49 26.51 5.6 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.988 0.915 . . . . 0.0 113.114 176.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.46 ' O ' ' HB2' ' A' ' 58' ' ' CYS . . . 158.09 160.59 10.35 Favored Glycine 0 N--CA 1.439 -1.149 0 C-N-CA 120.76 -0.734 . . . . 0.0 111.335 -179.527 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.406 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 45.9 Cg_endo -69.04 -12.27 33.84 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.667 2.245 . . . . 0.0 113.533 -177.402 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -79.41 -50.73 10.36 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.864 0.364 . . . . 0.0 111.084 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 24.1 t -90.78 7.75 38.17 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 120.953 0.406 . . . . 0.0 110.1 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.518 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 4.5 t -70.13 109.49 4.63 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.82 179.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -110.28 1.42 18.56 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.452 -177.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.2 p -98.08 152.06 19.72 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.663 178.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . 0.45 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -67.31 -177.6 10.12 Favored Glycine 0 CA--C 1.523 0.554 0 CA-C-N 116.082 -0.508 . . . . 0.0 114.239 -175.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 20.1 m -82.14 6.22 17.18 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 123.074 0.55 . . . . 0.0 111.76 -177.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.9 m -107.52 11.3 28.88 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.961 0.41 . . . . 0.0 110.34 178.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . 0.486 ' SG ' ' N ' ' A' ' 65' ' ' SER . 53.4 t -84.38 173.93 10.51 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.954 -179.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.486 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 8.9 m -64.82 -31.85 73.27 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.426 -179.163 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.548 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 26.0 p -81.6 10.63 5.67 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-O 120.843 0.354 . . . . 0.0 111.233 -179.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.548 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 15.0 mmtp . . . . . 0 C--O 1.266 1.934 0 CA-C-O 117.88 -1.057 . . . . 0.0 110.828 -177.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . 0.469 ' HB2' ' HA3' ' A' ' 28' ' ' GLY . 31.5 mmmt . . . . . 0 N--CA 1.471 0.602 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.604 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 91.5 m -77.08 130.93 38.05 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 121.288 0.566 . . . . 0.0 112.16 -178.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 35.8 p -87.19 177.57 7.14 Favored 'General case' 0 N--CA 1.431 -1.393 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.253 -179.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.5 m -58.98 -27.02 64.99 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.753 -179.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.34 -45.0 77.68 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 120.856 0.36 . . . . 0.0 110.814 178.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.644 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 5.4 t -78.07 -26.0 47.97 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.065 0.46 . . . . 0.0 110.534 -178.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 32.7 mmt180 -74.66 -17.88 60.62 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.052 179.076 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.3 t -62.6 159.64 15.57 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.61 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.456 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 37.5 mt-10 -132.32 107.07 13.38 Favored Pre-proline 0 C--N 1.308 -1.2 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.887 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.456 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 73.1 Cg_endo -74.18 170.96 69.41 Favored 'Cis proline' 0 C--O 1.243 0.732 0 C-N-CA 123.517 -1.451 . . . . 0.0 112.476 0.106 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.632 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 21.5 t -55.98 143.67 31.36 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.867 -178.688 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -120.79 15.24 11.77 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.468 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.644 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 0.5 OUTLIER -70.8 -4.01 21.81 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.054 0.454 . . . . 0.0 110.94 179.535 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.77 -15.37 73.6 Favored Glycine 0 CA--C 1.521 0.454 0 C-N-CA 121.158 -0.544 . . . . 0.0 112.583 178.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 t -73.18 -47.51 43.12 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.649 -0.324 . . . . 0.0 110.76 179.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -140.91 -43.57 0.39 Allowed 'General case' 0 C--O 1.237 0.43 0 CA-C-N 116.66 -0.245 . . . . 0.0 111.247 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 16.0 t 74.02 100.84 0.07 Allowed 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.99 0.806 . . . . 0.0 110.988 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -125.52 13.14 8.12 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.894 -177.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.604 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 15.1 p -84.11 -175.53 5.84 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.254 0.549 . . . . 0.0 110.858 -178.204 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.469 ' HA3' ' HB2' ' A' ' 9' ' ' LYS . . . -88.59 130.92 10.39 Favored Glycine 0 N--CA 1.425 -2.085 0 N-CA-C 109.431 -1.468 . . . . 0.0 109.431 173.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.0 18.82 0.08 Allowed 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -176.249 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . 0.442 ' H ' ' C ' ' A' ' 28' ' ' GLY . . . -110.63 11.13 30.33 Favored Glycine 0 N--CA 1.436 -1.356 0 N-CA-C 111.151 -0.78 . . . . 0.0 111.151 177.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.839 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 15.4 p -80.49 -15.44 56.72 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 120.644 0.259 . . . . 0.0 110.415 179.552 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 82.8 p 57.34 26.53 12.54 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.868 0.867 . . . . 0.0 111.627 -177.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.839 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 6.6 t -62.86 127.9 33.38 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.822 179.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -92.15 32.18 1.19 Allowed 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.393 -177.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -128.65 -50.71 1.26 Allowed 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.174 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.496 ' CB ' ' HB3' ' A' ' 21' ' ' CYS . 25.3 p -98.09 -39.56 8.85 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.112 179.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -84.55 115.57 22.67 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-O 121.107 0.479 . . . . 0.0 110.891 -179.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.0 t -177.76 -178.34 0.71 Allowed 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 178.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -98.23 135.05 40.42 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 109.524 -0.546 . . . . 0.0 109.524 177.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -86.71 -6.01 58.96 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.208 -178.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.434 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 59.9 m -80.63 135.18 36.0 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.769 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 71.5 p -105.87 172.68 6.67 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.618 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 34.0 p -75.12 -10.0 59.07 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.167 0.508 . . . . 0.0 110.197 178.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -76.36 -40.99 49.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.971 177.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -169.01 136.96 4.3 Favored Glycine 0 N--CA 1.431 -1.659 0 C-N-CA 120.887 -0.673 . . . . 0.0 111.824 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 17.8 t -69.32 128.18 35.68 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.434 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 10.8 mmpt? -82.23 -40.03 22.21 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 -177.345 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.514 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 19.2 p -86.99 -36.5 18.21 Favored 'General case' 0 C--N 1.318 -0.804 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.908 -177.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 106.72 15.16 17.57 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.185 178.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.514 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 74.4 mmtt -94.75 1.59 55.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.954 0.407 . . . . 0.0 110.54 178.294 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 62.4 33.38 16.33 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.09 178.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.586 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.4 p -82.6 -47.35 12.19 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.985 177.407 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.3 p 52.69 37.74 24.39 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.942 0.897 . . . . 0.0 113.131 176.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 141.56 157.31 7.12 Favored Glycine 0 N--CA 1.437 -1.284 0 C-N-CA 120.161 -1.019 . . . . 0.0 112.302 178.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -61.24 -27.07 83.02 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.874 2.383 . . . . 0.0 112.709 -178.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -62.19 -54.58 38.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.84 0.352 . . . . 0.0 111.219 -179.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.7 m -99.69 20.12 14.65 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.291 -178.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.586 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 4.5 t -74.32 105.55 5.54 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-O 121.059 0.457 . . . . 0.0 110.514 -179.169 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -83.33 -22.05 33.0 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.92 -177.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.2 p -93.02 133.38 36.22 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 120.678 -0.409 . . . . 0.0 109.987 179.182 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -120.71 114.97 2.77 Favored Glycine 0 N--CA 1.439 -1.143 0 C-N-CA 120.602 -0.808 . . . . 0.0 112.126 -175.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.437 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 63.7 m 64.13 163.89 0.13 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 122.941 0.497 . . . . 0.0 112.163 -179.57 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.5 m 66.88 -24.37 0.11 Allowed 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 174.469 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 37.9 t -73.41 163.72 27.66 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 118.273 0.488 . . . . 0.0 111.414 -177.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.0 p -66.21 -26.7 67.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.03 -0.532 . . . . 0.0 112.048 -178.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.43 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 30.4 p -81.08 0.39 36.24 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.71 178.808 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.437 ' HD2' ' H ' ' A' ' 62' ' ' SER . 5.2 mmpp? . . . . . 0 C--O 1.262 1.743 0 CA-C-O 118.249 -0.882 . . . . 0.0 110.494 -179.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 50.3 mtpt . . . . . 0 N--CA 1.454 -0.238 0 CA-C-O 121.319 0.58 . . . . 0.0 109.49 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.567 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 67.8 m -122.07 160.77 24.32 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.742 -177.064 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 20.9 p -85.63 174.06 9.69 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.222 -179.018 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.7 m -57.61 -36.78 72.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.337 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.92 -46.06 89.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.416 -179.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.488 ' HB3' ' HB3' ' A' ' 10' ' ' CYS . 26.4 t -68.96 -30.29 68.7 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.101 0.477 . . . . 0.0 110.005 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 28.5 mmm180 -78.35 -2.82 40.05 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.551 178.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.8 m -84.06 165.57 18.43 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.664 0.269 . . . . 0.0 110.766 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -133.2 116.63 14.36 Favored Pre-proline 0 C--N 1.318 -0.767 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -70.81 173.29 48.99 Favored 'Cis proline' 0 C--O 1.235 0.327 0 C-N-CA 123.153 -1.603 . . . . 0.0 112.253 0.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.7 t -57.23 116.55 3.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.362 -178.306 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -102.39 13.56 34.26 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.001 0.429 . . . . 0.0 111.108 -176.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.684 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 4.7 t -70.4 -20.36 62.94 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.595 -179.41 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 59.02 -152.62 32.18 Favored Glycine 0 C--N 1.343 0.964 0 CA-C-N 115.284 -0.871 . . . . 0.0 113.04 177.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 67.1 m -95.69 -3.58 45.78 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-O 120.658 0.266 . . . . 0.0 110.464 177.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -71.6 -44.25 64.77 Favored 'General case' 0 CA--C 1.495 -1.136 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 176.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.661 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 4.8 t 55.58 92.82 0.03 OUTLIER 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 114.415 -1.266 . . . . 0.0 112.625 174.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -102.88 3.61 36.75 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.352 -179.492 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.493 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 29.1 p -87.89 174.92 8.05 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.697 179.292 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -98.07 -102.97 2.26 Favored Glycine 0 N--CA 1.44 -1.093 0 C-N-CA 120.607 -0.806 . . . . 0.0 111.359 178.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -139.66 161.73 36.83 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.89 28.05 7.57 Favored Glycine 0 N--CA 1.436 -1.344 0 C-N-CA 120.353 -0.927 . . . . 0.0 112.928 178.206 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.567 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 15.0 p -115.63 -23.89 8.53 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 117.044 0.422 . . . . 0.0 110.225 177.831 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 38.6 p 51.49 36.05 15.89 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.59 0.756 . . . . 0.0 112.281 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 74.2 m -75.21 171.9 13.35 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 121.083 0.468 . . . . 0.0 110.904 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -135.4 9.5 3.44 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 175.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.32 -58.87 1.8 Allowed 'General case' 0 CA--C 1.507 -0.69 0 CA-C-N 114.801 -1.09 . . . . 0.0 109.943 -178.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.684 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 31.8 p -86.41 -47.36 9.39 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -95.38 92.07 6.53 Favored 'General case' 0 N--CA 1.424 -1.756 0 CA-C-N 114.754 -1.112 . . . . 0.0 109.549 177.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.8 t -137.36 162.18 34.28 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 13.1 t -107.31 133.28 52.09 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 120.932 0.396 . . . . 0.0 110.057 -179.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -89.95 -6.32 55.8 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.16 0.505 . . . . 0.0 110.38 -177.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 38.0 m -79.3 145.1 33.68 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.97 -177.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 64.9 p -115.09 170.0 8.69 Favored 'General case' 0 N--CA 1.438 -1.058 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 178.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.444 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 2.8 p -73.62 -11.01 60.29 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.06 0.457 . . . . 0.0 111.151 178.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -90.59 -33.05 16.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.838 179.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -158.45 127.25 1.84 Allowed Glycine 0 N--CA 1.434 -1.499 0 C-N-CA 120.348 -0.929 . . . . 0.0 112.364 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 6.7 t -76.09 134.72 39.96 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp -96.15 -16.53 21.45 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -175.059 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.412 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 32.1 p -103.1 -39.34 6.92 Favored 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.277 178.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.36 5.34 26.48 Favored Glycine 0 N--CA 1.438 -1.176 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.74 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.412 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 75.1 mmtt -84.74 -2.25 57.36 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 120.935 0.398 . . . . 0.0 110.455 178.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 63.68 24.11 13.77 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.052 0.941 . . . . 0.0 111.179 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.488 ' O ' ' HB2' ' A' ' 57' ' ' SER . 3.9 p -70.77 -43.65 68.32 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 178.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.444 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 64.3 p 51.26 39.9 24.93 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.808 0.843 . . . . 0.0 112.899 176.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 145.04 149.37 5.01 Favored Glycine 0 N--CA 1.439 -1.162 0 C-N-CA 120.255 -0.974 . . . . 0.0 112.071 179.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -61.98 -26.13 78.4 Favored 'Trans proline' 0 CA--C 1.532 0.395 0 C-N-CA 123.021 2.481 . . . . 0.0 112.758 -177.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -71.28 -24.04 62.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.398 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.488 ' HB2' ' O ' ' A' ' 52' ' ' CYS . 23.6 m -119.14 15.99 13.22 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.226 0.536 . . . . 0.0 110.04 179.322 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.432 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 13.3 t -83.44 106.07 14.9 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.734 -176.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -95.8 -13.32 24.16 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.224 -177.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.2 p -89.58 148.93 23.08 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.915 -179.219 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -79.52 -167.08 33.65 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.934 -0.651 . . . . 0.0 113.837 -175.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.462 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 16.1 m -73.31 -13.45 61.12 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 123.299 0.64 . . . . 0.0 111.792 -177.567 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 45.4 m -86.62 18.37 3.4 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.777 0.323 . . . . 0.0 111.158 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 13.0 t -100.06 172.19 7.35 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 178.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 25.2 m -81.43 -11.04 59.38 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -176.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.422 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 25.9 p -93.29 15.97 14.32 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.835 0.35 . . . . 0.0 110.789 179.373 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.462 ' HG3' ' HA ' ' A' ' 62' ' ' SER . 9.0 mmtp . . . . . 0 C--O 1.263 1.782 0 CA-C-O 118.006 -0.997 . . . . 0.0 111.117 -177.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt . . . . . 0 N--CA 1.463 0.211 0 CA-C-O 120.951 0.405 . . . . 0.0 111.423 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.544 ' HB3' ' HB3' ' A' ' 14' ' ' CYS . 57.3 m -79.58 148.74 31.62 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.336 178.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.1 t -85.5 171.3 11.87 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.058 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.6 m -53.54 -32.08 49.12 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 123.205 0.602 . . . . 0.0 111.194 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.8 -45.35 94.24 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.429 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.712 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 29.4 t -75.23 -24.81 57.75 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.446 0.641 . . . . 0.0 110.256 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 77.5 mtp180 -84.62 4.99 29.76 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.72 -178.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.8 m -106.73 162.75 13.5 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.685 0.278 . . . . 0.0 110.725 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -126.87 117.98 22.34 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.184 178.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -74.1 178.06 35.24 Favored 'Cis proline' 0 C--O 1.239 0.553 0 C-N-CA 123.144 -1.607 . . . . 0.0 112.155 0.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.443 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 21.1 t -69.9 136.53 50.74 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.76 -176.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -112.36 6.91 19.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.49 -177.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.712 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 4.8 m -75.11 -11.2 60.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.661 0.267 . . . . 0.0 111.636 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.81 69.11 2.69 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.979 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.3 t -174.3 -61.72 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -115.13 -46.45 2.9 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.872 -0.603 . . . . 0.0 109.666 177.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 21' ' ' CYS . 38.3 t 60.96 100.41 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.163 -0.926 . . . . 0.0 112.466 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -100.56 23.78 9.89 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.212 178.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -63.27 148.29 48.64 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.94 178.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.27 163.09 37.23 Favored Glycine 0 N--CA 1.433 -1.549 0 N-CA-C 109.759 -1.336 . . . . 0.0 109.759 172.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -70.97 114.36 8.94 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 117.247 0.523 . . . . 0.0 110.09 -177.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 132.92 24.54 0.72 Allowed Glycine 0 N--CA 1.436 -1.321 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.269 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.413 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 45.9 t -91.68 146.42 23.79 Favored 'General case' 0 N--CA 1.439 -0.975 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 178.52 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.7 p -123.44 30.67 6.19 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.314 -179.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.413 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 21.0 t -68.76 163.9 23.03 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.258 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -117.17 25.27 10.59 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.022 0.439 . . . . 0.0 110.246 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -127.6 -59.42 1.21 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.439 -178.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 7.1 p -86.45 -39.58 16.19 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.007 0.432 . . . . 0.0 111.022 -179.186 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.2 tmtp? -104.21 91.68 4.03 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.025 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.6 t -173.96 -175.83 1.11 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.936 -179.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 39.2 t -113.82 137.44 51.65 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.916 0.388 . . . . 0.0 110.327 178.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 32.1 m-80 -93.97 -0.29 55.65 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.87 -178.387 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.499 ' HB3' ' HA ' ' A' ' 53' ' ' THR . 81.7 m -78.7 156.5 28.92 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.124 0.487 . . . . 0.0 111.525 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.3 p -137.81 169.55 17.59 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.261 178.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.0 m -67.9 -18.19 64.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.223 0.535 . . . . 0.0 110.469 178.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -68.22 -37.27 80.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.489 177.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -175.0 133.24 2.4 Favored Glycine 0 N--CA 1.434 -1.474 0 C-N-CA 120.85 -0.69 . . . . 0.0 111.912 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 4.8 t -72.63 116.29 12.93 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 178.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -74.43 -33.59 62.99 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.583 -174.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.561 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 28.2 p -86.8 -43.82 12.21 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.054 -0.659 . . . . 0.0 110.073 179.822 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.81 4.8 26.07 Favored Glycine 0 N--CA 1.436 -1.309 0 CA-C-N 115.74 -0.664 . . . . 0.0 112.432 -179.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.561 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 46.1 mmtm -79.51 -5.36 54.68 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.249 0.547 . . . . 0.0 109.696 177.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 68.76 30.41 4.86 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 114.772 -1.104 . . . . 0.0 110.884 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.508 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 5.3 p -80.3 -39.45 28.73 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.288 177.441 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.499 ' HA ' ' HB3' ' A' ' 41' ' ' CYS . 39.0 p 51.97 33.42 11.74 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 177.254 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 145.77 150.45 5.21 Favored Glycine 0 N--CA 1.441 -1.033 0 C-N-CA 120.168 -1.015 . . . . 0.0 112.268 178.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -55.98 -28.04 66.91 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.307 2.671 . . . . 0.0 113.407 -178.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -66.89 -34.44 77.8 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.759 0.314 . . . . 0.0 111.625 -178.701 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.471 ' HB2' ' O ' ' A' ' 52' ' ' CYS . 19.2 m -111.97 13.15 20.79 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.286 0.565 . . . . 0.0 110.264 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.508 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 28.0 t -78.42 119.53 21.86 Favored 'General case' 0 N--CA 1.438 -1.04 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.842 -179.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -115.77 1.11 13.38 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.584 -178.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.484 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 0.6 OUTLIER -97.2 110.01 22.65 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 176.864 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -99.11 114.66 5.09 Favored Glycine 0 CA--C 1.491 -1.422 0 C-N-CA 120.993 -0.623 . . . . 0.0 112.639 -173.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.505 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 43.6 t 61.89 161.63 0.07 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.065 0.546 . . . . 0.0 111.424 -179.057 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 19.1 t 73.14 -32.77 0.25 Allowed 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 175.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 33.3 t -67.98 162.75 23.71 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 119.736 -0.786 . . . . 0.0 111.801 -176.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.4 t -68.75 -21.75 64.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.832 -177.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.412 ' HB3' ' HB3' ' A' ' 48' ' ' CYS . 29.3 p -86.24 0.31 54.06 Favored 'General case' 0 C--O 1.219 -0.52 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.976 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.505 ' HD2' ' H ' ' A' ' 62' ' ' SER . 0.1 OUTLIER . . . . . 0 C--O 1.261 1.671 0 CA-C-O 117.998 -1.001 . . . . 0.0 111.051 -179.029 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt . . . . . 0 CA--C 1.514 -0.426 0 CA-C-O 121.03 0.443 . . . . 0.0 110.026 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.537 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 6.0 m -95.82 164.7 12.63 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-O 121.892 0.853 . . . . 0.0 112.726 -179.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . 0.492 HG21 ' HB2' ' A' ' 26' ' ' GLN . 1.4 t -100.85 161.21 13.75 Favored 'General case' 0 N--CA 1.43 -1.453 0 CA-C-N 114.26 -1.336 . . . . 0.0 108.672 176.176 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.0 t -58.4 -30.62 66.99 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.94 0.4 . . . . 0.0 110.477 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.83 -35.01 79.07 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.124 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 10.4 t -86.44 -30.23 22.22 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.329 -176.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 42.2 ttp180 -77.38 -8.09 57.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.049 0.452 . . . . 0.0 110.281 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.9 t -89.26 161.84 16.19 Favored 'General case' 0 N--CA 1.435 -1.205 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 177.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.46 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 45.0 mt-10 -128.53 129.14 23.56 Favored Pre-proline 0 C--N 1.307 -1.259 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 -179.161 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.46 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 56.0 Cg_endo -68.5 173.16 40.85 Favored 'Cis proline' 0 C--N 1.348 0.52 0 C-N-CA 123.55 -1.438 . . . . 0.0 113.099 1.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.0 t -62.69 115.73 4.57 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.957 -178.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -107.2 14.43 26.19 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.079 -177.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.642 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 4.5 t -68.47 -20.7 64.63 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 179.068 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 61.86 -154.04 40.33 Favored Glycine 0 C--N 1.339 0.713 0 CA-C-N 115.076 -0.965 . . . . 0.0 114.411 174.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.6 m -89.81 -10.22 46.26 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.343 -0.429 . . . . 0.0 110.194 179.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -76.0 -40.01 54.62 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 177.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.632 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 10.9 t 56.33 86.61 0.06 Allowed 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.61 176.721 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.492 ' HB2' HG21 ' A' ' 11' ' ' THR . 11.2 mm100 -89.74 -7.04 55.39 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.489 -177.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.537 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 14.6 p -85.19 162.17 19.31 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-O 121.089 0.471 . . . . 0.0 110.676 -179.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.83 -159.59 35.5 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.698 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.5 mp0 -78.69 168.91 19.06 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.817 0.342 . . . . 0.0 110.396 179.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 87.21 -0.99 86.18 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.659 178.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 32.0 t -84.55 -48.56 9.43 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 122.768 -0.254 . . . . 0.0 111.356 -179.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 60.4 p 53.0 43.31 31.9 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.587 0.755 . . . . 0.0 112.401 -179.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.92 165.12 20.64 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.424 178.181 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -113.35 11.14 18.5 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.29 0.567 . . . . 0.0 110.051 179.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -117.46 -64.43 1.3 Allowed 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.608 -179.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.642 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 25.5 p -74.43 -42.92 58.34 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-O 121.134 0.492 . . . . 0.0 109.701 178.337 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.456 ' NZ ' ' SG ' ' A' ' 27' ' ' CYS . 14.0 mptt -83.76 87.6 7.07 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.027 176.068 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.5 t -142.21 154.76 45.05 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.428 ' H ' ' HB3' ' A' ' 55' ' ' PRO . 44.2 t -89.07 136.16 33.17 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -92.22 -3.75 55.1 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.116 -178.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 62.3 m -77.98 141.47 38.93 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.502 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 62.8 p -102.76 164.84 11.4 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.965 -177.182 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.4 m -67.93 -31.59 71.45 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.919 0.39 . . . . 0.0 110.681 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -71.67 -34.11 69.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.986 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -163.69 136.52 4.3 Favored Glycine 0 N--CA 1.435 -1.422 0 C-N-CA 120.284 -0.96 . . . . 0.0 112.705 -178.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 37.2 t -73.0 147.81 44.8 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 177.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.44 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 8.3 mtpm? -112.05 -19.6 12.26 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -177.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.435 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 17.4 p -96.99 -37.71 10.07 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 119.993 -0.683 . . . . 0.0 110.793 -179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.66 0.43 17.88 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.618 -0.801 . . . . 0.0 113.306 178.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.799 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 73.9 mmtt -84.6 -9.17 58.54 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 117.078 0.439 . . . . 0.0 110.703 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 66.4 27.94 9.81 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.16 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.582 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 0.8 OUTLIER -71.16 -47.46 57.58 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.312 178.197 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.5 p 55.89 35.99 26.47 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.182 0.993 . . . . 0.0 113.332 176.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 150.46 149.52 5.05 Favored Glycine 0 C--O 1.218 -0.899 0 C-N-CA 120.012 -1.09 . . . . 0.0 112.252 178.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.493 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 50.5 Cg_endo -70.82 -23.24 26.21 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.875 2.383 . . . . 0.0 113.068 -178.451 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -82.68 -21.21 34.99 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.212 0.53 . . . . 0.0 109.878 -178.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.8 m -121.77 22.86 10.36 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.546 179.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.582 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 8.2 t -75.34 142.29 43.21 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.116 -177.508 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 45.1 mtpt -110.7 1.38 17.87 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.496 -176.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.799 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 4.7 m -101.17 143.88 30.73 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.798 -177.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -110.03 70.84 0.21 Allowed Glycine 0 CA--C 1.507 -0.45 0 N-CA-C 111.23 -0.748 . . . . 0.0 111.23 -178.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.6 t 60.59 -179.61 0.1 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.205 0.602 . . . . 0.0 110.323 -177.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.7 m 62.92 -0.28 0.61 Allowed 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 177.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 36.2 t -93.77 162.68 13.83 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.285 178.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 51.0 m -70.1 -12.02 61.3 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -177.26 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.661 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 24.8 p -86.91 0.34 55.2 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 120.027 -0.669 . . . . 0.0 110.531 177.024 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.661 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 23.5 mmtp . . . . . 0 C--O 1.25 1.123 0 CA-C-O 117.767 -1.111 . . . . 0.0 110.532 -179.552 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 60.8 mttm . . . . . 0 C--O 1.232 0.144 0 CA-C-O 121.082 0.468 . . . . 0.0 109.992 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.566 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 60.4 m -99.97 163.65 12.35 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.371 0.605 . . . . 0.0 112.603 -176.167 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.8 p -100.02 175.5 5.74 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.657 -178.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.4 m -62.16 -31.52 72.02 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.22 179.235 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.0 -44.07 81.3 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 120.919 0.39 . . . . 0.0 110.536 179.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 41.9 t -70.89 -43.07 69.13 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.93 -178.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.437 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 40.6 ttt180 -79.17 3.45 17.67 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.025 0.441 . . . . 0.0 111.307 -178.741 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.5 t -73.33 165.0 25.88 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 178.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.454 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 6.5 mm-40 -119.77 105.78 42.69 Favored Pre-proline 0 C--N 1.312 -1.05 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -179.121 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' PRO . . . . . 0.454 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 93.3 Cg_endo -82.45 -177.02 17.89 Favored 'Cis proline' 0 C--N 1.352 0.715 0 C-N-CA 124.026 -1.239 . . . . 0.0 111.939 -0.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 37.5 t -61.62 129.68 42.25 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 120.949 0.404 . . . . 0.0 111.179 -177.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 76.4 mm-40 -114.58 13.61 17.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.575 -178.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.629 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 1.8 t -68.68 -31.77 71.12 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -179.574 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 60.3 -162.4 18.94 Favored Glycine 0 C--N 1.34 0.759 0 CA-C-N 115.091 -0.959 . . . . 0.0 114.627 175.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.0 m -76.49 -7.23 54.71 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 120.97 0.414 . . . . 0.0 110.818 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -78.53 -45.02 22.89 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 177.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.528 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 5.0 t 59.99 95.25 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.877 176.465 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -102.56 2.03 35.68 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.668 -178.255 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.566 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 14.8 p -90.49 -158.69 0.56 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.202 0.525 . . . . 0.0 111.298 -178.318 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -140.86 157.18 25.79 Favored Glycine 0 N--CA 1.438 -1.204 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 177.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -59.71 93.99 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.517 0.675 . . . . 0.0 112.055 -177.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -165.53 6.44 0.06 OUTLIER Glycine 0 N--CA 1.434 -1.445 0 N-CA-C 110.574 -1.011 . . . . 0.0 110.574 179.003 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.491 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 31.7 p -120.22 178.2 4.73 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.03 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.3 p -129.09 33.21 4.61 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 121.306 0.574 . . . . 0.0 110.538 -178.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 83.4 m -63.35 146.83 52.71 Favored 'General case' 0 CA--C 1.506 -0.727 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -177.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.549 ' C ' ' HB ' ' A' ' 38' ' ' THR . . . -114.95 21.67 14.09 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-N 114.069 -1.423 . . . . 0.0 107.254 173.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -113.48 -63.28 1.47 Allowed 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.702 -1.135 . . . . 0.0 110.476 -178.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.629 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 29.2 p -89.19 -45.66 9.39 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 121.588 0.708 . . . . 0.0 109.845 179.044 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.415 ' HG3' ' OG ' ' A' ' 62' ' ' SER . 2.0 ttpm? -95.97 44.81 1.07 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.059 -178.255 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.549 ' HB ' ' C ' ' A' ' 34' ' ' ALA . 14.1 t -100.91 142.07 32.91 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.731 -178.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.5 t -80.53 137.17 36.4 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.655 178.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -106.54 7.28 30.73 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 120.919 0.39 . . . . 0.0 111.308 -178.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' CYS . . . . . 0.573 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 85.2 m -80.91 133.28 35.53 Favored 'General case' 0 N--CA 1.435 -1.188 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.181 178.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 55.8 p -88.61 156.34 19.1 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.583 -177.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.433 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 14.5 m -65.18 -29.73 70.58 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.645 0.736 . . . . 0.0 109.133 176.606 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -65.24 -42.77 93.01 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.696 -1.138 . . . . 0.0 110.744 178.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -159.88 135.77 4.26 Favored Glycine 0 N--CA 1.44 -1.083 0 C-N-CA 121.048 -0.596 . . . . 0.0 111.906 -178.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 12.7 t -71.89 147.98 46.55 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -108.02 -31.74 7.84 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -177.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.462 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 20.7 p -89.75 -39.03 13.41 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.136 -0.625 . . . . 0.0 111.416 -177.61 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 118.48 -5.13 14.98 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.495 -0.859 . . . . 0.0 112.885 -179.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.675 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 74.0 mmtt -76.22 -13.42 60.17 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 120.8 0.333 . . . . 0.0 110.604 179.171 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 71.3 28.07 3.05 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.704 -179.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' CYS . . . . . 0.534 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.8 p -74.33 -43.88 54.8 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.268 178.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.433 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 55.0 p 54.03 31.96 14.64 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.087 0.955 . . . . 0.0 113.106 177.574 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 144.01 154.77 6.22 Favored Glycine 0 N--CA 1.442 -0.922 0 C-N-CA 120.353 -0.927 . . . . 0.0 112.299 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -60.47 -28.46 86.76 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.02 2.48 . . . . 0.0 112.677 -177.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -63.05 -29.29 70.7 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.104 -178.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 13.6 t -126.48 22.75 6.98 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.471 -178.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . 0.534 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 17.8 t -82.71 137.0 34.57 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.078 0.466 . . . . 0.0 110.871 -178.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -117.31 10.54 13.74 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.157 -178.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.675 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 2.6 m -102.01 156.3 17.63 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.154 -176.028 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -85.58 -115.68 0.83 Allowed Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 121.002 -0.618 . . . . 0.0 112.8 -178.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . 0.415 ' OG ' ' HG3' ' A' ' 37' ' ' LYS . 14.9 m -123.49 -13.46 7.56 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 120.832 0.349 . . . . 0.0 111.073 -177.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 58.3 m -107.33 24.24 13.17 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -177.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' CYS . . . . . 0.42 ' SG ' ' N ' ' A' ' 65' ' ' SER . 42.4 t -93.3 171.98 8.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 177.537 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.42 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 19.4 m -67.33 -23.01 65.58 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -177.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.573 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 20.6 p -90.9 4.65 51.31 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.794 -0.362 . . . . 0.0 111.647 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.416 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 22.1 mmtp . . . . . 0 C--O 1.26 1.626 0 CA-C-O 117.574 -1.203 . . . . 0.0 110.676 -178.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.156 0 N-CA-C 112.345 -0.302 . . . . 0.0 112.345 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.7 m -60.22 118.04 5.9 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 122.314 0.246 . . . . 0.0 110.558 179.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -67.14 90.02 0.17 Allowed Glycine 0 C--N 1.33 0.216 0 C-N-CA 121.226 -0.511 . . . . 0.0 112.773 -179.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 60.5 pttt -150.32 156.48 41.61 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 109.355 -0.609 . . . . 0.0 109.355 -179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -165.4 111.32 0.45 Allowed Glycine 0 N--CA 1.44 -1.092 0 C-N-CA 120.217 -0.992 . . . . 0.0 112.392 -179.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.9 mttt -114.43 -179.9 3.76 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -81.36 69.15 3.33 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.655 -0.783 . . . . 0.0 111.848 179.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -80.57 95.46 6.53 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-O 121.066 0.46 . . . . 0.0 110.517 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 92.7 mttt -80.78 -17.83 49.6 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.479 178.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.559 ' SG ' ' HB2' ' A' ' 27' ' ' CYS . 76.4 m -85.34 150.46 24.73 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 115.308 -0.86 . . . . 0.0 112.093 -178.255 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 4.9 t -81.22 166.94 20.13 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.309 -0.86 . . . . 0.0 110.565 -179.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.2 m -54.52 -39.09 67.28 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.589 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -58.69 -45.62 89.07 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.253 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.633 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 44.6 t -69.38 -34.08 74.01 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 121.226 0.536 . . . . 0.0 110.373 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 77.5 mtp180 -84.46 14.82 4.13 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.716 -0.675 . . . . 0.0 112.043 -178.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 69.6 m -100.99 164.39 11.84 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.557 0.218 . . . . 0.0 110.636 178.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.436 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 11.4 mp0 -121.49 110.85 33.62 Favored Pre-proline 0 C--N 1.327 -0.384 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 177.377 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.436 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 91.0 Cg_endo -78.23 172.12 63.14 Favored 'Cis proline' 0 C--O 1.237 0.47 0 C-N-CA 123.72 -1.367 . . . . 0.0 111.74 0.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.647 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 43.3 t -62.34 134.62 56.73 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 121.127 0.489 . . . . 0.0 110.571 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 18.6 mm-40 -113.34 23.78 12.91 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 115.529 -0.76 . . . . 0.0 109.933 -178.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.68 ' SG ' ' HA ' ' A' ' 25' ' ' CYS . 0.7 OUTLIER -73.97 -25.7 60.08 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 108.968 -0.752 . . . . 0.0 108.968 -178.908 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 59.45 -145.06 45.22 Favored Glycine 0 N--CA 1.443 -0.889 0 CA-C-N 115.172 -0.922 . . . . 0.0 113.24 177.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -95.03 -9.9 32.45 Favored 'General case' 0 N--CA 1.438 -1.038 0 CA-C-O 120.92 0.39 . . . . 0.0 110.164 178.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.439 ' CE ' ' HA ' ' A' ' 24' ' ' LYS . 5.4 mmpt? -72.94 -42.05 63.83 Favored 'General case' 0 CA--C 1.511 -0.555 0 N-CA-C 109.244 -0.651 . . . . 0.0 109.244 178.338 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.68 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 2.6 t 53.83 79.42 0.13 Allowed 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 115.053 -0.976 . . . . 0.0 111.861 175.05 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -99.91 16.67 23.06 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.749 -178.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.559 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 23.9 p -87.63 -163.57 0.96 Allowed 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.48 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -111.83 153.04 17.54 Favored Glycine 0 N--CA 1.441 -0.998 0 C-N-CA 120.554 -0.832 . . . . 0.0 112.485 -179.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -71.98 120.2 17.23 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 120.807 0.337 . . . . 0.0 110.324 178.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 135.79 -3.35 3.83 Favored Glycine 0 N--CA 1.441 -1.021 0 C-N-CA 120.619 -0.8 . . . . 0.0 112.601 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.551 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 9.1 p -89.31 -31.92 17.6 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.698 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 42.9 p 50.87 38.81 20.97 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.229 0.611 . . . . 0.0 111.306 -176.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.551 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 6.9 t -59.72 136.12 57.9 Favored 'General case' 0 C--O 1.221 -0.42 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.011 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -82.01 23.52 0.7 Allowed 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -174.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -125.7 -50.8 1.6 Allowed 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.134 0.493 . . . . 0.0 110.117 179.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.613 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 3.2 p -94.73 -43.1 8.41 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.621 179.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.439 ' HE3' ' OG ' ' A' ' 62' ' ' SER . 13.4 mptt -83.53 63.08 7.16 Favored 'General case' 0 CA--C 1.516 -0.36 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.468 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.4 t -112.2 175.62 5.36 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.574 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 43.2 t -134.27 135.66 43.04 Favored 'General case' 0 C--N 1.308 -1.198 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -100.95 7.66 43.46 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.484 -175.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.487 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 62.8 m -82.85 134.87 35.08 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.637 178.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 53.2 p -101.91 167.91 9.76 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.165 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.3 m -69.75 -20.36 63.5 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.016 0.436 . . . . 0.0 110.289 178.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 39.7 m-20 -74.64 -38.33 62.54 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.621 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -164.53 135.31 3.69 Favored Glycine 0 N--CA 1.428 -1.864 0 C-N-CA 120.455 -0.879 . . . . 0.0 112.285 -178.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.2 t -73.23 129.55 38.29 Favored 'General case' 0 C--N 1.31 -1.133 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 179.048 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.487 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 75.1 mmtt -86.74 -25.51 24.67 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 112.068 0.395 . . . . 0.0 112.068 -176.496 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.449 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 19.1 p -97.77 -36.58 10.17 Favored 'General case' 0 C--N 1.313 -1.007 0 C-N-CA 120.299 -0.56 . . . . 0.0 110.345 179.226 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 107.7 5.28 33.87 Favored Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.601 -0.809 . . . . 0.0 112.974 178.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.449 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 74.9 mmtt -83.96 -2.2 56.09 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-O 121.019 0.438 . . . . 0.0 110.542 178.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 67.16 23.91 9.41 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.721 177.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.433 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 1.7 p -73.78 -45.68 50.16 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.94 -0.573 . . . . 0.0 109.94 177.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 46.0 p 52.75 33.67 14.55 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.036 0.934 . . . . 0.0 113.375 176.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 156.74 144.13 3.85 Favored Glycine 0 N--CA 1.441 -1.032 0 C-N-CA 120.25 -0.976 . . . . 0.0 112.047 179.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.406 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 24.3 Cg_endo -63.18 -36.51 57.39 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.653 2.236 . . . . 0.0 112.406 -178.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -69.23 -14.93 63.24 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.938 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.6 m -125.47 22.56 7.66 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.038 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.433 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 4.6 t -83.33 137.98 33.73 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.298 -177.24 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 86.1 mttt -123.93 -4.83 8.02 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.384 -176.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.6 p -103.94 156.3 17.96 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 120.934 0.397 . . . . 0.0 111.911 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -71.34 -177.04 25.66 Favored Glycine 0 CA--C 1.52 0.361 0 CA-C-N 115.759 -0.655 . . . . 0.0 114.263 -176.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.465 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 41.3 m -78.21 -10.27 59.58 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -176.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 30.6 m -89.63 19.19 4.78 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.067 0.461 . . . . 0.0 110.365 178.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 29.6 t -96.97 166.44 11.61 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.825 -178.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 49.3 m -66.32 -29.66 69.9 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -177.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.532 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 25.2 p -80.34 4.65 17.18 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.795 0.331 . . . . 0.0 111.383 -178.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.532 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 9.9 mmtp . . . . . 0 C--O 1.264 1.854 0 CA-C-O 117.939 -1.029 . . . . 0.0 110.832 -177.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.288 0 N-CA-C 112.511 -0.236 . . . . 0.0 112.511 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.4 t -79.15 105.2 10.32 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.81 0.338 . . . . 0.0 110.553 -179.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 69.17 42.18 77.15 Favored Glycine 0 N--CA 1.447 -0.611 0 C-N-CA 121.028 -0.606 . . . . 0.0 112.317 179.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 36.2 mmtm -96.59 -179.46 4.61 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 120.854 0.359 . . . . 0.0 111.49 -179.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -79.51 84.79 1.27 Allowed Glycine 0 N--CA 1.437 -1.275 0 CA-C-N 115.677 -0.692 . . . . 0.0 112.865 -178.566 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -94.18 -9.81 35.12 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-O 121.412 0.625 . . . . 0.0 109.32 176.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 90.14 -98.46 2.45 Favored Glycine 0 N--CA 1.44 -1.086 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.849 178.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.561 ' HG2' ' SG ' ' A' ' 10' ' ' CYS . 28.8 tt0 -143.4 -67.0 0.36 Allowed 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 179.542 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt 59.14 33.75 22.94 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.929 -179.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.71 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 96.3 m -92.36 139.71 30.32 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-O 121.387 0.613 . . . . 0.0 111.932 -179.302 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 80.9 p -93.26 179.51 5.39 Favored 'General case' 0 N--CA 1.429 -1.479 0 CA-C-N 115.271 -0.877 . . . . 0.0 110.459 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.1 m -64.23 -26.03 68.33 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.234 -178.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.43 -44.22 83.51 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.828 179.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.524 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 42.4 t -75.12 -32.87 61.49 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.231 0.539 . . . . 0.0 110.977 -179.12 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 36.4 ttm-85 -80.36 0.56 32.59 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.178 -178.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 22.2 t -89.0 162.27 16.13 Favored 'General case' 0 N--CA 1.442 -0.842 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 178.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -134.12 117.41 13.65 Favored Pre-proline 0 C--N 1.318 -0.802 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 179.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -68.5 166.64 69.03 Favored 'Cis proline' 0 N--CA 1.477 0.507 0 C-N-CA 123.498 -1.459 . . . . 0.0 112.555 0.467 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.419 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 4.4 t -62.47 133.0 54.38 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.425 -178.026 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 80.2 mm-40 -112.93 18.7 17.93 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -174.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.524 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 1.2 m -65.49 -30.49 71.27 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 120.239 -0.584 . . . . 0.0 111.358 179.459 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 58.99 -136.88 50.93 Favored Glycine 0 CA--C 1.52 0.363 0 CA-C-N 115.961 -0.563 . . . . 0.0 114.15 176.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 17.0 m -93.32 -8.17 42.8 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 120.866 0.365 . . . . 0.0 111.165 -177.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -88.01 -49.88 6.77 Favored 'General case' 0 CA--C 1.504 -0.791 0 CA-C-N 116.406 -0.361 . . . . 0.0 110.134 179.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.4 ' HA ' ' HB3' ' A' ' 21' ' ' CYS . 5.4 t 59.96 92.61 0.04 OUTLIER 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.298 -0.865 . . . . 0.0 110.074 -178.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -85.14 -7.6 59.0 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.164 -0.925 . . . . 0.0 112.78 -174.146 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.567 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 22.6 p -101.07 -176.47 3.17 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-O 121.255 0.55 . . . . 0.0 111.686 -177.562 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -100.38 -147.9 21.67 Favored Glycine 0 N--CA 1.447 -0.589 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.981 177.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -109.13 18.05 20.99 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-O 121.157 0.504 . . . . 0.0 110.491 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -83.17 -9.12 84.48 Favored Glycine 0 C--N 1.309 -0.935 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.489 -177.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.71 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 29.8 p -94.27 -30.61 14.47 Favored 'General case' 0 C--N 1.318 -0.795 0 O-C-N 122.769 -0.253 . . . . 0.0 111.468 -178.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 41.1 p 49.61 41.23 21.23 Favored 'General case' 0 C--N 1.345 0.384 0 CA-C-O 121.709 0.766 . . . . 0.0 109.854 -173.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.622 ' O ' ' HB2' ' A' ' 37' ' ' LYS . 0.3 OUTLIER -58.77 159.19 7.06 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 114.528 -1.215 . . . . 0.0 111.214 -177.606 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -104.59 12.93 32.48 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.627 -178.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -121.72 -64.43 1.22 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.054 -178.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 14.7 p -82.11 -25.35 34.53 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.958 0.408 . . . . 0.0 111.275 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.622 ' HB2' ' O ' ' A' ' 33' ' ' CYS . 1.4 mmpp? -93.32 58.38 2.82 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.79 0.329 . . . . 0.0 111.208 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.7 t -127.72 159.97 33.14 Favored 'General case' 0 C--N 1.313 -1.017 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.735 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.3 t -93.35 139.52 30.58 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 179.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -95.15 -0.16 53.59 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-O 120.862 0.363 . . . . 0.0 111.384 -177.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.554 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 62.8 m -81.31 135.29 35.69 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.219 -0.446 . . . . 0.0 109.949 177.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 69.5 p -101.3 166.47 10.74 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.758 -178.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 36.7 m -71.72 -15.2 62.19 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.532 179.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -80.66 -35.32 33.94 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.508 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -166.61 130.04 2.05 Favored Glycine 0 N--CA 1.439 -1.151 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.091 -179.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 18.6 t -67.88 133.87 49.89 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 179.019 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 32.8 mmmt -92.41 -30.85 15.55 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.372 0.508 . . . . 0.0 112.372 -176.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 15.1 p -91.62 -39.61 11.77 Favored 'General case' 0 C--N 1.319 -0.753 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.611 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 114.41 4.74 21.72 Favored Glycine 0 N--CA 1.445 -0.704 0 C-N-CA 120.817 -0.706 . . . . 0.0 113.028 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.511 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 75.3 mmtt -86.32 -2.99 58.89 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.982 0.391 . . . . 0.0 111.507 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 67.94 18.31 9.56 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.311 0.577 . . . . 0.0 111.284 177.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.505 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 0.9 OUTLIER -65.83 -49.55 67.8 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.008 178.108 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 46.5 p 53.05 46.47 26.65 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 115.042 -0.981 . . . . 0.0 113.111 177.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 135.13 153.1 6.67 Favored Glycine 0 N--CA 1.442 -0.951 0 C-N-CA 120.212 -0.994 . . . . 0.0 112.687 177.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -71.09 -18.34 30.92 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.752 2.302 . . . . 0.0 112.68 -178.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -82.16 -4.83 57.78 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.158 0.504 . . . . 0.0 110.729 -178.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 49.3 m -148.07 26.44 0.98 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.317 0.58 . . . . 0.0 110.209 179.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.505 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 12.2 t -84.21 138.2 33.1 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 115.738 -0.664 . . . . 0.0 110.988 -177.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -110.82 12.43 22.38 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.445 0.641 . . . . 0.0 109.406 179.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.511 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 19.3 m -108.66 151.25 26.41 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.456 -178.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.401 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -89.18 -106.7 1.11 Allowed Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 121.106 -0.569 . . . . 0.0 112.558 -178.058 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 61.7 p -129.32 -9.0 4.71 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-O 120.9 0.381 . . . . 0.0 111.142 -178.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 13.1 m -104.38 20.61 18.14 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.88 -175.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 35.3 t -102.13 170.48 8.08 Favored 'General case' 0 C--N 1.32 -0.7 0 C-N-CA 120.559 -0.456 . . . . 0.0 110.669 179.334 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.6 t -65.93 -28.94 69.3 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.186 -178.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.554 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 17.3 p -80.52 1.81 27.96 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 120.845 0.355 . . . . 0.0 111.488 -178.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 61' ' ' GLY . 23.5 mmtp . . . . . 0 C--O 1.258 1.525 0 CA-C-O 117.544 -1.217 . . . . 0.0 110.533 -179.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.225 0 N-CA-C 112.566 -0.213 . . . . 0.0 112.566 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.4 m -87.79 90.11 8.25 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.874 0.368 . . . . 0.0 110.367 179.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -66.31 149.82 51.6 Favored Glycine 0 N--CA 1.447 -0.575 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.772 -178.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm -97.01 158.78 15.26 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 120.904 0.383 . . . . 0.0 110.414 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 176.65 70.95 0.06 OUTLIER Glycine 0 N--CA 1.436 -1.32 0 N-CA-C 111.252 -0.739 . . . . 0.0 111.252 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 66.4 mttm -86.81 179.14 6.8 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 110.419 -0.215 . . . . 0.0 110.419 -179.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -71.04 102.63 1.09 Allowed Glycine 0 N--CA 1.442 -0.955 0 C-N-CA 120.788 -0.72 . . . . 0.0 111.918 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -82.98 141.31 32.2 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 120.956 0.408 . . . . 0.0 110.563 -179.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.487 ' HD2' ' N ' ' A' ' 9' ' ' LYS . 11.5 mptt -99.25 13.02 34.55 Favored 'General case' 0 C--N 1.309 -1.185 0 N-CA-C 109.263 -0.643 . . . . 0.0 109.263 178.091 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.854 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 79.7 m -100.35 146.33 27.09 Favored 'General case' 0 N--CA 1.443 -0.78 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.271 -177.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.5 p -94.68 178.76 5.48 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.589 -179.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.5 p -60.47 -29.35 68.99 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.385 179.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.27 -45.66 87.09 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.259 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.481 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 17.5 t -69.42 -35.27 75.57 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.006 0.432 . . . . 0.0 110.71 -178.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 15' ' ' ARG . 19.0 mtt180 -76.12 0.91 17.19 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 48.8 m -81.18 160.12 24.43 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-O 120.683 0.278 . . . . 0.0 111.064 -178.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.4 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 74.9 mm-40 -126.48 108.45 23.47 Favored Pre-proline 0 C--N 1.323 -0.559 0 CA-C-N 115.966 -0.561 . . . . 0.0 109.991 178.305 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.4 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 69.3 Cg_endo -74.44 173.12 58.74 Favored 'Cis proline' 0 C--O 1.241 0.634 0 C-N-CA 123.554 -1.436 . . . . 0.0 112.145 -2.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.481 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 8.7 t -57.66 139.92 52.5 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.871 -177.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 86.1 mm-40 -119.01 16.49 13.34 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -175.563 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -62.86 -29.86 71.07 Favored 'General case' 0 C--O 1.241 0.619 0 C-N-CA 120.269 -0.572 . . . . 0.0 110.412 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 59.33 -139.5 48.62 Favored Glycine 0 N--CA 1.448 -0.562 0 CA-C-N 115.663 -0.699 . . . . 0.0 113.032 176.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.3 m -99.17 10.69 40.94 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.133 0.492 . . . . 0.0 110.647 -179.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -98.61 -50.23 4.33 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 177.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 t 57.3 94.6 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 114.937 -1.029 . . . . 0.0 111.0 179.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -97.36 9.61 41.84 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.562 -175.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.575 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 31.7 p -107.63 173.59 6.26 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 120.356 -0.538 . . . . 0.0 111.947 -179.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -102.06 178.45 26.93 Favored Glycine 0 N--CA 1.445 -0.742 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.798 178.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -82.14 78.23 8.84 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.221 0.534 . . . . 0.0 111.284 -178.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -159.14 23.09 0.31 Allowed Glycine 0 N--CA 1.444 -0.821 0 N-CA-C 111.265 -0.734 . . . . 0.0 111.265 178.002 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.854 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 25.1 p -116.52 -19.79 9.91 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 111.962 0.356 . . . . 0.0 111.962 -178.255 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 71.7 p 50.92 30.41 5.22 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-O 121.573 0.702 . . . . 0.0 110.543 -175.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.429 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 1.9 t -76.84 116.41 17.48 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.008 -177.204 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -88.1 16.94 5.44 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.37 0.605 . . . . 0.0 110.607 -176.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -103.38 -54.07 2.67 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.216 -179.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 28.6 p -98.44 -30.48 12.52 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.122 178.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.546 ' NZ ' ' HB2' ' A' ' 37' ' ' LYS . 0.3 OUTLIER -106.52 80.18 1.45 Allowed 'General case' 0 N--CA 1.435 -1.193 0 CA-C-O 121.448 0.642 . . . . 0.0 111.796 -175.17 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.5 t -157.17 161.75 39.32 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.37 -0.832 . . . . 0.0 109.035 178.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 42.6 t -89.96 146.91 24.03 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 120.835 0.35 . . . . 0.0 110.736 -179.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 33.1 m-80 -114.51 2.76 14.69 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.098 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.572 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 57.2 m -79.71 148.11 31.67 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.235 179.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 44.8 p -114.25 162.24 16.82 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.698 -179.132 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.446 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 6.6 p -63.8 -25.75 68.32 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.021 0.438 . . . . 0.0 111.312 179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -73.4 -35.09 65.82 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.299 179.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -164.24 131.07 2.33 Favored Glycine 0 N--CA 1.442 -0.949 0 C-N-CA 120.708 -0.758 . . . . 0.0 112.032 -179.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 27.4 t -76.96 133.65 39.13 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 120.743 0.306 . . . . 0.0 110.483 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -86.41 -41.06 14.77 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 112.407 0.521 . . . . 0.0 112.407 -178.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.451 ' HA ' ' HB2' ' A' ' 65' ' ' SER . 19.2 p -83.37 -39.23 20.97 Favored 'General case' 0 C--N 1.32 -0.699 0 C-N-CA 120.235 -0.586 . . . . 0.0 111.033 -177.411 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.64 5.82 25.57 Favored Glycine 0 N--CA 1.44 -1.071 0 C-N-CA 120.47 -0.871 . . . . 0.0 113.029 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -84.58 -0.51 53.48 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.075 0.464 . . . . 0.0 110.264 178.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 63.66 21.23 12.62 Favored 'General case' 0 C--O 1.23 0.071 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.215 179.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.56 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 3.2 p -70.04 -47.53 61.67 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.956 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.446 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 73.5 p 55.35 25.68 7.84 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 114.956 -1.02 . . . . 0.0 113.032 177.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 152.02 155.22 6.93 Favored Glycine 0 N--CA 1.441 -1.025 0 C-N-CA 120.297 -0.954 . . . . 0.0 112.518 179.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.455 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 20.8 Cg_endo -60.36 -26.64 83.18 Favored 'Trans proline' 0 C--N 1.35 0.625 0 C-N-CA 123.258 2.639 . . . . 0.0 113.179 -179.075 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -70.74 -17.73 62.8 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 120.927 0.394 . . . . 0.0 111.656 -178.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.1 m -135.43 25.15 3.48 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-O 121.008 0.432 . . . . 0.0 110.032 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.56 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 6.3 t -81.59 126.42 31.71 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.146 -176.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 31.0 mmtp -106.34 17.27 23.66 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.462 -178.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.3 m -109.5 159.38 17.11 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.197 -175.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -110.21 -77.04 0.91 Allowed Glycine 0 N--CA 1.439 -1.115 0 C-N-CA 120.73 -0.747 . . . . 0.0 112.624 -179.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 34.8 m -146.47 159.3 43.59 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 110.376 -0.231 . . . . 0.0 110.376 -179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 41.2 m 65.21 7.4 4.13 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 177.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . 0.433 ' HB3' ' HG2' ' A' ' 67' ' ' LYS . 45.3 t -75.46 167.47 21.84 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 108.648 -0.871 . . . . 0.0 108.648 176.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.451 ' HB2' ' HA ' ' A' ' 48' ' ' CYS . 15.4 m -64.34 -16.56 62.46 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 120.771 0.319 . . . . 0.0 111.771 -177.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.572 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 25.5 p -101.15 1.92 39.64 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-O 120.571 0.224 . . . . 0.0 111.29 178.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.52 ' HE2' ' SG ' ' A' ' 66' ' ' CYS . 71.9 mmtt . . . . . 0 C--O 1.261 1.708 0 CA-C-O 117.843 -1.075 . . . . 0.0 111.049 -177.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 N-CA-C 112.366 -0.294 . . . . 0.0 112.366 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.7 m -87.7 -21.18 25.37 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.776 0.322 . . . . 0.0 111.035 -179.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.401 ' C ' ' HD2' ' A' ' 4' ' ' LYS . . . 81.32 -129.84 9.31 Favored Glycine 0 N--CA 1.444 -0.804 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.174 179.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.401 ' HD2' ' C ' ' A' ' 3' ' ' GLY . 13.3 mptt -121.12 170.17 9.81 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 128.33 109.15 1.46 Allowed Glycine 0 N--CA 1.442 -0.949 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.446 179.369 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -114.69 101.66 9.29 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.954 0.406 . . . . 0.0 110.627 179.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 79.62 -139.73 21.87 Favored Glycine 0 N--CA 1.443 -0.846 0 C-N-CA 120.73 -0.747 . . . . 0.0 111.603 -179.323 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -138.62 -82.39 0.3 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.061 0.458 . . . . 0.0 111.874 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 93.9 mttt -132.95 25.07 4.29 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.119 -177.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.55 ' SG ' ' HB2' ' A' ' 27' ' ' CYS . 78.6 m -95.86 147.86 23.21 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -176.429 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 74.8 p -100.51 179.6 4.39 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.805 -178.088 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.5 m -62.12 -20.07 63.68 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 116.13 -0.486 . . . . 0.0 112.31 -178.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.38 -50.14 48.94 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 120.956 0.408 . . . . 0.0 110.023 177.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 51.4 t -73.57 -35.68 65.48 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.009 178.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 27.7 mtm180 -69.35 -3.34 13.75 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.948 0.404 . . . . 0.0 111.649 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.5 t -83.62 163.97 20.01 Favored 'General case' 0 N--CA 1.435 -1.214 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 176.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -132.86 111.43 13.37 Favored Pre-proline 0 C--N 1.306 -1.3 0 CA-C-O 120.884 0.373 . . . . 0.0 110.565 178.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -75.22 173.14 59.5 Favored 'Cis proline' 0 C--N 1.35 0.613 0 C-N-CA 123.444 -1.482 . . . . 0.0 112.238 -0.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 71.2 m -59.86 140.68 56.44 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.075 0.464 . . . . 0.0 111.164 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 28.7 mm-40 -114.29 21.1 14.99 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.771 -0.65 . . . . 0.0 111.004 -177.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.44 ' HB3' ' HA ' ' A' ' 25' ' ' CYS . 11.0 m -66.1 -33.14 75.1 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.84 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 79.75 -114.85 3.95 Favored Glycine 0 N--CA 1.438 -1.17 0 C-N-CA 120.775 -0.726 . . . . 0.0 111.445 -178.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.9 t -129.29 -3.27 4.97 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.043 0.449 . . . . 0.0 110.248 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -88.22 -40.81 13.39 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.086 179.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.538 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 0.6 OUTLIER 66.72 104.39 0.04 OUTLIER 'General case' 0 CA--C 1.505 -0.772 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.848 -179.615 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -88.3 -14.88 37.2 Favored 'General case' 0 C--N 1.305 -1.346 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.009 177.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.55 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 26.6 p -84.19 170.86 13.33 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.194 178.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.12 -126.68 2.87 Favored Glycine 0 N--CA 1.441 -0.987 0 C-N-CA 120.568 -0.825 . . . . 0.0 112.29 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -137.36 77.41 1.64 Allowed 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 121.635 0.731 . . . . 0.0 110.556 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -172.36 43.21 0.17 Allowed Glycine 0 N--CA 1.446 -0.694 0 C-N-CA 120.727 -0.749 . . . . 0.0 111.844 -179.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.566 ' SG ' ' HE2' ' A' ' 37' ' ' LYS . 12.0 p -130.88 -28.63 1.97 Allowed 'General case' 0 C--N 1.31 -1.128 0 CA-C-O 120.6 0.238 . . . . 0.0 111.178 -178.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.8 p 50.04 45.66 25.18 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 123.466 0.706 . . . . 0.0 112.8 179.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.637 ' O ' ' HB2' ' A' ' 37' ' ' LYS . 59.1 m -74.6 170.95 14.74 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.503 178.164 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -109.41 3.54 21.54 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 121.27 0.557 . . . . 0.0 110.08 178.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -104.62 -69.09 0.82 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.389 -178.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.538 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 25.3 p -88.68 0.23 56.63 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.139 -179.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.637 ' HB2' ' O ' ' A' ' 33' ' ' CYS . 34.1 mmtm -120.39 37.67 4.2 Favored 'General case' 0 CA--C 1.503 -0.832 0 CA-C-O 121.568 0.699 . . . . 0.0 111.454 -179.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.5 t -113.81 165.42 12.59 Favored 'General case' 0 C--N 1.295 -1.77 0 CA-C-N 115.125 -0.943 . . . . 0.0 108.558 177.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 27.9 t -102.73 136.43 42.57 Favored 'General case' 0 C--N 1.307 -1.255 0 C-N-CA 120.633 -0.427 . . . . 0.0 109.922 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -87.31 -5.26 58.97 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.041 0.448 . . . . 0.0 110.806 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.426 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 69.3 m -80.03 136.01 36.49 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.176 178.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 61.1 p -92.59 152.91 19.34 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 115.849 -0.614 . . . . 0.0 110.448 -178.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.516 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 45.5 m -66.52 -13.0 60.35 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-O 121.215 0.531 . . . . 0.0 110.795 178.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -86.01 -19.81 29.8 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.248 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 178.2 134.8 2.15 Favored Glycine 0 N--CA 1.438 -1.17 0 C-N-CA 120.976 -0.63 . . . . 0.0 112.033 -178.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 30.9 t -69.03 142.24 54.62 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 110.114 -0.328 . . . . 0.0 110.114 179.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 51.7 mtpt -112.18 -10.32 13.86 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -177.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.522 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 14.5 p -103.67 -39.48 6.67 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 120.121 -0.632 . . . . 0.0 109.962 177.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 122.9 -1.62 9.96 Favored Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.81 -0.709 . . . . 0.0 113.437 177.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.807 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 35.2 mmtp -84.71 -4.12 58.88 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 117.136 0.468 . . . . 0.0 111.526 -178.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 67.85 19.58 9.51 Favored 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.273 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.559 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.2 p -69.06 -44.29 72.88 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.132 -179.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.516 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 67.0 p 53.65 27.75 7.17 Favored 'General case' 0 N--CA 1.48 1.075 0 N-CA-C 113.699 1.0 . . . . 0.0 113.699 176.142 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 143.97 158.62 7.66 Favored Glycine 0 N--CA 1.443 -0.882 0 C-N-CA 120.095 -1.05 . . . . 0.0 112.151 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -58.91 -26.51 81.3 Favored 'Trans proline' 0 C--N 1.349 0.575 0 C-N-CA 123.159 2.572 . . . . 0.0 113.065 -178.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -60.29 -50.25 74.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.873 0.368 . . . . 0.0 111.467 179.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.0 m -107.21 19.38 20.45 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.237 -177.271 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.559 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 41.8 t -84.87 135.47 34.06 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 121.183 0.516 . . . . 0.0 111.509 -178.27 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -122.28 13.19 10.31 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.154 179.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.807 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 3.7 m -99.71 116.72 32.46 Favored 'General case' 0 N--CA 1.443 -0.816 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 178.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -106.37 89.38 0.6 Allowed Glycine 0 C--N 1.298 -1.549 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.916 -175.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.458 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 39.7 m 66.14 164.72 0.18 Allowed 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.17 0.588 . . . . 0.0 111.339 -179.15 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.9 m 69.31 -14.32 0.33 Allowed 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 176.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 25.5 t -86.22 165.37 16.56 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 119.873 -0.731 . . . . 0.0 110.932 -178.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 18.8 m -64.2 -22.69 67.03 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.738 -178.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.426 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 27.4 p -90.29 4.22 51.36 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 120.914 -0.314 . . . . 0.0 110.81 178.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.458 ' HD2' ' H ' ' A' ' 62' ' ' SER . 0.3 OUTLIER . . . . . 0 C--O 1.256 1.403 0 CA-C-O 118.078 -0.963 . . . . 0.0 110.474 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.038 0 N-CA-C 112.168 -0.373 . . . . 0.0 112.168 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 35.9 t -106.54 148.99 27.58 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 110.076 -0.342 . . . . 0.0 110.076 179.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -72.52 -41.57 50.98 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.658 -179.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.413 ' HE3' ' HB2' ' A' ' 4' ' ' LYS . 51.2 mtmt -103.18 120.57 40.96 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.873 0.368 . . . . 0.0 111.881 -177.698 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 82.22 -39.83 2.65 Favored Glycine 0 N--CA 1.448 -0.545 0 CA-C-N 115.921 -0.582 . . . . 0.0 114.032 174.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.6 mptt 66.68 19.14 10.79 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 121.364 0.602 . . . . 0.0 109.982 -177.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -174.44 175.78 46.76 Favored Glycine 0 N--CA 1.433 -1.532 0 CA-C-N 115.301 -0.863 . . . . 0.0 111.148 -179.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.5 ' HA ' ' O ' ' A' ' 29' ' ' GLU . 28.9 mt-10 -64.21 -53.42 49.48 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 120.67 0.271 . . . . 0.0 110.923 -179.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 50.4 mtpt 58.04 51.89 8.32 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.341 -179.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.731 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 71.7 m -92.93 139.4 30.57 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.218 177.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 64.4 p -88.08 -179.06 6.11 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.758 -177.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.0 p -62.74 -30.59 71.55 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.196 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.45 -49.43 76.86 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.695 179.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.425 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 43.2 t -67.97 -29.29 68.3 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.431 0.634 . . . . 0.0 110.423 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 18.4 mmt180 -84.38 15.94 3.36 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.975 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 47.6 m -107.81 161.09 15.22 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 175.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -123.35 110.87 30.36 Favored Pre-proline 0 C--N 1.315 -0.908 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.724 179.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -79.17 171.27 65.69 Favored 'Cis proline' 0 C--O 1.239 0.544 0 C-N-CA 123.483 -1.465 . . . . 0.0 111.852 -0.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 95.9 m -55.31 129.06 37.01 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-O 121.391 0.615 . . . . 0.0 111.215 179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 31.4 mm-40 -94.75 8.89 41.03 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.034 -178.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.611 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 7.4 m -62.26 -37.02 83.85 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.093 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 64.59 -144.56 48.52 Favored Glycine 0 N--CA 1.441 -1.011 0 CA-C-N 115.687 -0.688 . . . . 0.0 113.105 178.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 25.7 m -88.58 -8.51 54.59 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 111.839 0.311 . . . . 0.0 111.839 -178.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 71.7 mmtt -86.66 -54.13 4.56 Favored 'General case' 0 CA--C 1.491 -1.29 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 178.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.685 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 8.6 t 63.48 101.18 0.03 OUTLIER 'General case' 0 N--CA 1.437 -1.098 0 CA-C-N 114.358 -1.292 . . . . 0.0 112.467 175.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -97.18 12.15 33.82 Favored 'General case' 0 C--N 1.308 -1.197 0 N-CA-C 113.816 1.043 . . . . 0.0 113.816 -178.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.731 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 21.8 p -104.12 166.05 10.65 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 119.754 -0.779 . . . . 0.0 111.24 176.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -79.41 -112.49 0.24 Allowed Glycine 0 N--CA 1.443 -0.864 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.225 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.5 ' O ' ' HA ' ' A' ' 8' ' ' GLU . 46.8 mt-10 -139.84 -173.34 3.61 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 110.197 -0.297 . . . . 0.0 110.197 -179.205 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 97.96 -33.8 5.67 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.472 -0.87 . . . . 0.0 113.095 177.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 18.5 p -69.37 -36.88 77.26 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 120.738 0.304 . . . . 0.0 110.814 -179.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 46.9 p 49.59 43.96 24.2 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.634 -179.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 72.3 m -64.81 172.38 2.85 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.926 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -108.39 3.29 23.17 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 121.539 0.685 . . . . 0.0 109.619 177.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -106.45 -72.06 0.73 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.324 -0.853 . . . . 0.0 110.542 -178.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.685 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 7.8 p -80.25 -23.43 40.83 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.183 0.516 . . . . 0.0 111.275 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.524 ' NZ ' ' SG ' ' A' ' 27' ' ' CYS . 11.2 mptt -95.36 105.52 17.48 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-O 121.473 0.654 . . . . 0.0 111.691 179.226 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.4 t -171.7 -173.04 1.11 Allowed 'General case' 0 C--N 1.309 -1.164 0 CA-C-N 114.891 -1.049 . . . . 0.0 108.348 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.423 ' SG ' ' HB2' ' A' ' 41' ' ' CYS . 46.4 t -136.98 127.18 26.26 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 177.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 41.4 m-80 -72.48 -20.28 61.4 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-O 120.972 0.415 . . . . 0.0 110.705 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.488 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 49.5 m -68.59 137.15 54.04 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.712 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 77.9 p -117.9 173.38 6.8 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.434 -177.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 15.1 m -62.08 -20.27 63.84 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 121.04 0.448 . . . . 0.0 110.947 178.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -68.09 -39.59 82.83 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.391 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 176.22 146.51 6.01 Favored Glycine 0 N--CA 1.428 -1.855 0 C-N-CA 120.848 -0.691 . . . . 0.0 111.853 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 45.1 t -63.91 129.7 41.14 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 178.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.488 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 30.8 mmmt -96.23 -12.69 24.23 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 -176.261 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.499 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 18.7 p -99.97 -41.4 7.21 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 119.654 -0.818 . . . . 0.0 109.928 177.123 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.46 15.82 9.3 Favored Glycine 0 N--CA 1.433 -1.531 0 C-N-CA 120.646 -0.788 . . . . 0.0 112.816 178.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.499 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 75.7 mmtt -94.64 6.06 50.01 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 176.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 67.99 37.98 2.88 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.694 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.629 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 26.6 p -113.14 141.9 46.38 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 115.644 -0.707 . . . . 0.0 109.327 176.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 39.2 p -136.55 106.4 6.24 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.624 -179.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 90.8 147.86 19.84 Favored Glycine 0 N--CA 1.437 -1.234 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.312 -179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -59.37 -30.26 92.28 Favored 'Trans proline' 0 C--N 1.342 0.216 0 C-N-CA 122.327 2.018 . . . . 0.0 111.918 -179.52 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -63.63 -47.01 83.1 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.565 -179.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.4 m -101.52 19.62 17.59 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.257 -178.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.629 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 44.6 t -75.24 126.63 31.41 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-O 120.874 0.369 . . . . 0.0 110.375 179.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 30.5 mmmt -99.58 -5.11 29.65 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.366 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.403 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 15.2 m -89.0 142.18 27.85 Favored 'General case' 0 N--CA 1.436 -1.128 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.017 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -116.27 73.08 0.27 Allowed Glycine 0 C--N 1.316 -0.575 0 C-N-CA 120.808 -0.711 . . . . 0.0 113.074 -176.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.451 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 9.7 t 65.65 166.39 0.19 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.18 0.592 . . . . 0.0 111.355 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 23.3 t 70.21 -16.57 0.3 Allowed 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.411 0.684 . . . . 0.0 112.759 177.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 20.1 t -76.88 165.16 25.06 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 110.354 -0.239 . . . . 0.0 110.354 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 6.7 m -64.24 -24.59 67.72 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.87 -177.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.49 ' SG ' ' HE2' ' A' ' 67' ' ' LYS . 20.8 p -75.92 -4.09 39.07 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.922 0.392 . . . . 0.0 111.01 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.49 ' HE2' ' SG ' ' A' ' 66' ' ' CYS . 18.0 mmtt . . . . . 0 C--O 1.258 1.517 0 CA-C-O 117.485 -1.245 . . . . 0.0 110.34 -178.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.503 0 N-CA-C 112.333 -0.307 . . . . 0.0 112.333 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.3 p -65.26 -36.78 85.18 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-O 120.963 0.411 . . . . 0.0 111.173 179.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -104.91 36.51 4.35 Favored Glycine 0 N--CA 1.443 -0.859 0 N-CA-C 111.36 -0.696 . . . . 0.0 111.36 179.035 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 61.4 tttm -78.99 108.19 12.29 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-O 121.043 0.449 . . . . 0.0 110.2 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 168.68 127.98 0.96 Allowed Glycine 0 N--CA 1.437 -1.293 0 N-CA-C 111.305 -0.718 . . . . 0.0 111.305 -179.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -119.99 146.85 45.46 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-O 120.603 0.239 . . . . 0.0 110.387 -179.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 150.49 -165.62 30.03 Favored Glycine 0 CA--C 1.49 -1.482 0 C-N-CA 120.918 -0.658 . . . . 0.0 111.955 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -137.89 179.76 6.24 Favored 'General case' 0 N--CA 1.427 -1.599 0 CA-C-O 121.41 0.624 . . . . 0.0 111.024 179.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -126.39 37.36 4.33 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 114.969 -1.014 . . . . 0.0 108.387 178.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.639 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 59.4 m -91.34 156.49 17.74 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 114.659 -1.155 . . . . 0.0 112.617 -176.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.3 p -94.16 177.76 5.86 Favored 'General case' 0 N--CA 1.446 -0.644 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.465 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 44.7 m -57.75 -37.74 74.14 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 111.782 0.29 . . . . 0.0 111.782 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.97 -42.28 98.96 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-O 120.942 0.401 . . . . 0.0 111.517 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.56 ' HB3' ' HB3' ' A' ' 10' ' ' CYS . 11.7 t -73.83 -25.46 60.1 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.365 0.603 . . . . 0.0 109.635 179.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 42.2 mtt180 -89.78 12.83 15.98 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.411 178.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 42.6 m -89.05 177.71 6.58 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.279 -0.267 . . . . 0.0 110.279 179.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.469 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 3.4 tm-20 -131.84 111.08 14.61 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-O 120.707 0.289 . . . . 0.0 110.507 178.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.469 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 72.0 Cg_endo -77.94 -170.55 8.85 Favored 'Cis proline' 0 C--N 1.347 0.481 0 C-N-CA 122.926 -1.697 . . . . 0.0 110.924 -2.264 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.7 t -59.46 122.95 15.27 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 120.898 0.38 . . . . 0.0 110.575 -179.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 84.5 mm-40 -110.17 15.73 22.22 Favored 'General case' 0 CA--C 1.503 -0.84 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.007 -177.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.857 ' SG ' ' HA ' ' A' ' 25' ' ' CYS . 3.4 t -65.62 -27.88 68.71 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 179.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 50.75 -139.01 23.94 Favored Glycine 0 C--N 1.341 0.826 0 CA-C-N 114.704 -1.135 . . . . 0.0 115.345 173.323 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.2 m -84.03 -15.39 47.74 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.101 -0.549 . . . . 0.0 111.293 -177.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.8 mmmt -73.95 -48.75 28.42 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.186 179.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.857 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 8.2 t 53.59 81.9 0.09 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.318 -0.856 . . . . 0.0 110.74 -179.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -86.61 -11.2 52.12 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.869 -175.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.639 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 30.8 p -82.92 175.52 10.0 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.0 0.428 . . . . 0.0 111.176 -178.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -123.04 -135.57 4.62 Favored Glycine 0 N--CA 1.437 -1.253 0 C-N-CA 120.474 -0.87 . . . . 0.0 112.499 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -74.58 152.29 39.31 Favored 'General case' 0 C--N 1.313 -0.992 0 C-N-CA 122.899 0.48 . . . . 0.0 111.071 -179.029 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 94.84 15.92 43.89 Favored Glycine 0 N--CA 1.448 -0.553 0 C-N-CA 121.021 -0.609 . . . . 0.0 112.944 178.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.69 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 16.1 t -114.77 -62.61 1.58 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 111.919 0.34 . . . . 0.0 111.919 -179.103 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 76.3 p 52.38 35.48 17.46 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.124 0.569 . . . . 0.0 111.8 -177.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.69 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -58.35 142.44 48.21 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.339 179.757 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -93.28 18.31 9.78 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 121.392 0.615 . . . . 0.0 109.681 178.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -120.71 -53.55 2.08 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 115.499 -0.773 . . . . 0.0 110.531 -177.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.649 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 29.8 p -98.24 -38.93 9.09 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.735 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 11.1 ttmm -107.18 36.01 2.84 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.471 0.653 . . . . 0.0 111.104 -174.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.424 ' O ' ' HD3' ' A' ' 67' ' ' LYS . 14.7 t -96.86 171.27 8.62 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.729 -177.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -99.8 148.59 24.25 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.663 178.656 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -110.28 3.89 20.36 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.656 -178.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.406 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 64.8 m -80.08 155.79 27.38 Favored 'General case' 0 N--CA 1.44 -0.958 0 CA-C-O 120.827 0.346 . . . . 0.0 110.712 179.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 54.7 p -122.87 159.15 28.79 Favored 'General case' 0 N--CA 1.438 -1.032 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.403 -178.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.5 m -65.03 -27.97 69.17 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.148 0.499 . . . . 0.0 110.241 179.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -66.52 -32.18 73.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.472 -0.785 . . . . 0.0 110.896 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -174.44 128.36 1.44 Allowed Glycine 0 N--CA 1.437 -1.253 0 C-N-CA 120.89 -0.671 . . . . 0.0 111.759 -179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.9 t -63.31 144.23 57.12 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 178.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 45.4 mmtm -104.9 -21.58 13.29 Favored 'General case' 0 C--N 1.317 -0.848 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -175.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 25.7 p -98.12 -41.69 7.81 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.75 179.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.93 -2.38 19.54 Favored Glycine 0 N--CA 1.443 -0.893 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.094 -178.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.602 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 30.4 mmmt -79.65 -3.33 46.77 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.691 0.281 . . . . 0.0 110.405 178.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 70.16 17.06 7.3 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.513 176.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.572 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 3.4 p -69.5 -37.5 77.24 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.798 179.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 44.1 p 52.09 37.39 21.39 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.715 0.806 . . . . 0.0 112.797 177.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 134.44 159.59 8.88 Favored Glycine 0 N--CA 1.439 -1.129 0 C-N-CA 120.148 -1.025 . . . . 0.0 112.296 178.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -62.26 -25.52 76.79 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.968 2.445 . . . . 0.0 112.798 -178.399 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 27.7 m-20 -62.01 -40.08 94.47 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.692 -178.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 40.2 m -115.53 18.35 15.95 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-O 121.035 0.445 . . . . 0.0 110.626 -179.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.572 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 48.6 t -79.06 120.77 24.1 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.21 0.529 . . . . 0.0 111.067 -178.645 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -108.49 7.48 26.88 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.683 -0.689 . . . . 0.0 109.81 179.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.602 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 26.5 m -80.77 142.75 33.46 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.656 178.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -127.2 82.37 0.35 Allowed Glycine 0 C--N 1.311 -0.842 0 C-N-CA 120.925 -0.655 . . . . 0.0 111.771 -178.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 52.0 m 62.99 171.99 0.15 Allowed 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 122.722 0.409 . . . . 0.0 110.992 -178.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 31.6 m 62.81 3.53 1.21 Allowed 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 176.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 33.1 t -101.74 167.26 10.21 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 122.032 -0.417 . . . . 0.0 110.376 179.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.9 t -68.46 -27.84 66.51 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.748 -177.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.406 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 25.6 p -82.55 -0.86 48.73 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.138 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.424 ' HD3' ' O ' ' A' ' 38' ' ' THR . 70.8 mmtt . . . . . 0 C--O 1.263 1.814 0 CA-C-O 117.676 -1.154 . . . . 0.0 110.786 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.365 0 N-CA-C 112.276 -0.33 . . . . 0.0 112.276 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 71.0 m -132.31 150.32 52.18 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 120.675 0.274 . . . . 0.0 110.503 179.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 166.95 101.31 0.15 Allowed Glycine 0 N--CA 1.443 -0.862 0 N-CA-C 111.533 -0.627 . . . . 0.0 111.533 -179.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.8 mmmt -83.69 115.24 22.09 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.186 0.517 . . . . 0.0 111.318 -179.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -96.06 -20.43 25.84 Favored Glycine 0 CA--C 1.495 -1.17 0 N-CA-C 109.932 -1.267 . . . . 0.0 109.932 177.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? -142.52 122.58 13.7 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 114.908 -0.646 . . . . 0.0 109.309 177.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -97.95 -122.63 4.55 Favored Glycine 0 N--CA 1.441 -1.026 0 C-N-CA 120.374 -0.917 . . . . 0.0 112.738 -179.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.471 ' HB3' ' HD2' ' A' ' 9' ' ' LYS . 11.9 mm-40 -73.03 -85.7 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.328 0.585 . . . . 0.0 112.256 -178.448 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.471 ' HD2' ' HB3' ' A' ' 8' ' ' GLU . 10.8 mptt -127.24 25.25 6.2 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 115.608 -0.724 . . . . 0.0 109.764 -178.157 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.515 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 85.9 m -88.5 139.1 30.82 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.016 179.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.426 ' OG1' ' HB2' ' A' ' 26' ' ' GLN . 73.4 p -89.42 -177.62 5.39 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.396 -179.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 11.3 m -64.13 -22.77 67.07 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.064 179.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.86 -49.39 58.73 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-O 120.837 0.351 . . . . 0.0 110.737 179.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 36.3 t -73.48 -31.16 63.6 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.002 0.43 . . . . 0.0 110.536 179.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.553 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 1.7 mmp_? -74.17 -11.39 60.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.857 179.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 19.9 t -82.11 165.27 20.71 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 178.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.406 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 8.0 pt-20 -126.37 115.08 23.36 Favored Pre-proline 0 C--N 1.316 -0.85 0 CA-C-O 120.81 0.338 . . . . 0.0 110.997 -179.294 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.406 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 1.8 Cg_endo -81.27 -174.07 13.4 Favored 'Cis proline' 0 C--N 1.348 0.514 0 C-N-CA 123.58 -1.425 . . . . 0.0 111.722 -0.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 17.5 m -56.63 126.56 27.25 Favored 'General case' 0 CA--C 1.504 -0.814 0 CA-C-O 121.644 0.735 . . . . 0.0 112.55 -178.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -101.92 12.82 36.33 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.738 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.405 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 15.1 m -60.99 -28.77 69.26 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.269 177.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 59.58 -112.6 4.45 Favored Glycine 0 C--N 1.34 0.791 0 CA-C-N 115.74 -0.663 . . . . 0.0 112.028 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 70.3 m -121.43 17.75 11.35 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-O 121.147 0.498 . . . . 0.0 110.211 177.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -102.31 -45.83 4.99 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.836 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 55.9 90.94 0.03 OUTLIER 'General case' 0 C--O 1.236 0.387 0 CA-C-O 121.608 0.718 . . . . 0.0 110.601 -176.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.426 ' HB2' ' OG1' ' A' ' 11' ' ' THR . 49.4 mt-30 -92.9 -6.08 49.44 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.298 -174.708 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.515 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 26.3 p -88.27 174.06 8.41 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-O 121.101 0.477 . . . . 0.0 111.501 -177.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -118.12 -134.29 5.05 Favored Glycine 0 N--CA 1.443 -0.892 0 C-N-CA 120.936 -0.649 . . . . 0.0 113.242 -179.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -74.25 176.8 6.31 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 123.189 0.595 . . . . 0.0 112.027 -177.178 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 62.46 31.7 80.49 Favored Glycine 0 CA--C 1.502 -0.76 0 CA-C-N 115.283 -0.871 . . . . 0.0 112.158 178.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 49.3 t -124.9 -76.7 0.59 Allowed 'General case' 0 N--CA 1.423 -1.823 0 C-N-CA 120.651 -0.419 . . . . 0.0 111.909 -177.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 75.1 p 48.73 41.12 17.42 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.548 0.689 . . . . 0.0 110.906 -178.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.424 ' HB2' ' SG ' ' A' ' 36' ' ' CYS . 0.5 OUTLIER -54.48 157.41 2.88 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 114.753 -1.112 . . . . 0.0 112.445 -178.66 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -95.57 21.03 8.75 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.341 0.591 . . . . 0.0 110.386 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -131.55 -63.81 0.82 Allowed 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.371 -179.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.424 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 27.4 p -82.91 -45.2 14.49 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 115.705 -0.679 . . . . 0.0 112.16 -179.195 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.0 ttmt -118.79 50.94 1.15 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 121.192 0.52 . . . . 0.0 112.162 -170.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 10.7 t -97.62 162.66 13.18 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.707 179.004 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.413 ' SG ' ' HB2' ' A' ' 41' ' ' CYS . 51.6 t -94.96 140.56 29.78 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 179.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 43.5 m-80 -99.64 0.61 42.4 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.837 -179.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.413 ' HB2' ' SG ' ' A' ' 39' ' ' CYS . 62.1 m -82.93 141.09 32.42 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.987 -0.551 . . . . 0.0 109.727 177.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 59.3 p -100.39 164.89 11.72 Favored 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 109.756 -0.461 . . . . 0.0 109.756 -178.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.452 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 7.9 m -69.55 -9.68 54.97 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 121.299 0.571 . . . . 0.0 110.539 178.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -99.44 -32.77 10.97 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.005 179.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -150.2 128.42 2.67 Favored Glycine 0 N--CA 1.438 -1.187 0 C-N-CA 120.289 -0.958 . . . . 0.0 112.843 -177.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.0 t -80.57 133.73 35.82 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 179.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -98.84 -24.78 14.86 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 112.809 0.67 . . . . 0.0 112.809 -176.005 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 23.2 p -93.43 -35.41 13.0 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 120.221 -0.592 . . . . 0.0 110.579 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 110.37 -2.24 29.51 Favored Glycine 0 N--CA 1.438 -1.204 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.932 178.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -78.4 -7.16 57.04 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.034 0.445 . . . . 0.0 110.47 179.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 64.16 33.6 11.72 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.173 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.494 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 3.1 p -75.1 -49.12 20.69 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.254 -0.885 . . . . 0.0 110.139 178.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.452 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 53.4 p 50.45 76.27 0.15 Allowed 'General case' 0 C--O 1.237 0.423 0 C-N-CA 123.941 0.896 . . . . 0.0 112.432 179.183 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 113.84 138.92 7.06 Favored Glycine 0 N--CA 1.436 -1.324 0 CA-C-N 115.496 -0.774 . . . . 0.0 111.714 179.071 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.512 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 21.8 Cg_endo -62.12 -27.98 79.43 Favored 'Trans proline' 0 C--N 1.345 0.366 0 C-N-CA 122.783 2.322 . . . . 0.0 112.524 -178.318 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -62.84 -39.51 94.58 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.106 179.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.4 m -107.05 24.23 13.14 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.487 -179.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.512 ' HB2' ' HA ' ' A' ' 55' ' ' PRO . 0.5 OUTLIER -76.04 131.42 39.49 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.772 -178.272 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -106.73 3.77 26.98 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.219 0.533 . . . . 0.0 109.607 -179.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 4.3 m -96.24 167.3 11.28 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.877 -175.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -98.59 -106.63 2.62 Favored Glycine 0 N--CA 1.442 -0.959 0 CA-C-N 115.815 -0.63 . . . . 0.0 112.222 179.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 3.9 m -131.43 -12.74 3.47 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.73 0.3 . . . . 0.0 111.591 -178.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 17.4 m -103.0 20.51 17.43 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -175.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 38.2 t -96.75 165.69 12.0 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 120.838 0.351 . . . . 0.0 110.963 -179.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.6 m -64.18 -25.32 68.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.948 -0.569 . . . . 0.0 112.291 -178.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.502 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 26.7 p -89.84 13.53 14.26 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 120.541 -0.464 . . . . 0.0 110.725 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.502 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 39.5 mmtm . . . . . 0 C--O 1.264 1.822 0 CA-C-O 117.875 -1.059 . . . . 0.0 110.437 -179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.473 ' N ' ' HB3' ' A' ' 4' ' ' LYS . . . . . . . . 0 N--CA 1.489 2.201 0 N-CA-C 112.406 -0.278 . . . . 0.0 112.406 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.9 m -76.32 98.52 4.53 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 120.85 0.357 . . . . 0.0 111.115 -178.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 71.35 19.41 77.53 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.909 -0.662 . . . . 0.0 112.185 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.473 ' HB3' ' N ' ' A' ' 1' ' ' GLY . 28.3 tptp -97.17 -65.6 0.95 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -72.29 -48.52 24.5 Favored Glycine 0 N--CA 1.447 -0.581 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 176.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -162.43 179.68 7.62 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 177.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -104.52 106.31 2.72 Favored Glycine 0 N--CA 1.442 -0.913 0 C-N-CA 120.189 -1.005 . . . . 0.0 113.807 -176.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -76.25 120.81 22.02 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 176.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 47.8 mtmt -90.89 52.12 2.1 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 121.36 0.6 . . . . 0.0 110.511 -177.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.523 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 78.1 m -80.53 134.9 36.01 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.682 178.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 61.2 p -80.87 177.32 9.12 Favored 'General case' 0 N--CA 1.441 -0.924 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.126 -178.784 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.9 p -58.15 -37.16 74.15 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.211 178.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -63.02 -47.53 82.7 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.862 0.363 . . . . 0.0 110.839 179.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 47.4 t -68.13 -38.61 82.38 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.163 0.506 . . . . 0.0 110.406 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 29.3 ttt180 -73.05 -9.36 58.65 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.874 -179.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 70.2 m -71.99 164.57 25.88 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 122.107 -0.37 . . . . 0.0 110.594 179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.431 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 0.2 OUTLIER -125.23 114.08 25.99 Favored Pre-proline 0 C--N 1.316 -0.855 0 CA-C-N 116.472 -0.331 . . . . 0.0 110.654 178.442 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.431 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 74.4 Cg_endo -75.73 174.34 53.36 Favored 'Cis proline' 0 C--O 1.237 0.438 0 C-N-CA 123.394 -1.503 . . . . 0.0 112.066 -1.184 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.578 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 49.6 t -57.9 132.88 54.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.228 -178.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 79.5 mm-40 -117.59 17.35 14.47 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.958 -179.235 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.682 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 3.8 t -60.11 -29.23 68.47 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.022 -0.99 . . . . 0.0 109.966 -179.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 81.13 -153.1 33.58 Favored Glycine 0 N--CA 1.431 -1.66 0 CA-C-N 115.463 -0.79 . . . . 0.0 112.195 178.617 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 15.5 m -107.33 11.82 28.73 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.2 mtpt -102.53 -30.58 10.89 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.862 -179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.67 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 1.1 m 65.59 103.78 0.04 OUTLIER 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.568 0.699 . . . . 0.0 112.799 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 79.9 mt-30 -95.48 -5.57 42.63 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-N 115.38 -0.827 . . . . 0.0 108.861 176.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.523 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 22.8 p -92.89 160.12 15.05 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.184 -178.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -79.96 162.15 46.35 Favored Glycine 0 N--CA 1.44 -1.049 0 N-CA-C 110.008 -1.237 . . . . 0.0 110.008 174.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.24 163.04 23.69 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 117.529 0.664 . . . . 0.0 111.307 -178.283 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 98.19 0.88 58.31 Favored Glycine 0 N--CA 1.439 -1.151 0 N-CA-C 110.311 -1.116 . . . . 0.0 110.311 -175.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 43.2 t -75.46 142.19 42.99 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 75.7 p -103.8 14.18 31.45 Favored 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 -175.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.7 m -67.33 133.03 48.86 Favored 'General case' 0 CA--C 1.509 -0.624 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.032 175.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -99.69 12.91 35.35 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.645 0.736 . . . . 0.0 109.035 177.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.8 -57.01 2.12 Favored 'General case' 0 CA--C 1.506 -0.719 0 CA-C-N 114.964 -1.016 . . . . 0.0 109.403 -178.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.682 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 28.4 p -82.6 -43.62 16.79 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.746 177.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.2 ttpm? -101.8 81.15 2.1 Favored 'General case' 0 N--CA 1.443 -0.801 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.519 178.564 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.3 t -121.73 155.41 35.3 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 -179.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.6 t -92.83 135.05 34.48 Favored 'General case' 0 N--CA 1.444 -0.725 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 38.3 m-80 -92.85 1.34 57.34 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 121.1 0.476 . . . . 0.0 110.881 -178.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.51 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 56.3 m -88.81 133.7 34.17 Favored 'General case' 0 N--CA 1.437 -1.12 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.338 179.197 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 1.6 t -108.69 164.77 12.08 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.337 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.551 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 44.4 m -70.58 -9.88 57.94 Favored 'General case' 0 C--N 1.305 -1.35 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.707 179.746 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -88.33 -19.69 26.35 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.78 -0.645 . . . . 0.0 110.432 177.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -179.65 131.11 1.61 Allowed Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.058 -179.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.6 t -76.9 147.84 36.78 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 109.753 -0.462 . . . . 0.0 109.753 179.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -109.71 -30.89 7.66 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 112.324 0.491 . . . . 0.0 112.324 -177.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.53 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 29.1 p -87.89 -34.18 18.26 Favored 'General case' 0 C--N 1.32 -0.69 0 C-N-CA 120.188 -0.605 . . . . 0.0 111.397 -177.574 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.28 -1.38 31.14 Favored Glycine 0 N--CA 1.445 -0.765 0 C-N-CA 120.61 -0.805 . . . . 0.0 112.507 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.558 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 75.1 mmtt -80.58 -8.64 59.67 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.029 0.442 . . . . 0.0 109.902 178.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 67.82 30.87 6.08 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.062 -0.972 . . . . 0.0 111.144 178.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.411 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.6 p -72.66 -44.05 62.36 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.157 177.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.551 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 77.7 p 50.78 41.0 25.83 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 123.72 0.808 . . . . 0.0 112.859 177.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 147.4 136.38 2.8 Favored Glycine 0 N--CA 1.437 -1.276 0 C-N-CA 120.384 -0.912 . . . . 0.0 111.731 179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.423 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 13.2 Cg_endo -57.2 -24.6 59.97 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.122 2.548 . . . . 0.0 113.621 -178.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -74.22 -35.86 63.92 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.923 0.392 . . . . 0.0 111.197 179.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 37.0 t -101.2 10.92 40.29 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 121.524 0.678 . . . . 0.0 109.746 179.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.423 ' HB2' ' HA ' ' A' ' 55' ' ' PRO . 13.8 t -79.87 110.27 15.07 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 115.08 -0.964 . . . . 0.0 109.69 -178.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -108.24 -6.95 16.11 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.277 -0.419 . . . . 0.0 111.725 -177.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.558 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.8 p -85.36 157.92 20.4 Favored 'General case' 0 C--N 1.32 -0.692 0 C-N-CA 120.157 -0.617 . . . . 0.0 111.707 -179.165 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -64.6 175.34 12.41 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 115.234 0.854 . . . . 0.0 115.234 -174.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.53 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 14.2 m -77.94 -10.63 59.68 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 123.697 0.799 . . . . 0.0 111.121 -178.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 16.7 m -93.95 9.81 35.95 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 120.96 0.41 . . . . 0.0 110.676 179.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 44.2 t -81.35 169.63 17.01 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.205 -178.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 22.8 t -69.97 -24.76 63.37 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.956 -177.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.51 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 22.0 p -82.5 -3.87 56.57 Favored 'General case' 0 CA--C 1.512 -0.515 0 C-N-CA 120.466 -0.493 . . . . 0.0 110.815 -179.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.53 ' HG3' ' HA ' ' A' ' 62' ' ' SER . 38.5 mmtm . . . . . 0 C--O 1.26 1.657 0 CA-C-O 117.533 -1.222 . . . . 0.0 110.449 -177.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.263 0 N-CA-C 112.448 -0.261 . . . . 0.0 112.448 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.1 m -139.1 150.99 46.34 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 120.686 0.279 . . . . 0.0 110.561 -179.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -122.35 28.29 5.82 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.897 -0.668 . . . . 0.0 111.975 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 44.8 mttm -130.69 156.04 45.59 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.056 0.455 . . . . 0.0 111.326 -178.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -158.63 139.91 6.59 Favored Glycine 0 N--CA 1.437 -1.262 0 N-CA-C 110.294 -1.122 . . . . 0.0 110.294 177.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -122.48 139.19 54.15 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 117.091 0.445 . . . . 0.0 110.333 -179.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -81.52 -100.33 0.39 Allowed Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.423 -0.894 . . . . 0.0 111.29 178.246 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.453 ' HB2' ' HD2' ' A' ' 9' ' ' LYS . 0.0 OUTLIER -100.43 -93.71 0.28 Allowed 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 120.796 0.332 . . . . 0.0 110.861 178.091 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.453 ' HD2' ' HB2' ' A' ' 8' ' ' GLU . 11.9 mptt -108.03 10.41 28.24 Favored 'General case' 0 C--N 1.312 -1.056 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 176.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.645 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 80.9 m -64.23 150.62 45.52 Favored 'General case' 0 N--CA 1.431 -1.408 0 CA-C-N 114.621 -1.172 . . . . 0.0 112.885 -176.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 65.2 p -109.76 -174.1 2.41 Favored 'General case' 0 N--CA 1.434 -1.252 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.116 -179.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.9 t -67.19 -30.05 69.89 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.673 0.273 . . . . 0.0 110.809 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -60.87 -49.03 79.11 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-O 120.751 0.31 . . . . 0.0 110.667 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 42.6 t -64.07 -38.81 92.42 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.151 179.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 26.6 mtp180 -80.55 18.54 0.92 Allowed 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.683 0.623 . . . . 0.0 112.683 179.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.3 m -106.06 159.83 15.77 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 173.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.447 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 19.4 mm-40 -120.09 115.77 32.95 Favored Pre-proline 0 C--N 1.321 -0.661 0 C-N-CA 120.703 -0.399 . . . . 0.0 111.633 -179.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.447 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 72.9 Cg_endo -77.61 169.2 74.37 Favored 'Cis proline' 0 C--N 1.346 0.41 0 C-N-CA 123.115 -1.619 . . . . 0.0 111.033 -2.252 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 74.6 m -54.02 122.33 9.91 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.088 0.471 . . . . 0.0 110.646 -179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 32.3 mm-40 -88.89 16.78 6.39 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.987 -175.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.526 ' HB2' ' HB3' ' A' ' 36' ' ' CYS . 2.3 m -64.53 -29.73 70.76 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.953 178.343 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 62.97 -138.86 44.35 Favored Glycine 0 N--CA 1.444 -0.802 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.838 -179.082 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.6 m -98.86 12.01 37.05 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-O 121.028 0.442 . . . . 0.0 110.233 178.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 66.1 mttm -97.51 -53.18 3.52 Favored 'General case' 0 CA--C 1.511 -0.531 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.64 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 0.1 OUTLIER 64.84 99.36 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 114.916 -1.038 . . . . 0.0 112.355 178.23 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 87.3 mt-30 -90.65 -14.3 32.57 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 115.104 -0.953 . . . . 0.0 111.666 -178.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.645 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 31.6 p -87.68 -175.1 5.06 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 121.029 0.443 . . . . 0.0 111.698 -177.078 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.23 -110.01 0.6 Allowed Glycine 0 N--CA 1.442 -0.915 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.43 179.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -160.77 0.0 0.06 Allowed 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.615 0.598 . . . . 0.0 112.615 -176.132 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -86.76 -6.96 79.17 Favored Glycine 0 C--N 1.301 -1.377 0 C-N-CA 121.077 -0.583 . . . . 0.0 113.719 -175.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.503 ' SG ' ' HE2' ' A' ' 37' ' ' LYS . 3.8 p -75.71 -29.67 59.03 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 120.837 0.351 . . . . 0.0 110.917 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 63.6 p 50.06 42.12 24.4 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 123.492 0.717 . . . . 0.0 112.251 -179.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.429 ' SG ' ' HB2' ' A' ' 31' ' ' CYS . 58.3 m -66.62 177.31 1.62 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.881 -179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -111.7 -0.27 16.07 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 121.243 0.544 . . . . 0.0 110.222 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.49 -67.23 0.88 Allowed 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.569 -178.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.64 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 7.9 p -85.05 -13.45 50.37 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 121.222 0.534 . . . . 0.0 110.942 179.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.584 ' NZ ' ' SG ' ' A' ' 27' ' ' CYS . 11.2 mptt -105.71 45.19 0.98 Allowed 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 121.585 0.707 . . . . 0.0 110.982 178.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 8.8 t -91.31 128.44 37.14 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.595 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.9 t -92.27 135.28 34.14 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.8 m-80 -89.06 -6.57 57.02 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-O 121.143 0.497 . . . . 0.0 110.704 -178.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.535 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 36.8 m -81.43 133.24 35.38 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-N 115.562 -0.745 . . . . 0.0 109.658 178.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 74.9 p -109.42 170.73 7.87 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.161 -177.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.9 m -71.75 -9.93 59.02 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.164 0.506 . . . . 0.0 110.403 178.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -80.43 -40.36 26.49 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.968 178.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -169.18 139.39 5.6 Favored Glycine 0 N--CA 1.437 -1.287 0 CA-C-N 115.596 -0.729 . . . . 0.0 111.767 -179.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 19.1 t -79.97 129.75 34.74 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-O 120.702 0.287 . . . . 0.0 110.431 179.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -87.99 -39.7 14.48 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.481 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 16.6 p -78.01 -33.13 51.33 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 119.97 -0.692 . . . . 0.0 110.264 -178.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 104.72 0.22 42.55 Favored Glycine 0 N--CA 1.438 -1.192 0 C-N-CA 120.79 -0.719 . . . . 0.0 113.262 177.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.481 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 28.5 mmtp -82.4 -1.69 50.78 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 117.15 0.475 . . . . 0.0 110.991 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 68.88 23.07 6.91 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.44 176.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.405 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 1.8 p -70.74 -47.2 60.93 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.919 177.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 47.6 p 51.43 31.63 7.58 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.876 0.87 . . . . 0.0 112.864 177.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 159.16 145.84 4.37 Favored Glycine 0 N--CA 1.436 -1.343 0 C-N-CA 120.534 -0.841 . . . . 0.0 111.897 -179.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -65.56 -30.87 51.53 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.903 2.402 . . . . 0.0 113.302 -177.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -76.16 -17.67 59.45 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.287 0.565 . . . . 0.0 110.485 -178.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 17.8 m -117.17 18.52 14.51 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.095 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.405 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 0.5 OUTLIER -73.11 130.26 39.89 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.645 -178.523 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -113.65 6.4 16.9 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.616 -177.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -122.9 159.07 29.0 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.754 -177.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -77.33 -164.82 22.88 Favored Glycine 0 C--N 1.332 0.327 0 CA-C-N 115.983 -0.553 . . . . 0.0 113.761 -177.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.474 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 4.0 m -85.7 -10.39 55.73 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 122.923 0.489 . . . . 0.0 111.753 -176.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.0 m -89.2 13.08 14.12 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.147 0.499 . . . . 0.0 110.353 179.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 11.5 t -90.68 170.06 10.46 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.355 -178.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 2.9 p -76.31 -16.18 59.83 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -176.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.546 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 21.6 p -87.15 2.66 49.2 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.988 0.423 . . . . 0.0 110.723 178.497 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.546 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 11.3 mmtp . . . . . 0 C--O 1.265 1.884 0 CA-C-O 117.686 -1.15 . . . . 0.0 110.91 -176.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 N-CA-C 112.354 -0.298 . . . . 0.0 112.354 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 43.0 m -81.81 150.44 27.86 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-O 120.76 0.314 . . . . 0.0 110.418 179.274 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 99.3 5.12 56.11 Favored Glycine 0 N--CA 1.445 -0.712 0 C-N-CA 120.507 -0.854 . . . . 0.0 112.213 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.2 pttm -76.07 132.26 39.98 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.902 0.382 . . . . 0.0 110.562 179.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -79.04 83.99 1.26 Allowed Glycine 0 N--CA 1.442 -0.957 0 C-N-CA 121.192 -0.528 . . . . 0.0 112.217 -178.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -92.13 -27.41 17.75 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.648 0.261 . . . . 0.0 110.299 179.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 59.61 -117.64 11.86 Favored Glycine 0 CA--C 1.503 -0.71 0 CA-C-N 115.851 -0.613 . . . . 0.0 112.303 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -146.47 137.48 24.26 Favored 'General case' 0 C--N 1.307 -1.268 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 178.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -77.77 -0.75 28.23 Favored 'General case' 0 C--N 1.307 -1.254 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.82 -178.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.682 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 93.6 m -82.09 143.66 31.33 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-O 121.191 0.52 . . . . 0.0 111.522 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 67.1 p -93.52 -179.28 4.98 Favored 'General case' 0 N--CA 1.432 -1.365 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.348 -179.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.9 m -66.38 -21.39 66.23 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.959 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.57 -45.95 67.5 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-O 120.829 0.347 . . . . 0.0 111.042 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.448 ' HB2' ' HB3' ' A' ' 27' ' ' CYS . 22.6 t -68.1 -31.49 71.13 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 121.233 0.539 . . . . 0.0 110.226 -179.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 31.5 mmt180 -90.57 9.57 28.97 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.007 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.1 t -83.76 169.55 15.1 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.459 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 33.5 mm-40 -119.34 105.69 43.85 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.713 -0.222 . . . . 0.0 111.083 -179.708 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.459 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 1.6 Cg_endo -83.85 -173.33 10.72 Favored 'Cis proline' 0 N--CA 1.456 -0.685 0 C-N-CA 123.888 -1.297 . . . . 0.0 111.314 -1.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 15.1 t -56.42 123.3 14.25 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-O 121.015 0.436 . . . . 0.0 110.54 -178.365 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -108.75 20.59 18.31 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.717 -176.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -60.67 -35.74 77.01 Favored 'General case' 0 C--N 1.309 -1.187 0 CA-C-O 120.78 0.324 . . . . 0.0 111.205 179.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 78.26 -169.97 54.67 Favored Glycine 0 N--CA 1.44 -1.049 0 C-N-CA 121.131 -0.557 . . . . 0.0 112.83 178.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 24.5 m -77.53 -11.82 59.9 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.688 0.28 . . . . 0.0 111.301 -179.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -86.55 -31.74 21.07 Favored 'General case' 0 CA--C 1.507 -0.688 0 N-CA-C 110.097 -0.334 . . . . 0.0 110.097 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 6.0 t 66.54 105.83 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.368 0 CA-C-N 115.277 -0.874 . . . . 0.0 109.805 -176.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 41.9 mt-30 -110.4 28.49 8.59 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 115.159 -0.928 . . . . 0.0 111.818 -173.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.613 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 9.1 p -124.25 -164.81 1.29 Allowed 'General case' 0 C--N 1.312 -1.062 0 CA-C-O 120.665 0.269 . . . . 0.0 110.555 178.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -114.25 153.95 17.28 Favored Glycine 0 N--CA 1.442 -0.91 0 N-CA-C 110.86 -0.896 . . . . 0.0 110.86 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -79.09 84.07 5.11 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.489 0.662 . . . . 0.0 111.269 -176.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -168.82 23.89 0.1 Allowed Glycine 0 C--N 1.301 -1.373 0 N-CA-C 110.634 -0.986 . . . . 0.0 110.634 177.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.72 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 28.6 p -112.95 -21.29 11.19 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 115.682 -0.259 . . . . 0.0 111.572 -177.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 38.4 p 49.08 39.14 14.39 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.464 0.649 . . . . 0.0 109.951 -173.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.72 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 1.8 t -66.73 149.91 49.85 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.555 -176.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -104.52 22.61 14.67 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.148 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -126.17 -58.17 1.37 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.069 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 7.8 p -83.74 -44.45 14.42 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.318 0.58 . . . . 0.0 110.034 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 63.6 tttm -86.24 82.79 7.9 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.421 -0.809 . . . . 0.0 110.148 179.301 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.445 ' O ' ' HD3' ' A' ' 67' ' ' LYS . 14.1 t -142.88 174.28 10.8 Favored 'General case' 0 C--N 1.311 -1.076 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.83 -179.412 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.506 ' SG ' ' HB2' ' A' ' 66' ' ' CYS . 48.7 t -114.01 145.19 41.9 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.1 0.476 . . . . 0.0 110.939 -178.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.6 m-80 -102.26 -4.79 25.14 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.87 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.622 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 61.7 m -77.98 151.07 33.81 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.905 -0.589 . . . . 0.0 110.798 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 63.2 p -121.23 169.47 10.53 Favored 'General case' 0 C--N 1.314 -0.955 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.453 -178.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.49 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 14.4 m -68.97 -27.07 65.39 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-O 121.172 0.51 . . . . 0.0 110.574 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -81.17 -34.4 32.4 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.701 -0.681 . . . . 0.0 111.28 179.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -153.84 131.86 3.38 Favored Glycine 0 N--CA 1.436 -1.304 0 C-N-CA 120.323 -0.942 . . . . 0.0 112.511 -177.184 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 4.4 t -86.27 135.86 33.38 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -93.47 -28.02 16.35 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 112.218 0.451 . . . . 0.0 112.218 -176.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 21.7 p -92.97 -30.68 15.23 Favored 'General case' 0 C--N 1.318 -0.782 0 C-N-CA 120.565 -0.454 . . . . 0.0 110.829 -178.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 98.5 9.6 52.65 Favored Glycine 0 N--CA 1.444 -0.831 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.883 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -90.64 -4.6 56.68 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 120.956 0.407 . . . . 0.0 110.303 178.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 65.67 26.55 11.46 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.213 179.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.629 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 4.4 p -66.82 -46.94 73.59 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 176.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.49 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 52.0 p 50.78 72.79 0.32 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 114.915 -1.038 . . . . 0.0 113.184 176.051 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 111.96 140.26 8.0 Favored Glycine 0 N--CA 1.444 -0.816 0 C-N-CA 120.713 -0.756 . . . . 0.0 111.876 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -57.71 -29.61 86.2 Favored 'Trans proline' 0 C--N 1.35 0.632 0 C-N-CA 123.103 2.536 . . . . 0.0 112.846 -177.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -64.16 -39.23 93.56 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.979 0.419 . . . . 0.0 111.229 -179.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.6 t -106.16 17.34 23.66 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-O 121.288 0.565 . . . . 0.0 109.941 -179.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.629 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 19.3 t -86.64 111.01 20.24 Favored 'General case' 0 N--CA 1.444 -0.775 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.124 -178.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -106.3 -2.5 22.24 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.716 -177.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 3.9 m -71.72 154.63 41.21 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.636 -179.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.537 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -74.53 -179.56 41.92 Favored Glycine 0 N--CA 1.443 -0.875 0 C-N-CA 120.477 -0.868 . . . . 0.0 111.258 176.587 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.416 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 6.6 m -80.31 4.28 18.3 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 120.893 0.377 . . . . 0.0 111.88 -178.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 20.0 m -109.98 12.7 23.62 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.917 0.389 . . . . 0.0 110.587 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 22.2 t -86.59 166.88 15.06 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.559 -178.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 14.5 m -62.62 -26.52 68.66 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -177.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.622 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 6.1 p -81.18 -6.71 59.15 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.779 0.323 . . . . 0.0 111.8 -178.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.537 ' HG3' ' O ' ' A' ' 61' ' ' GLY . 13.2 mmtp . . . . . 0 C--O 1.261 1.659 0 CA-C-O 117.955 -1.021 . . . . 0.0 111.326 -177.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.177 0 N-CA-C 112.553 -0.219 . . . . 0.0 112.553 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.6 t -80.64 -46.24 15.94 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.983 0.421 . . . . 0.0 110.562 -179.135 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 143.09 -172.81 24.44 Favored Glycine 0 N--CA 1.439 -1.147 0 C-N-CA 120.657 -0.782 . . . . 0.0 112.074 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt -93.05 -66.78 0.9 Allowed 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 120.513 0.197 . . . . 0.0 111.249 -178.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.99 109.65 1.91 Allowed Glycine 0 N--CA 1.447 -0.623 0 C-N-CA 120.858 -0.686 . . . . 0.0 111.665 -179.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.46 ' HG2' ' O ' ' A' ' 7' ' ' GLY . 21.2 ttpp -142.79 134.94 27.31 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-O 120.794 0.33 . . . . 0.0 110.984 -178.136 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . 0.46 ' O ' ' HG2' ' A' ' 6' ' ' LYS . . . -90.07 175.29 41.34 Favored Glycine 0 N--CA 1.438 -1.18 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 175.291 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 17.0 mp0 -59.04 -56.97 15.35 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 116.934 0.367 . . . . 0.0 111.168 178.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 5.2 tmtt? 176.82 -40.48 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.59 ' SG ' ' HB2' ' A' ' 27' ' ' CYS . 88.5 m -57.82 139.81 53.23 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 115.481 -0.782 . . . . 0.0 111.217 178.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.8 p -80.69 174.22 11.83 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.793 -178.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 7.8 p -61.84 -28.55 69.57 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.126 -179.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.85 -43.45 75.44 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.547 179.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.732 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 18.3 t -69.97 -36.33 75.14 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.033 -178.213 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 7.9 ttt180 -79.84 -9.24 59.64 Favored 'General case' 0 N--CA 1.445 -0.677 0 C-N-CA 120.69 -0.404 . . . . 0.0 111.437 -177.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.9 t -80.16 161.86 25.02 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 178.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.553 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 9.4 pt-20 -136.31 123.77 14.58 Favored Pre-proline 0 C--N 1.316 -0.886 0 CA-C-O 120.784 0.326 . . . . 0.0 111.437 -179.408 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.553 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 40.6 Cg_endo -64.36 157.9 71.89 Favored 'Cis proline' 0 C--N 1.348 0.525 0 C-N-CA 123.158 -1.601 . . . . 0.0 112.038 0.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.664 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 44.4 t -60.9 130.36 46.06 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.948 -177.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 78.3 mm-40 -101.94 13.75 33.9 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.897 -177.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.732 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -70.45 -16.49 62.94 Favored 'General case' 0 C--O 1.209 -1.043 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.057 -179.314 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.79 -30.26 56.3 Favored Glycine 0 CA--C 1.525 0.664 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.69 -179.243 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 53.1 p -64.64 -48.5 74.61 Favored 'General case' 0 CA--C 1.544 0.712 0 N-CA-C 112.079 0.4 . . . . 0.0 112.079 -179.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.4 mmmt -130.49 -46.18 1.08 Allowed 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 120.664 0.269 . . . . 0.0 111.384 -178.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.625 ' SG ' ' HB2' ' A' ' 36' ' ' CYS . 8.3 t 64.06 82.29 0.19 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.362 -179.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -117.51 20.07 13.7 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.491 -177.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.59 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 24.5 p -75.46 163.06 27.79 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.042 178.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -103.12 25.25 27.85 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.183 -1.008 . . . . 0.0 111.549 177.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.411 ' CD ' ' H ' ' A' ' 30' ' ' GLY . 0.0 OUTLIER 66.14 -175.19 0.19 Allowed 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.337 0.655 . . . . 0.0 110.444 -177.676 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.411 ' H ' ' CD ' ' A' ' 29' ' ' GLU . . . 87.28 10.29 71.44 Favored Glycine 0 N--CA 1.434 -1.442 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 -176.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.567 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 7.3 p -100.49 -26.45 13.85 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 114.651 -0.775 . . . . 0.0 109.685 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 46.6 p 53.06 36.43 22.18 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.945 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 62.6 m -66.14 167.34 10.22 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.701 179.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -117.91 11.87 13.59 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.316 -0.857 . . . . 0.0 108.841 176.48 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.404 ' HB3' ' HB3' ' A' ' 19' ' ' CYS . . . -110.68 -67.74 0.97 Allowed 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.467 -178.442 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.65 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 28.2 p -77.91 -44.62 26.43 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-O 121.368 0.604 . . . . 0.0 109.443 178.677 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.4 ' O ' ' HB ' ' A' ' 38' ' ' THR . 58.4 tttp -84.17 108.64 17.19 Favored 'General case' 0 N--CA 1.442 -0.844 0 CA-C-N 115.088 -0.96 . . . . 0.0 110.098 178.301 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.4 ' HB ' ' O ' ' A' ' 37' ' ' LYS . 10.0 t -179.26 164.16 1.34 Allowed 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 178.739 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.6 t -96.21 143.69 27.08 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -103.17 5.44 37.78 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.892 0.377 . . . . 0.0 111.48 -177.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.468 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 60.9 m -85.61 146.7 26.75 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.014 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 60.2 p -120.66 161.52 21.24 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 109.608 -0.516 . . . . 0.0 109.608 179.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.489 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 35.4 m -63.03 -27.76 69.63 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 121.091 0.472 . . . . 0.0 110.413 179.437 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.93 -36.01 79.42 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.952 178.433 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -164.01 128.98 1.91 Allowed Glycine 0 N--CA 1.437 -1.27 0 C-N-CA 120.351 -0.928 . . . . 0.0 112.73 -179.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 6.8 t -79.18 124.41 28.32 Favored 'General case' 0 N--CA 1.439 -1.005 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 178.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.468 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 33.4 mmtp -76.35 -42.82 43.48 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.719 -176.09 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 19.8 p -84.21 -38.3 20.76 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-O 120.901 0.381 . . . . 0.0 110.749 -177.261 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.12 3.44 27.88 Favored Glycine 0 N--CA 1.445 -0.747 0 C-N-CA 120.819 -0.705 . . . . 0.0 113.107 179.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.645 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 73.5 mmtt -81.55 -3.9 54.52 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 116.981 0.391 . . . . 0.0 111.008 179.494 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 65.34 24.98 12.11 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.962 179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.496 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.3 p -71.7 -47.63 52.75 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 176.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.489 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 82.5 p 51.94 28.92 5.56 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 115.135 -0.939 . . . . 0.0 113.472 175.511 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 164.09 140.77 2.95 Favored Glycine 0 N--CA 1.436 -1.325 0 N-CA-C 111.306 -0.718 . . . . 0.0 111.306 -179.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -56.36 -37.31 97.24 Favored 'Trans proline' 0 C--N 1.344 0.302 0 C-N-CA 122.976 2.451 . . . . 0.0 113.532 -177.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -67.4 -40.88 85.66 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 120.848 0.356 . . . . 0.0 111.019 -179.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 40.7 m -94.37 15.34 17.86 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.601 179.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.496 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 24.5 t -85.4 135.07 34.03 Favored 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.15 -179.082 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -113.15 -6.28 13.66 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.218 -179.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.645 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 13.9 m -77.52 157.51 30.36 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.836 -178.185 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -86.05 -108.99 0.76 Allowed Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.377 -179.024 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.2 m -135.16 -2.39 2.54 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 120.543 0.211 . . . . 0.0 111.414 -179.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 18.6 m -106.27 5.11 29.47 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.941 0.401 . . . . 0.0 111.457 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 29.9 t -82.8 167.0 18.54 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.436 -0.347 . . . . 0.0 110.333 -179.87 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.7 t -70.61 -16.33 62.83 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.798 -177.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.438 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 24.7 p -88.72 2.11 53.95 Favored 'General case' 0 C--N 1.328 -0.36 0 C-N-CA 120.366 -0.533 . . . . 0.0 111.322 179.396 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 25.2 mmtp . . . . . 0 C--O 1.261 1.704 0 CA-C-O 117.67 -1.157 . . . . 0.0 110.866 -179.107 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.942 0 N-CA-C 112.563 -0.215 . . . . 0.0 112.563 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.2 m -96.35 -3.24 44.14 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.059 0.457 . . . . 0.0 110.992 -179.112 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 115.44 119.96 3.3 Favored Glycine 0 N--CA 1.44 -1.04 0 N-CA-C 111.087 -0.805 . . . . 0.0 111.087 -178.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.9 mtmt -70.74 84.9 0.65 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.377 0.608 . . . . 0.0 111.366 -178.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -162.02 25.22 0.23 Allowed Glycine 0 N--CA 1.442 -0.908 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.367 178.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -77.32 -21.15 53.89 Favored 'General case' 0 CA--C 1.51 -0.576 0 CA-C-O 121.254 0.549 . . . . 0.0 110.013 -179.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -67.06 148.17 50.06 Favored Glycine 0 N--CA 1.432 -1.629 0 CA-C-N 115.243 -0.889 . . . . 0.0 112.037 179.136 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -66.97 -43.59 82.7 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 179.308 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 55.2 mtmt 58.81 31.02 20.82 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.197 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.571 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 91.5 m -85.65 152.87 22.76 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-O 121.371 0.605 . . . . 0.0 111.838 -179.591 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 81.3 p -92.02 176.27 6.57 Favored 'General case' 0 N--CA 1.432 -1.34 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.81 -177.379 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.9 m -67.16 -21.73 65.79 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.148 0.499 . . . . 0.0 110.079 178.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -74.0 -47.56 36.26 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.32 178.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.649 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 10.2 t -66.44 -33.56 75.97 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.382 0.611 . . . . 0.0 109.667 179.478 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 22.7 mmt180 -91.22 21.27 4.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.844 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 10.6 t -94.45 -178.55 4.61 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 178.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.435 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 7.0 pt-20 -131.09 101.93 16.18 Favored Pre-proline 0 CA--C 1.543 0.687 0 CA-C-O 120.709 0.29 . . . . 0.0 111.292 -178.448 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.435 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 87.9 Cg_endo -81.41 -174.94 14.79 Favored 'Cis proline' 0 N--CA 1.461 -0.416 0 C-N-CA 123.625 -1.406 . . . . 0.0 111.072 -0.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.731 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 48.6 t -59.49 127.9 34.35 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.038 0.447 . . . . 0.0 110.829 -179.653 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 20.2 mm-40 -112.04 17.62 19.46 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 -179.344 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.731 ' HB2' ' SG ' ' A' ' 19' ' ' CYS . 0.5 OUTLIER -64.86 -23.15 67.15 Favored 'General case' 0 C--O 1.208 -1.129 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.348 -177.341 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.71 -12.04 9.18 Favored Glycine 0 CA--C 1.528 0.883 0 C-N-CA 121.303 -0.475 . . . . 0.0 113.723 -177.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 4.4 m -68.6 -35.58 77.53 Favored 'General case' 0 CA--C 1.544 0.744 0 O-C-N 122.727 -0.278 . . . . 0.0 110.992 179.078 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 69.3 mttm -146.19 -43.28 0.2 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 122.899 0.48 . . . . 0.0 110.323 178.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.666 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 10.5 t 67.24 74.12 0.32 Allowed 'General case' 0 CA--C 1.504 -0.8 0 CA-C-N 115.121 -0.945 . . . . 0.0 109.051 -179.133 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 16.3 tt0 -104.82 10.55 34.44 Favored 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 114.572 -1.195 . . . . 0.0 110.84 -175.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.552 ' HB2' ' SG ' ' A' ' 10' ' ' CYS . 21.0 p -75.75 -178.71 4.36 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.155 0.502 . . . . 0.0 111.072 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.92 -141.36 10.57 Favored Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 115.789 -0.642 . . . . 0.0 111.915 177.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.461 ' HA ' ' HE2' ' A' ' 37' ' ' LYS . 8.2 mp0 -123.77 13.65 9.28 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.168 0.508 . . . . 0.0 110.734 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -84.48 -30.79 26.43 Favored Glycine 0 C--N 1.306 -1.112 0 C-N-CA 120.819 -0.705 . . . . 0.0 113.183 -177.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.795 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 20.3 p -67.96 -34.13 75.97 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -176.288 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 58.9 p 53.1 33.7 15.64 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 121.8 0.809 . . . . 0.0 109.994 -173.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.795 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 0.5 OUTLIER -62.56 117.04 5.68 Favored 'General case' 0 C--O 1.222 -0.365 0 CA-C-N 114.276 -1.329 . . . . 0.0 110.37 -178.655 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -86.11 20.25 2.37 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.385 0.612 . . . . 0.0 110.831 -177.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -109.42 -48.92 3.17 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.494 -0.775 . . . . 0.0 109.029 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.63 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 26.2 p -94.24 -41.5 9.44 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.569 177.673 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.589 ' HG3' ' SG ' ' A' ' 36' ' ' CYS . 26.3 mtpp -99.26 88.86 4.03 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.837 -178.508 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 12.3 t -144.83 172.2 13.35 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.738 179.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.481 ' HA ' ' O ' ' A' ' 66' ' ' CYS . 35.8 t -92.17 133.9 35.36 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 179.711 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -83.9 -17.7 39.89 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.155 0.502 . . . . 0.0 110.224 -177.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.431 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 37.4 m -69.57 136.34 51.17 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.001 -176.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 82.3 p -99.64 166.26 11.21 Favored 'General case' 0 N--CA 1.439 -0.998 0 N-CA-C 109.171 -0.678 . . . . 0.0 109.171 178.106 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.484 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 46.9 m -64.03 -26.79 68.72 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-O 120.922 0.392 . . . . 0.0 111.8 -178.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -88.47 -30.7 19.2 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.717 -179.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -143.34 119.29 1.32 Allowed Glycine 0 N--CA 1.445 -0.753 0 C-N-CA 119.784 -1.198 . . . . 0.0 113.697 -175.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.412 ' HA ' ' HB3' ' A' ' 41' ' ' CYS . 17.5 t -78.07 126.99 31.62 Favored 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 177.419 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.431 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 3.2 mmmp? -82.05 -36.57 27.56 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 111.997 0.369 . . . . 0.0 111.997 -176.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.508 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 21.5 p -91.95 -37.93 12.56 Favored 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 120.494 -0.482 . . . . 0.0 110.897 -177.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 113.2 11.36 13.74 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 120.739 -0.743 . . . . 0.0 113.816 178.505 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.755 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 32.4 mmtp -88.23 -3.2 58.9 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 117.331 0.565 . . . . 0.0 110.985 179.658 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 65.61 17.49 10.92 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.644 -0.707 . . . . 0.0 111.139 -177.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.56 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.2 p -64.57 -47.29 79.26 Favored 'General case' 0 N--CA 1.445 -0.698 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 177.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.484 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 53.2 p 49.88 44.54 25.23 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.189 -0.914 . . . . 0.0 113.063 174.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.435 ' O ' ' HB2' ' A' ' 58' ' ' CYS . . . 135.1 150.28 6.02 Favored Glycine 0 N--CA 1.438 -1.206 0 C-N-CA 120.624 -0.798 . . . . 0.0 111.587 179.738 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_endo -61.81 -22.53 74.56 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.845 2.363 . . . . 0.0 112.559 -177.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -63.12 -52.56 62.07 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.645 179.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.1 m -104.12 20.73 17.74 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.788 -177.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.56 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 48.8 t -86.91 137.58 32.26 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-O 121.213 0.53 . . . . 0.0 111.229 -178.499 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 85.1 mttt -118.67 3.26 11.71 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.569 -179.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.755 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 5.5 m -91.15 117.43 29.61 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 -179.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -97.56 82.4 0.69 Allowed Glycine 0 C--N 1.303 -1.257 0 CA-C-N 115.517 -0.765 . . . . 0.0 112.578 -175.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.448 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 50.8 m 63.77 170.28 0.16 Allowed 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.016 0.526 . . . . 0.0 111.386 -178.429 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.4 m 70.87 -25.16 0.17 Allowed 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 176.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 38.0 t -72.05 167.73 19.58 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 121.919 -0.488 . . . . 0.0 111.288 -176.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 32.3 t -62.59 -27.44 69.2 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.592 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.481 ' O ' ' HA ' ' A' ' 39' ' ' CYS . 32.1 p -85.87 8.44 20.16 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.018 179.56 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.448 ' HD2' ' H ' ' A' ' 62' ' ' SER . 1.0 OUTLIER . . . . . 0 C--O 1.262 1.727 0 CA-C-O 118.037 -0.982 . . . . 0.0 111.064 -178.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.188 0 N-CA-C 112.317 -0.313 . . . . 0.0 112.317 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.9 m -135.83 115.15 12.54 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 120.759 0.314 . . . . 0.0 110.682 -179.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -105.17 -76.73 1.08 Allowed Glycine 0 N--CA 1.443 -0.847 0 N-CA-C 110.955 -0.858 . . . . 0.0 110.955 177.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -162.15 154.46 19.38 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.843 -0.428 . . . . 0.0 109.843 177.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -145.92 167.69 27.69 Favored Glycine 0 N--CA 1.441 -1.023 0 C-N-CA 120.559 -0.829 . . . . 0.0 111.816 -179.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp -125.87 178.87 5.47 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -104.4 -175.91 25.16 Favored Glycine 0 N--CA 1.44 -1.052 0 C-N-CA 120.58 -0.819 . . . . 0.0 111.4 178.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -83.41 117.52 23.1 Favored 'General case' 0 C--N 1.314 -0.953 0 CA-C-O 121.095 0.474 . . . . 0.0 110.471 179.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -73.93 -13.64 60.92 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.246 -177.434 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.594 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 57.4 m -88.49 145.04 25.98 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-O 121.298 0.57 . . . . 0.0 112.27 -176.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 37.3 p -77.16 176.05 9.09 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 114.936 -1.029 . . . . 0.0 110.775 -178.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.8 m -62.45 -32.8 73.73 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.135 178.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.9 -52.22 64.97 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.271 179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.669 ' HA ' ' SG ' ' A' ' 19' ' ' CYS . 43.5 t -67.15 -28.67 68.31 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 121.571 0.7 . . . . 0.0 110.81 -179.366 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 15.1 ttm180 -79.66 -5.13 54.49 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.371 -177.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.9 m -85.44 167.48 15.46 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.086 0.47 . . . . 0.0 111.924 -177.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.441 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 76.6 mm-40 -127.59 108.72 20.78 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.683 177.442 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.441 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 73.2 Cg_endo -76.15 169.67 73.86 Favored 'Cis proline' 0 C--O 1.237 0.458 0 C-N-CA 123.457 -1.476 . . . . 0.0 112.157 0.055 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.669 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 41.7 t -61.03 140.36 57.86 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.004 179.78 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 76.3 mm-40 -117.28 19.81 13.95 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.296 -177.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.614 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 0.1 OUTLIER -67.46 -31.25 71.29 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.981 0.419 . . . . 0.0 109.922 179.899 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 72.58 -168.03 53.18 Favored Glycine 0 N--CA 1.442 -0.924 0 CA-C-N 115.709 -0.678 . . . . 0.0 112.633 178.828 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 11.8 p -80.22 -11.98 59.68 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-O 120.825 0.345 . . . . 0.0 110.675 178.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt -77.51 -42.08 36.92 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 178.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 8.7 t 65.53 99.22 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 114.516 -1.22 . . . . 0.0 111.296 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -100.83 -0.8 36.32 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.375 -0.829 . . . . 0.0 112.513 -176.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.594 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 7.3 p -91.94 164.13 13.76 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 120.837 0.351 . . . . 0.0 111.677 -176.408 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -86.21 148.33 22.17 Favored Glycine 0 N--CA 1.441 -1.014 0 N-CA-C 109.101 -1.6 . . . . 0.0 109.101 172.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -77.72 89.57 3.99 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 117.769 0.785 . . . . 0.0 112.163 -174.035 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -158.17 25.25 0.4 Allowed Glycine 0 N--CA 1.435 -1.383 0 N-CA-C 110.022 -1.231 . . . . 0.0 110.022 176.317 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.606 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 26.2 p -115.12 -28.73 6.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.143 -0.528 . . . . 0.0 112.121 -175.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 57.4 p 54.27 29.07 10.07 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.4 0.619 . . . . 0.0 110.015 -171.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.606 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 2.1 t -57.64 140.25 51.62 Favored 'General case' 0 C--N 1.346 0.453 0 CA-C-N 114.744 -1.116 . . . . 0.0 110.273 -177.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -93.8 16.8 13.24 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 120.922 0.391 . . . . 0.0 111.171 -176.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -116.53 -57.02 2.23 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.561 -177.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.614 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 6.1 p -89.41 -43.15 11.08 Favored 'General case' 0 C--N 1.308 -1.212 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.717 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 83.7 tttt -84.39 74.21 10.39 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-O 121.683 0.754 . . . . 0.0 109.825 178.097 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.9 t -125.77 149.74 48.32 Favored 'General case' 0 N--CA 1.431 -1.412 0 CA-C-N 115.165 -0.925 . . . . 0.0 109.988 -179.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 53.1 t -100.58 128.99 46.46 Favored 'General case' 0 N--CA 1.442 -0.869 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 177.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 29.5 m-80 -90.99 -1.52 57.81 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.487 -178.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.566 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 61.6 m -75.93 136.68 40.07 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.637 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 61.0 p -102.74 165.01 11.3 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.091 -178.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.1 m -71.23 -10.35 59.61 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.182 0.515 . . . . 0.0 110.356 177.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -89.86 -32.31 16.95 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.745 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -164.71 132.82 2.79 Favored Glycine 0 N--CA 1.435 -1.399 0 C-N-CA 120.796 -0.716 . . . . 0.0 111.991 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 4.7 t -72.73 136.37 45.51 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.36 -0.608 . . . . 0.0 109.36 179.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.44 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 75.8 mmtt -95.97 -22.35 17.45 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 111.938 0.348 . . . . 0.0 111.938 -176.13 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.479 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 21.8 p -99.69 -39.97 8.0 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 120.486 -0.486 . . . . 0.0 110.499 179.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 112.65 3.62 25.24 Favored Glycine 0 N--CA 1.437 -1.258 0 C-N-CA 120.704 -0.76 . . . . 0.0 112.948 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.479 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 46.3 mmtm -81.37 -6.04 58.5 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-O 120.964 0.411 . . . . 0.0 110.251 178.318 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 68.94 20.91 7.71 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.265 -0.88 . . . . 0.0 110.664 179.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.525 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 4.7 p -71.2 -41.57 70.11 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.418 178.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 40.1 p 52.93 29.48 7.89 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.857 0.863 . . . . 0.0 113.297 177.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 149.32 159.18 8.46 Favored Glycine 0 N--CA 1.44 -1.1 0 C-N-CA 119.887 -1.149 . . . . 0.0 112.838 178.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.429 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 58.0 Cg_endo -69.64 -11.95 32.09 Favored 'Trans proline' 0 C--N 1.345 0.343 0 C-N-CA 123.113 2.542 . . . . 0.0 112.779 -178.229 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -84.08 -10.07 58.11 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.029 0.442 . . . . 0.0 110.835 -178.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.8 m -142.58 26.36 1.77 Allowed 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.146 0.498 . . . . 0.0 110.112 179.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.525 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 0.5 OUTLIER -71.11 122.76 20.69 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.998 -177.919 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -100.05 4.28 44.59 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.727 -0.67 . . . . 0.0 109.936 -178.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.445 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 1.2 p -137.91 157.45 46.38 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.05 -174.353 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -150.15 171.89 30.05 Favored Glycine 0 N--CA 1.439 -1.101 0 C-N-CA 120.022 -1.085 . . . . 0.0 113.563 -178.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 50.5 m 63.53 -84.79 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 C-N-CA 124.489 1.116 . . . . 0.0 113.855 177.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.2 m -117.4 66.33 0.73 Allowed 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 112.737 0.643 . . . . 0.0 112.737 -174.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 41.3 t -112.84 166.61 11.22 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 173.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.447 ' HB2' ' HA ' ' A' ' 48' ' ' CYS . 7.4 m -64.61 -9.39 19.05 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 122.719 0.407 . . . . 0.0 112.028 -177.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.566 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 25.0 p -104.62 -11.02 17.15 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.722 0.296 . . . . 0.0 111.227 177.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.415 ' NZ ' ' SG ' ' A' ' 66' ' ' CYS . 3.5 mmpp? . . . . . 0 C--O 1.251 1.164 0 CA-C-O 117.317 -1.325 . . . . 0.0 110.156 -178.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.393 0 N-CA-C 112.329 -0.309 . . . . 0.0 112.329 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.8 t -114.56 -0.13 13.79 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.946 0.403 . . . . 0.0 110.658 -179.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 124.73 138.6 5.09 Favored Glycine 0 N--CA 1.448 -0.515 0 C-N-CA 120.676 -0.773 . . . . 0.0 111.946 -179.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.458 ' HE2' ' O ' ' A' ' 30' ' ' GLY . 14.3 mptt -98.92 140.41 33.12 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.014 0.435 . . . . 0.0 111.457 -179.323 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -91.2 -26.38 21.52 Favored Glycine 0 N--CA 1.44 -1.05 0 N-CA-C 109.898 -1.281 . . . . 0.0 109.898 174.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -79.32 130.05 35.06 Favored 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 115.049 -0.576 . . . . 0.0 110.334 177.771 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -82.0 86.33 1.43 Allowed Glycine 0 N--CA 1.433 -1.5 0 C-N-CA 120.714 -0.755 . . . . 0.0 111.454 178.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 63.3 mm-40 -65.38 -88.53 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.73 0.3 . . . . 0.0 111.0 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 42.7 mtmt -153.51 50.53 0.7 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.251 0.548 . . . . 0.0 110.202 179.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.477 ' HA ' ' CB ' ' A' ' 27' ' ' CYS . 85.6 m -98.68 130.91 45.19 Favored 'General case' 0 C--N 1.301 -1.503 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.003 178.065 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.6 p -76.35 178.09 6.79 Favored 'General case' 0 N--CA 1.446 -0.673 0 CA-C-O 121.085 0.469 . . . . 0.0 111.871 -176.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.517 ' HA ' ' HG2' ' A' ' 15' ' ' ARG . 16.6 m -57.37 -33.23 67.58 Favored 'General case' 0 N--CA 1.445 -0.7 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.143 -179.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.5 -44.86 81.44 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.331 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.405 ' HB3' ' HB3' ' A' ' 10' ' ' CYS . 37.4 t -69.97 -34.49 73.46 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.096 0.474 . . . . 0.0 111.208 -177.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.517 ' HG2' ' HA ' ' A' ' 12' ' ' SER . 9.2 ptm85 -78.36 -6.81 56.24 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.519 -0.472 . . . . 0.0 111.475 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 67.3 m -79.5 153.43 29.58 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 179.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -126.41 119.75 23.29 Favored Pre-proline 0 C--N 1.312 -1.028 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.295 179.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -69.61 160.89 86.83 Favored 'Cis proline' 0 C--O 1.243 0.748 0 C-N-CA 123.438 -1.484 . . . . 0.0 111.966 -0.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -51.82 130.78 29.77 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.935 -177.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 27.6 mm-40 -105.52 8.7 33.49 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.602 -177.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.418 ' HB3' ' CB ' ' A' ' 36' ' ' CYS . 0.1 OUTLIER -62.02 -35.89 79.91 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 120.846 0.355 . . . . 0.0 110.635 179.944 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 62.12 -135.83 45.8 Favored Glycine 0 N--CA 1.448 -0.517 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.792 178.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 50.0 m -100.18 -6.75 25.66 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 120.648 0.261 . . . . 0.0 111.061 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -79.03 -45.3 20.47 Favored 'General case' 0 CA--C 1.508 -0.65 0 N-CA-C 108.806 -0.812 . . . . 0.0 108.806 178.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER 58.47 91.96 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 114.69 -1.141 . . . . 0.0 111.643 177.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -88.74 -12.96 40.74 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 115.51 -0.768 . . . . 0.0 112.908 -175.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.477 ' CB ' ' HA ' ' A' ' 10' ' ' CYS . 30.6 p -79.07 159.67 27.44 Favored 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.513 -0.475 . . . . 0.0 111.548 -177.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -87.45 -155.4 28.28 Favored Glycine 0 N--CA 1.448 -0.527 0 CA-C-N 115.913 -0.585 . . . . 0.0 112.673 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -83.21 157.89 22.53 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 120.962 0.411 . . . . 0.0 111.15 -178.347 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.458 ' O ' ' HE2' ' A' ' 4' ' ' LYS . . . 94.38 9.58 58.96 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.386 178.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.455 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 17.1 t -97.35 -61.64 1.37 Allowed 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 120.883 -0.327 . . . . 0.0 111.805 -179.401 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 81.6 p 49.41 39.09 15.64 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.239 0.616 . . . . 0.0 111.661 -177.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.455 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -54.73 147.73 14.2 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.723 178.921 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -85.58 28.44 0.76 Allowed 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.616 0.722 . . . . 0.0 110.205 -178.374 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -140.51 -61.06 0.51 Allowed 'General case' 0 N--CA 1.436 -1.168 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.457 -179.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.418 ' CB ' ' HB3' ' A' ' 21' ' ' CYS . 20.7 p -88.27 -40.41 13.66 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 112.766 0.654 . . . . 0.0 112.766 -177.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.1 ttmt -116.75 53.99 0.87 Allowed 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.281 0.562 . . . . 0.0 111.741 -172.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.473 ' O ' ' HD3' ' A' ' 67' ' ' LYS . 13.9 t -121.5 179.32 4.48 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.772 178.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 35.1 t -93.52 156.89 16.48 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.2 0.524 . . . . 0.0 111.061 -178.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 29.0 m-80 -117.33 0.18 12.16 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.481 -179.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.456 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 69.1 m -80.6 149.48 29.87 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.118 179.289 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 68.0 p -118.87 168.52 10.69 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.346 -178.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.6 m -65.81 -25.73 67.36 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.221 0.534 . . . . 0.0 110.278 178.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -72.38 -36.24 68.67 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.361 -179.739 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -166.65 135.47 3.69 Favored Glycine 0 N--CA 1.433 -1.535 0 C-N-CA 120.205 -0.997 . . . . 0.0 112.75 -178.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 5.1 t -77.6 124.64 28.19 Favored 'General case' 0 C--N 1.313 -1.02 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 177.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -84.35 -29.4 26.31 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -176.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.508 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 20.2 p -89.91 -39.88 12.74 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 120.191 -0.603 . . . . 0.0 110.273 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 109.99 0.34 30.14 Favored Glycine 0 N--CA 1.443 -0.877 0 C-N-CA 120.913 -0.66 . . . . 0.0 112.762 178.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.508 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 30.0 mmtp -81.31 -0.26 40.2 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 121.292 0.568 . . . . 0.0 110.188 179.43 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 64.41 36.57 8.86 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 114.647 -1.161 . . . . 0.0 112.131 176.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.487 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 0.8 OUTLIER -81.4 -46.61 14.38 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.088 176.271 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 48.2 p 52.94 34.65 17.28 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 177.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.484 ' O ' ' HB2' ' A' ' 58' ' ' CYS . . . 166.21 161.6 15.67 Favored Glycine 0 N--CA 1.425 -2.034 0 C-N-CA 120.339 -0.934 . . . . 0.0 111.653 178.341 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -75.55 -44.47 0.3 Allowed 'Trans proline' 0 N--CA 1.46 -0.451 0 C-N-CA 122.679 2.252 . . . . 0.0 112.683 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -77.38 -16.32 58.92 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.162 0.506 . . . . 0.0 110.553 -178.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 40.1 m -106.6 13.03 28.74 Favored 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 115.439 -0.801 . . . . 0.0 110.481 177.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.487 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 47.1 t -86.69 135.54 33.36 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.552 -179.277 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 32.0 mtmt -109.39 -7.85 15.15 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.04 -178.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 34.5 m -77.47 157.32 30.52 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.166 -177.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -90.59 -85.2 1.39 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.971 -0.633 . . . . 0.0 113.368 -178.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 54.3 p -147.42 -30.14 0.33 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 111.888 0.329 . . . . 0.0 111.888 -177.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 35.8 m -92.4 47.16 1.29 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.102 0.477 . . . . 0.0 111.637 -177.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 16.1 t -124.22 165.23 17.98 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 178.033 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 8.8 m -66.62 -19.7 65.83 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.885 -177.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.456 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 27.7 p -93.72 22.09 5.85 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.811 0.338 . . . . 0.0 111.03 -179.413 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.473 ' HD3' ' O ' ' A' ' 38' ' ' THR . 36.2 mmtm . . . . . 0 C--O 1.262 1.711 0 CA-C-O 117.285 -1.34 . . . . 0.0 110.598 -178.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.282 0 N-CA-C 112.227 -0.349 . . . . 0.0 112.227 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.2 m -66.8 -47.69 71.29 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.832 0.349 . . . . 0.0 111.05 -179.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -88.83 68.54 2.8 Favored Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.313 -179.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.589 ' HD2' ' H ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -82.44 158.11 23.39 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.674 0.273 . . . . 0.0 110.51 179.806 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -88.32 145.08 18.85 Favored Glycine 0 N--CA 1.44 -1.053 0 C-N-CA 120.662 -0.78 . . . . 0.0 111.563 179.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . 0.458 ' HB2' ' NZ ' ' A' ' 6' ' ' LYS . 8.3 mtmp? -119.16 0.44 11.23 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.124 0.487 . . . . 0.0 110.636 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -147.42 148.35 19.86 Favored Glycine 0 N--CA 1.442 -0.91 0 N-CA-C 111.352 -0.699 . . . . 0.0 111.352 179.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -112.04 -118.85 0.3 Allowed 'General case' 0 C--N 1.316 -0.867 0 CA-C-O 120.788 0.328 . . . . 0.0 111.875 -178.695 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.5 mtpp -95.02 34.73 1.34 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.817 -175.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.639 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 87.9 m -98.47 139.1 34.71 Favored 'General case' 0 C--N 1.314 -0.964 0 CA-C-O 120.985 0.421 . . . . 0.0 111.722 179.414 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 45.2 p -89.66 -178.33 5.51 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.618 -179.382 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.3 m -64.33 -28.66 69.86 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.462 -0.335 . . . . 0.0 110.804 -179.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.0 -44.86 91.38 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.882 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.557 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 48.9 t -77.21 -31.23 55.1 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.662 -179.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.658 ' HA ' ' NE ' ' A' ' 15' ' ' ARG . 1.8 mmp_? -74.25 -9.17 58.34 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 116.129 -0.487 . . . . 0.0 112.178 -179.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 52.7 m -88.23 159.28 18.2 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 177.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.434 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 43.3 mt-10 -126.54 119.13 22.98 Favored Pre-proline 0 C--N 1.309 -1.191 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 179.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.434 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 5.1 Cg_exo -77.09 -178.19 23.4 Favored 'Cis proline' 0 C--N 1.348 0.529 0 C-N-CA 123.191 -1.587 . . . . 0.0 112.126 1.518 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 8.5 m -65.57 139.62 58.46 Favored 'General case' 0 CA--C 1.503 -0.861 0 CA-C-O 121.535 0.683 . . . . 0.0 111.941 -178.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 78.2 mm-40 -114.26 15.75 18.06 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.835 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.63 ' HB3' ' HA ' ' A' ' 25' ' ' CYS . 1.9 m -63.08 -31.53 72.69 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.843 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 72.17 -148.19 42.23 Favored Glycine 0 N--CA 1.438 -1.21 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.791 177.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 14.5 m -88.42 -18.53 28.14 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-O 120.922 0.391 . . . . 0.0 110.082 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.5 mtpt -77.66 -48.19 17.39 Favored 'General case' 0 CA--C 1.499 -1.0 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.943 -179.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.63 ' HA ' ' HB3' ' A' ' 21' ' ' CYS . 1.3 t 72.42 98.17 0.07 Allowed 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 114.614 -1.175 . . . . 0.0 110.119 -176.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -80.69 -24.04 39.15 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 114.771 -1.104 . . . . 0.0 112.544 -175.563 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.639 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 18.6 p -79.28 156.23 28.17 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 119.929 -0.709 . . . . 0.0 110.477 -179.704 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -83.95 -66.77 1.47 Allowed Glycine 0 N--CA 1.433 -1.508 0 C-N-CA 120.215 -0.993 . . . . 0.0 111.442 179.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -169.88 168.16 8.87 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 -178.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 101.93 32.45 5.02 Favored Glycine 0 N--CA 1.441 -0.983 0 C-N-CA 120.579 -0.819 . . . . 0.0 113.557 177.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.412 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 30.1 p -139.72 -37.58 0.49 Allowed 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 117.323 0.561 . . . . 0.0 111.767 178.093 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 46.3 p 49.65 46.43 23.74 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-O 121.226 0.536 . . . . 0.0 111.285 -178.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 68.4 m -63.98 168.66 4.99 Favored 'General case' 0 CA--C 1.515 -0.403 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.781 -179.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.413 ' HA ' ' HB ' ' A' ' 38' ' ' THR . . . -102.82 16.81 25.49 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.177 -0.919 . . . . 0.0 109.443 177.58 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -124.85 -70.34 0.76 Allowed 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.698 -178.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.616 ' HB2' ' SG ' ' A' ' 25' ' ' CYS . 29.4 p -86.49 -38.65 17.05 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.222 0.534 . . . . 0.0 111.637 -178.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.08 41.03 1.54 Allowed 'General case' 0 CA--C 1.511 -0.523 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.514 -173.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.413 ' HB ' ' HA ' ' A' ' 34' ' ' ALA . 7.8 t -114.67 163.27 15.68 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.488 -175.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 51.3 t -109.07 140.64 42.34 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 108.422 -0.955 . . . . 0.0 108.422 176.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -98.76 3.6 47.57 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 120.704 0.288 . . . . 0.0 111.498 -177.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.541 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 85.0 m -80.02 164.25 23.58 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-O 120.928 0.394 . . . . 0.0 110.954 178.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 29.7 p -131.22 162.47 29.9 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.516 -179.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.9 m -69.37 -22.18 63.75 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 120.948 0.404 . . . . 0.0 110.922 -179.823 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -86.63 -2.24 58.34 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.388 179.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 169.65 128.52 1.02 Allowed Glycine 0 N--CA 1.44 -1.08 0 C-N-CA 120.301 -0.952 . . . . 0.0 112.529 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 7.8 t -78.59 128.08 33.02 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.541 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 32.1 mmmt -87.82 -30.5 20.17 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 -175.117 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.449 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 19.6 p -88.79 -36.79 15.88 Favored 'General case' 0 C--N 1.321 -0.671 0 C-N-CA 120.35 -0.54 . . . . 0.0 110.285 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 110.66 -0.51 29.06 Favored Glycine 0 N--CA 1.442 -0.923 0 C-N-CA 120.833 -0.699 . . . . 0.0 113.056 178.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.449 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 72.2 mmtt -80.24 -2.05 43.32 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 117.065 0.432 . . . . 0.0 110.907 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.2 tt0 67.88 21.93 8.85 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.131 177.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.518 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 3.0 p -72.54 -44.88 61.54 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.18 178.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 67.2 p 53.49 26.51 5.6 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.988 0.915 . . . . 0.0 113.114 176.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.46 ' O ' ' HB2' ' A' ' 58' ' ' CYS . . . 158.09 160.59 10.35 Favored Glycine 0 N--CA 1.439 -1.149 0 C-N-CA 120.76 -0.734 . . . . 0.0 111.335 -179.527 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.406 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 45.9 Cg_endo -69.04 -12.27 33.84 Favored 'Trans proline' 0 C--O 1.234 0.278 0 C-N-CA 122.667 2.245 . . . . 0.0 113.533 -177.402 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -79.41 -50.73 10.36 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.864 0.364 . . . . 0.0 111.084 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 24.1 t -90.78 7.75 38.17 Favored 'General case' 0 C--N 1.315 -0.894 0 CA-C-O 120.953 0.406 . . . . 0.0 110.1 179.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.518 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 4.5 t -70.13 109.49 4.63 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.82 179.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -110.28 1.42 18.56 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.452 -177.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.2 p -98.08 152.06 19.72 Favored 'General case' 0 C--N 1.316 -0.87 0 C-N-CA 120.83 -0.348 . . . . 0.0 110.663 178.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.45 ' O ' ' HG3' ' A' ' 67' ' ' LYS . . . -67.31 -177.6 10.12 Favored Glycine 0 CA--C 1.523 0.554 0 CA-C-N 116.082 -0.508 . . . . 0.0 114.239 -175.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 20.1 m -82.14 6.22 17.18 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 123.074 0.55 . . . . 0.0 111.76 -177.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.9 m -107.52 11.3 28.88 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.961 0.41 . . . . 0.0 110.34 178.645 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . 0.486 ' SG ' ' N ' ' A' ' 65' ' ' SER . 53.4 t -84.38 173.93 10.51 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.954 -179.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.486 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 8.9 m -64.82 -31.85 73.27 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.426 -179.163 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.548 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 26.0 p -81.6 10.63 5.67 Favored 'General case' 0 C--N 1.334 -0.103 0 CA-C-O 120.843 0.354 . . . . 0.0 111.233 -179.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.548 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 15.0 mmtp . . . . . 0 C--O 1.266 1.934 0 CA-C-O 117.88 -1.057 . . . . 0.0 110.828 -177.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.446 0 N-CA-C 112.267 -0.333 . . . . 0.0 112.267 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.0 m -139.62 115.29 10.06 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.613 0.244 . . . . 0.0 110.35 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -163.9 38.07 0.31 Allowed Glycine 0 N--CA 1.446 -0.692 0 C-N-CA 120.584 -0.817 . . . . 0.0 112.446 179.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.593 ' H ' ' HD3' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -70.77 141.25 51.44 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 110.145 -0.317 . . . . 0.0 110.145 179.389 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -145.11 13.29 1.88 Allowed Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 119.946 -1.121 . . . . 0.0 113.285 -177.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -78.42 135.81 37.5 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-O 120.721 0.296 . . . . 0.0 110.4 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -128.74 134.35 8.01 Favored Glycine 0 N--CA 1.439 -1.117 0 C-N-CA 120.789 -0.719 . . . . 0.0 111.613 178.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.419 ' CD ' HH22 ' A' ' 15' ' ' ARG . 26.2 mt-10 -66.54 -33.32 75.41 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 122.354 0.262 . . . . 0.0 110.855 -179.02 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.469 ' HB2' ' HA3' ' A' ' 28' ' ' GLY . 31.5 mmmt 66.69 14.35 9.73 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 115.938 -0.573 . . . . 0.0 111.759 179.283 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.604 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 91.5 m -77.08 130.93 38.05 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-O 121.288 0.566 . . . . 0.0 112.16 -178.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 35.8 p -87.19 177.57 7.14 Favored 'General case' 0 N--CA 1.431 -1.393 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.253 -179.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.5 m -58.98 -27.02 64.99 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.753 -179.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.34 -45.0 77.68 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-O 120.856 0.36 . . . . 0.0 110.814 178.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.644 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 5.4 t -78.07 -26.0 47.97 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.065 0.46 . . . . 0.0 110.534 -178.84 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.419 HH22 ' CD ' ' A' ' 8' ' ' GLU . 32.7 mmt180 -74.66 -17.88 60.62 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.052 179.076 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 36.3 t -62.6 159.64 15.57 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.61 -179.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.456 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 37.5 mt-10 -132.32 107.07 13.38 Favored Pre-proline 0 C--N 1.308 -1.2 0 CA-C-N 115.913 -0.585 . . . . 0.0 109.887 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.456 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 73.1 Cg_endo -74.18 170.96 69.41 Favored 'Cis proline' 0 C--O 1.243 0.732 0 C-N-CA 123.517 -1.451 . . . . 0.0 112.476 0.106 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.632 ' SG ' ' HB2' ' A' ' 21' ' ' CYS . 21.5 t -55.98 143.67 31.36 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.867 -178.688 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 28.0 mm-40 -120.79 15.24 11.77 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.468 179.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.644 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 0.5 OUTLIER -70.8 -4.01 21.81 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.054 0.454 . . . . 0.0 110.94 179.535 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.77 -15.37 73.6 Favored Glycine 0 CA--C 1.521 0.454 0 C-N-CA 121.158 -0.544 . . . . 0.0 112.583 178.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 33.3 t -73.18 -47.51 43.12 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 122.649 -0.324 . . . . 0.0 110.76 179.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -140.91 -43.57 0.39 Allowed 'General case' 0 C--O 1.237 0.43 0 CA-C-N 116.66 -0.245 . . . . 0.0 111.247 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 16.0 t 74.02 100.84 0.07 Allowed 'General case' 0 N--CA 1.466 0.371 0 O-C-N 123.99 0.806 . . . . 0.0 110.988 -179.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -125.52 13.14 8.12 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 115.705 -0.679 . . . . 0.0 110.894 -177.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.604 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 15.1 p -84.11 -175.53 5.84 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-O 121.254 0.549 . . . . 0.0 110.858 -178.204 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.469 ' HA3' ' HB2' ' A' ' 9' ' ' LYS . . . -88.59 130.92 10.39 Favored Glycine 0 N--CA 1.425 -2.085 0 N-CA-C 109.431 -1.468 . . . . 0.0 109.431 173.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.0 18.82 0.08 Allowed 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 112.85 0.685 . . . . 0.0 112.85 -176.249 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.442 ' H ' ' C ' ' A' ' 28' ' ' GLY . . . -110.63 11.13 30.33 Favored Glycine 0 N--CA 1.436 -1.356 0 N-CA-C 111.151 -0.78 . . . . 0.0 111.151 177.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.839 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 15.4 p -80.49 -15.44 56.72 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 120.644 0.259 . . . . 0.0 110.415 179.552 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 82.8 p 57.34 26.53 12.54 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 123.868 0.867 . . . . 0.0 111.627 -177.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.839 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 6.6 t -62.86 127.9 33.38 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.04 -0.527 . . . . 0.0 109.822 179.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -92.15 32.18 1.19 Allowed 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.393 -177.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -128.65 -50.71 1.26 Allowed 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.174 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.496 ' CB ' ' HB3' ' A' ' 21' ' ' CYS . 25.3 p -98.09 -39.56 8.85 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 116.343 -0.389 . . . . 0.0 111.112 179.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -84.55 115.57 22.67 Favored 'General case' 0 N--CA 1.442 -0.828 0 CA-C-O 121.107 0.479 . . . . 0.0 110.891 -179.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 15.0 t -177.76 -178.34 0.71 Allowed 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 178.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 54.1 t -98.23 135.05 40.42 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 109.524 -0.546 . . . . 0.0 109.524 177.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 27.4 m-80 -86.71 -6.01 58.96 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.208 -178.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.434 ' HA ' ' HG2' ' A' ' 47' ' ' LYS . 59.9 m -80.63 135.18 36.0 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.769 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 71.5 p -105.87 172.68 6.67 Favored 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.618 -179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 34.0 p -75.12 -10.0 59.07 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.167 0.508 . . . . 0.0 110.197 178.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -76.36 -40.99 49.68 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.971 177.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -169.01 136.96 4.3 Favored Glycine 0 N--CA 1.431 -1.659 0 C-N-CA 120.887 -0.673 . . . . 0.0 111.824 -179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 17.8 t -69.32 128.18 35.68 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.434 ' HG2' ' HA ' ' A' ' 41' ' ' CYS . 10.8 mmpt? -82.23 -40.03 22.21 Favored 'General case' 0 C--N 1.317 -0.821 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 -177.345 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.514 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 19.2 p -86.99 -36.5 18.21 Favored 'General case' 0 C--N 1.318 -0.804 0 C-N-CA 120.696 -0.402 . . . . 0.0 110.908 -177.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 106.72 15.16 17.57 Favored Glycine 0 N--CA 1.445 -0.743 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.185 178.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.514 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 74.4 mmtt -94.75 1.59 55.47 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.954 0.407 . . . . 0.0 110.54 178.294 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 62.4 33.38 16.33 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.09 178.757 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.586 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.4 p -82.6 -47.35 12.19 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.985 177.407 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.3 p 52.69 37.74 24.39 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.942 0.897 . . . . 0.0 113.131 176.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 141.56 157.31 7.12 Favored Glycine 0 N--CA 1.437 -1.284 0 C-N-CA 120.161 -1.019 . . . . 0.0 112.302 178.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_endo -61.24 -27.07 83.02 Favored 'Trans proline' 0 C--N 1.346 0.447 0 C-N-CA 122.874 2.383 . . . . 0.0 112.709 -178.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -62.19 -54.58 38.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.84 0.352 . . . . 0.0 111.219 -179.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.7 m -99.69 20.12 14.65 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.291 -178.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.586 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 4.5 t -74.32 105.55 5.54 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-O 121.059 0.457 . . . . 0.0 110.514 -179.169 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 32.0 mmtp -83.33 -22.05 33.0 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.92 -177.679 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.2 p -93.02 133.38 36.22 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 120.678 -0.409 . . . . 0.0 109.987 179.182 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -120.71 114.97 2.77 Favored Glycine 0 N--CA 1.439 -1.143 0 C-N-CA 120.602 -0.808 . . . . 0.0 112.126 -175.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.437 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 63.7 m 64.13 163.89 0.13 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 122.941 0.497 . . . . 0.0 112.163 -179.57 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 14.5 m 66.88 -24.37 0.11 Allowed 'General case' 0 CA--C 1.55 0.977 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 174.469 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 37.9 t -73.41 163.72 27.66 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 118.273 0.488 . . . . 0.0 111.414 -177.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 3.0 p -66.21 -26.7 67.51 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 116.03 -0.532 . . . . 0.0 112.048 -178.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.43 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 30.4 p -81.08 0.39 36.24 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 120.533 -0.467 . . . . 0.0 110.71 178.808 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.437 ' HD2' ' H ' ' A' ' 62' ' ' SER . 5.2 mmpp? . . . . . 0 C--O 1.262 1.743 0 CA-C-O 118.249 -0.882 . . . . 0.0 110.494 -179.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.223 0 N-CA-C 112.385 -0.286 . . . . 0.0 112.385 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.0 m -74.96 113.82 12.72 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.665 0.269 . . . . 0.0 110.368 179.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 79.54 73.54 1.13 Allowed Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.751 -0.737 . . . . 0.0 112.867 178.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -101.52 -178.24 3.67 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-O 120.818 0.342 . . . . 0.0 110.669 178.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 132.65 -29.39 3.27 Favored Glycine 0 N--CA 1.439 -1.113 0 C-N-CA 120.67 -0.776 . . . . 0.0 111.643 -178.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -115.71 107.15 14.72 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.922 0.391 . . . . 0.0 111.049 179.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -122.77 -8.25 6.91 Favored Glycine 0 CA--C 1.499 -0.934 0 C-N-CA 120.613 -0.803 . . . . 0.0 112.109 178.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.5 mp0 -117.17 147.23 42.64 Favored 'General case' 0 N--CA 1.434 -1.261 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 179.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 50.3 mtpt -100.14 29.88 4.07 Favored 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.49 178.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.567 ' SG ' ' HB3' ' A' ' 31' ' ' CYS . 67.8 m -122.07 160.77 24.32 Favored 'General case' 0 N--CA 1.442 -0.854 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.742 -177.064 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 20.9 p -85.63 174.06 9.69 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.222 -179.018 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 6.7 m -57.61 -36.78 72.23 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.337 -179.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -62.92 -46.06 89.58 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.416 -179.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.488 ' HB3' ' HB3' ' A' ' 10' ' ' CYS . 26.4 t -68.96 -30.29 68.7 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.101 0.477 . . . . 0.0 110.005 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 28.5 mmm180 -78.35 -2.82 40.05 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.551 178.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.8 m -84.06 165.57 18.43 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.664 0.269 . . . . 0.0 110.766 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -133.2 116.63 14.36 Favored Pre-proline 0 C--N 1.318 -0.767 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 178.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -70.81 173.29 48.99 Favored 'Cis proline' 0 C--O 1.235 0.327 0 C-N-CA 123.153 -1.603 . . . . 0.0 112.253 0.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 4.7 t -57.23 116.55 3.35 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.362 -178.306 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 34.0 mm-40 -102.39 13.56 34.26 Favored 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.001 0.429 . . . . 0.0 111.108 -176.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.684 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 4.7 t -70.4 -20.36 62.94 Favored 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.595 -179.41 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 59.02 -152.62 32.18 Favored Glycine 0 C--N 1.343 0.964 0 CA-C-N 115.284 -0.871 . . . . 0.0 113.04 177.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 67.1 m -95.69 -3.58 45.78 Favored 'General case' 0 N--CA 1.433 -1.284 0 CA-C-O 120.658 0.266 . . . . 0.0 110.464 177.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -71.6 -44.25 64.77 Favored 'General case' 0 CA--C 1.495 -1.136 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 176.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.661 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 4.8 t 55.58 92.82 0.03 OUTLIER 'General case' 0 N--CA 1.435 -1.185 0 CA-C-N 114.415 -1.266 . . . . 0.0 112.625 174.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 75.3 mt-30 -102.88 3.61 36.75 Favored 'General case' 0 C--N 1.309 -1.173 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.352 -179.492 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.493 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 29.1 p -87.89 174.92 8.05 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.697 179.292 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -98.07 -102.97 2.26 Favored Glycine 0 N--CA 1.44 -1.093 0 C-N-CA 120.607 -0.806 . . . . 0.0 111.359 178.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -139.66 161.73 36.83 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 178.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 99.89 28.05 7.57 Favored Glycine 0 N--CA 1.436 -1.344 0 C-N-CA 120.353 -0.927 . . . . 0.0 112.928 178.206 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.567 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 15.0 p -115.63 -23.89 8.53 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 117.044 0.422 . . . . 0.0 110.225 177.831 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 38.6 p 51.49 36.05 15.89 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 123.59 0.756 . . . . 0.0 112.281 -179.719 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 74.2 m -75.21 171.9 13.35 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 121.083 0.468 . . . . 0.0 110.904 179.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -135.4 9.5 3.44 Favored 'General case' 0 C--N 1.308 -1.206 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 175.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -102.32 -58.87 1.8 Allowed 'General case' 0 CA--C 1.507 -0.69 0 CA-C-N 114.801 -1.09 . . . . 0.0 109.943 -178.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.684 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 31.8 p -86.41 -47.36 9.39 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 177.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -95.38 92.07 6.53 Favored 'General case' 0 N--CA 1.424 -1.756 0 CA-C-N 114.754 -1.112 . . . . 0.0 109.549 177.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.8 t -137.36 162.18 34.28 Favored 'General case' 0 C--N 1.3 -1.586 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 179.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 13.1 t -107.31 133.28 52.09 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 120.932 0.396 . . . . 0.0 110.057 -179.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -89.95 -6.32 55.8 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.16 0.505 . . . . 0.0 110.38 -177.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 38.0 m -79.3 145.1 33.68 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.831 -0.622 . . . . 0.0 111.97 -177.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 64.9 p -115.09 170.0 8.69 Favored 'General case' 0 N--CA 1.438 -1.058 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 178.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.444 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 2.8 p -73.62 -11.01 60.29 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.06 0.457 . . . . 0.0 111.151 178.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 26.7 t70 -90.59 -33.05 16.03 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.838 179.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -158.45 127.25 1.84 Allowed Glycine 0 N--CA 1.434 -1.499 0 C-N-CA 120.348 -0.929 . . . . 0.0 112.364 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 6.7 t -76.09 134.72 39.96 Favored 'General case' 0 C--N 1.312 -1.05 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 178.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp -96.15 -16.53 21.45 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 112.742 0.645 . . . . 0.0 112.742 -175.059 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.412 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 32.1 p -103.1 -39.34 6.92 Favored 'General case' 0 C--N 1.311 -1.09 0 C-N-CA 120.432 -0.507 . . . . 0.0 110.277 178.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.36 5.34 26.48 Favored Glycine 0 N--CA 1.438 -1.176 0 C-N-CA 120.969 -0.634 . . . . 0.0 112.74 179.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.412 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 75.1 mmtt -84.74 -2.25 57.36 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 120.935 0.398 . . . . 0.0 110.455 178.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 63.68 24.11 13.77 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.052 0.941 . . . . 0.0 111.179 -179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.488 ' O ' ' HB2' ' A' ' 57' ' ' SER . 3.9 p -70.77 -43.65 68.32 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.854 -0.424 . . . . 0.0 109.854 178.397 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.444 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 64.3 p 51.26 39.9 24.93 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.808 0.843 . . . . 0.0 112.899 176.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 145.04 149.37 5.01 Favored Glycine 0 N--CA 1.439 -1.162 0 C-N-CA 120.255 -0.974 . . . . 0.0 112.071 179.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -61.98 -26.13 78.4 Favored 'Trans proline' 0 CA--C 1.532 0.395 0 C-N-CA 123.021 2.481 . . . . 0.0 112.758 -177.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -71.28 -24.04 62.08 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.398 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.488 ' HB2' ' O ' ' A' ' 52' ' ' CYS . 23.6 m -119.14 15.99 13.22 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.226 0.536 . . . . 0.0 110.04 179.322 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.432 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 13.3 t -83.44 106.07 14.9 Favored 'General case' 0 N--CA 1.437 -1.103 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.734 -176.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 53.9 mtpt -95.8 -13.32 24.16 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.28 -0.873 . . . . 0.0 111.224 -177.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 1.2 p -89.58 148.93 23.08 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.915 -179.219 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -79.52 -167.08 33.65 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.934 -0.651 . . . . 0.0 113.837 -175.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.462 ' HA ' ' HG3' ' A' ' 67' ' ' LYS . 16.1 m -73.31 -13.45 61.12 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 123.299 0.64 . . . . 0.0 111.792 -177.567 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 45.4 m -86.62 18.37 3.4 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 120.777 0.323 . . . . 0.0 111.158 179.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 13.0 t -100.06 172.19 7.35 Favored 'General case' 0 N--CA 1.44 -0.943 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 178.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 25.2 m -81.43 -11.04 59.38 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 -176.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.422 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 25.9 p -93.29 15.97 14.32 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 120.835 0.35 . . . . 0.0 110.789 179.373 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.462 ' HG3' ' HA ' ' A' ' 62' ' ' SER . 9.0 mmtp . . . . . 0 C--O 1.263 1.782 0 CA-C-O 118.006 -0.997 . . . . 0.0 111.117 -177.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.305 0 N-CA-C 112.357 -0.297 . . . . 0.0 112.357 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 21.6 m -81.15 -2.2 47.55 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 120.957 0.408 . . . . 0.0 111.315 -179.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -71.11 -30.72 67.22 Favored Glycine 0 N--CA 1.445 -0.741 0 C-N-CA 120.917 -0.659 . . . . 0.0 112.25 179.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 50.6 tptt 63.69 25.65 14.29 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-O 121.741 0.781 . . . . 0.0 110.461 179.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 145.18 -51.88 0.6 Allowed Glycine 0 N--CA 1.438 -1.172 0 N-CA-C 110.856 -0.897 . . . . 0.0 110.856 -179.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 65.9 mttp -119.19 114.31 22.24 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 120.664 0.269 . . . . 0.0 110.672 178.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -82.46 145.8 24.31 Favored Glycine 0 N--CA 1.441 -1.005 0 N-CA-C 111.017 -0.833 . . . . 0.0 111.017 178.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 64.02 99.9 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.137 0.494 . . . . 0.0 110.634 -178.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 73.3 mmtt -76.38 -2.3 31.19 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.423 -178.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.544 ' HB3' ' HB3' ' A' ' 14' ' ' CYS . 57.3 m -79.58 148.74 31.62 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.336 178.857 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 5.1 t -85.5 171.3 11.87 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.058 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.6 m -53.54 -32.08 49.12 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 123.205 0.602 . . . . 0.0 111.194 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -61.8 -45.35 94.24 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.429 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.712 ' HB2' ' SG ' ' A' ' 21' ' ' CYS . 29.4 t -75.23 -24.81 57.75 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.446 0.641 . . . . 0.0 110.256 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 77.5 mtp180 -84.62 4.99 29.76 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.72 -178.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 50.8 m -106.73 162.75 13.5 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.685 0.278 . . . . 0.0 110.725 179.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -126.87 117.98 22.34 Favored Pre-proline 0 C--N 1.326 -0.423 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.184 178.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -74.1 178.06 35.24 Favored 'Cis proline' 0 C--O 1.239 0.553 0 C-N-CA 123.144 -1.607 . . . . 0.0 112.155 0.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.443 ' SG ' ' HA ' ' A' ' 14' ' ' CYS . 21.1 t -69.9 136.53 50.74 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.76 -176.996 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -112.36 6.91 19.01 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.49 -177.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.712 ' SG ' ' HB2' ' A' ' 14' ' ' CYS . 4.8 m -75.11 -11.2 60.04 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.661 0.267 . . . . 0.0 111.636 179.928 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.81 69.11 2.69 Favored Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.875 -0.679 . . . . 0.0 111.979 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 22.3 t -174.3 -61.72 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 179.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.6 mttp -115.13 -46.45 2.9 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.872 -0.603 . . . . 0.0 109.666 177.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 21' ' ' CYS . 38.3 t 60.96 100.41 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.163 -0.926 . . . . 0.0 112.466 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -100.56 23.78 9.89 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.212 178.824 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 1.5 m -63.27 148.29 48.64 Favored 'General case' 0 CA--C 1.51 -0.561 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.94 178.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.27 163.09 37.23 Favored Glycine 0 N--CA 1.433 -1.549 0 N-CA-C 109.759 -1.336 . . . . 0.0 109.759 172.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 -70.97 114.36 8.94 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 117.247 0.523 . . . . 0.0 110.09 -177.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 132.92 24.54 0.72 Allowed Glycine 0 N--CA 1.436 -1.321 0 CA-C-N 115.703 -0.68 . . . . 0.0 112.269 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.413 ' SG ' ' HB2' ' A' ' 33' ' ' CYS . 45.9 t -91.68 146.42 23.79 Favored 'General case' 0 N--CA 1.439 -0.975 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 178.52 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.7 p -123.44 30.67 6.19 Favored 'General case' 0 C--N 1.308 -1.204 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.314 -179.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.413 ' HB2' ' SG ' ' A' ' 31' ' ' CYS . 21.0 t -68.76 163.9 23.03 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 115.674 -0.693 . . . . 0.0 110.258 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -117.17 25.27 10.59 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-O 121.022 0.439 . . . . 0.0 110.246 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -127.6 -59.42 1.21 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.439 -178.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 7.1 p -86.45 -39.58 16.19 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.007 0.432 . . . . 0.0 111.022 -179.186 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.2 tmtp? -104.21 91.68 4.03 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.025 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 14.6 t -173.96 -175.83 1.11 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.146 -0.479 . . . . 0.0 109.936 -179.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 39.2 t -113.82 137.44 51.65 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.916 0.388 . . . . 0.0 110.327 178.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 32.1 m-80 -93.97 -0.29 55.65 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.87 -178.387 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.499 ' HB3' ' HA ' ' A' ' 53' ' ' THR . 81.7 m -78.7 156.5 28.92 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.124 0.487 . . . . 0.0 111.525 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.3 p -137.81 169.55 17.59 Favored 'General case' 0 N--CA 1.444 -0.745 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.261 178.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.0 m -67.9 -18.19 64.71 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.223 0.535 . . . . 0.0 110.469 178.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -68.22 -37.27 80.68 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.489 177.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -175.0 133.24 2.4 Favored Glycine 0 N--CA 1.434 -1.474 0 C-N-CA 120.85 -0.69 . . . . 0.0 111.912 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 4.8 t -72.63 116.29 12.93 Favored 'General case' 0 N--CA 1.443 -0.794 0 N-CA-C 109.071 -0.715 . . . . 0.0 109.071 178.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 41.7 mmtm -74.43 -33.59 62.99 Favored 'General case' 0 C--N 1.314 -0.944 0 CA-C-N 115.859 -0.609 . . . . 0.0 112.583 -174.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.561 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 28.2 p -86.8 -43.82 12.21 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.054 -0.659 . . . . 0.0 110.073 179.822 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 111.81 4.8 26.07 Favored Glycine 0 N--CA 1.436 -1.309 0 CA-C-N 115.74 -0.664 . . . . 0.0 112.432 -179.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.561 ' HG2' ' SG ' ' A' ' 48' ' ' CYS . 46.1 mmtm -79.51 -5.36 54.68 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-O 121.249 0.547 . . . . 0.0 109.696 177.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 68.76 30.41 4.86 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 114.772 -1.104 . . . . 0.0 110.884 -179.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.508 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 5.3 p -80.3 -39.45 28.73 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.288 177.441 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.499 ' HA ' ' HB3' ' A' ' 41' ' ' CYS . 39.0 p 51.97 33.42 11.74 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 113.486 0.921 . . . . 0.0 113.486 177.254 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 145.77 150.45 5.21 Favored Glycine 0 N--CA 1.441 -1.033 0 C-N-CA 120.168 -1.015 . . . . 0.0 112.268 178.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_endo -55.98 -28.04 66.91 Favored 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.307 2.671 . . . . 0.0 113.407 -178.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -66.89 -34.44 77.8 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.759 0.314 . . . . 0.0 111.625 -178.701 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.471 ' HB2' ' O ' ' A' ' 52' ' ' CYS . 19.2 m -111.97 13.15 20.79 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.286 0.565 . . . . 0.0 110.264 179.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.508 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 28.0 t -78.42 119.53 21.86 Favored 'General case' 0 N--CA 1.438 -1.04 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.842 -179.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -115.77 1.11 13.38 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.584 -178.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.484 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 0.6 OUTLIER -97.2 110.01 22.65 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 176.864 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -99.11 114.66 5.09 Favored Glycine 0 CA--C 1.491 -1.422 0 C-N-CA 120.993 -0.623 . . . . 0.0 112.639 -173.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.505 ' H ' ' HD2' ' A' ' 67' ' ' LYS . 43.6 t 61.89 161.63 0.07 Allowed 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 123.065 0.546 . . . . 0.0 111.424 -179.057 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 19.1 t 73.14 -32.77 0.25 Allowed 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 175.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 33.3 t -67.98 162.75 23.71 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 119.736 -0.786 . . . . 0.0 111.801 -176.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 20.4 t -68.75 -21.75 64.35 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.832 -177.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.499 ' SG ' ' NZ ' ' A' ' 67' ' ' LYS . 29.3 p -86.24 0.31 54.06 Favored 'General case' 0 C--O 1.219 -0.52 0 C-N-CA 120.466 -0.494 . . . . 0.0 110.976 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.505 ' HD2' ' H ' ' A' ' 62' ' ' SER . 0.1 OUTLIER . . . . . 0 C--O 1.261 1.671 0 CA-C-O 117.998 -1.001 . . . . 0.0 111.051 -179.029 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.31 0 N-CA-C 112.479 -0.249 . . . . 0.0 112.479 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 65.6 p 49.24 79.09 0.08 Allowed 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 123.467 0.707 . . . . 0.0 112.004 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -101.69 163.69 17.52 Favored Glycine 0 N--CA 1.44 -1.08 0 C-N-CA 120.644 -0.789 . . . . 0.0 111.779 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.402 ' N ' ' HD2' ' A' ' 4' ' ' LYS . 0.3 OUTLIER -91.81 97.35 10.93 Favored 'General case' 0 C--N 1.316 -0.87 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 179.258 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -112.71 65.25 0.26 Allowed Glycine 0 N--CA 1.441 -1.012 0 C-N-CA 120.414 -0.898 . . . . 0.0 112.414 -178.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -93.25 163.85 13.46 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.822 0.344 . . . . 0.0 110.632 179.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . 162.77 70.0 0.02 OUTLIER Glycine 0 N--CA 1.443 -0.874 0 C-N-CA 121.028 -0.606 . . . . 0.0 111.597 179.759 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -81.77 -81.45 0.14 Allowed 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 120.973 0.416 . . . . 0.0 110.818 -178.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -131.63 29.48 4.5 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.026 -179.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.537 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 6.0 m -95.82 164.7 12.63 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-O 121.892 0.853 . . . . 0.0 112.726 -179.558 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.492 HG21 ' HB2' ' A' ' 26' ' ' GLN . 1.4 t -100.85 161.21 13.75 Favored 'General case' 0 N--CA 1.43 -1.453 0 CA-C-N 114.26 -1.336 . . . . 0.0 108.672 176.176 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 25.0 t -58.4 -30.62 66.99 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.94 0.4 . . . . 0.0 110.477 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -66.83 -35.01 79.07 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.124 179.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 10.4 t -86.44 -30.23 22.22 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.329 -176.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 42.2 ttp180 -77.38 -8.09 57.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.049 0.452 . . . . 0.0 110.281 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 18.9 t -89.26 161.84 16.19 Favored 'General case' 0 N--CA 1.435 -1.205 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 177.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.46 ' HA ' ' C ' ' A' ' 18' ' ' PRO . 45.0 mt-10 -128.53 129.14 23.56 Favored Pre-proline 0 C--N 1.307 -1.259 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 -179.161 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.46 ' C ' ' HA ' ' A' ' 17' ' ' GLU . 56.0 Cg_endo -68.5 173.16 40.85 Favored 'Cis proline' 0 C--N 1.348 0.52 0 C-N-CA 123.55 -1.438 . . . . 0.0 113.099 1.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 44.0 t -62.69 115.73 4.57 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.957 -178.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -107.2 14.43 26.19 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.079 -177.537 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.642 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 4.5 t -68.47 -20.7 64.63 Favored 'General case' 0 CA--C 1.54 0.58 0 N-CA-C 108.841 -0.8 . . . . 0.0 108.841 179.068 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 61.86 -154.04 40.33 Favored Glycine 0 C--N 1.339 0.713 0 CA-C-N 115.076 -0.965 . . . . 0.0 114.411 174.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 31.6 m -89.81 -10.22 46.26 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.343 -0.429 . . . . 0.0 110.194 179.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -76.0 -40.01 54.62 Favored 'General case' 0 N--CA 1.446 -0.64 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 177.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.632 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 10.9 t 56.33 86.61 0.06 Allowed 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.277 -0.874 . . . . 0.0 111.61 176.721 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.492 ' HB2' HG21 ' A' ' 11' ' ' THR . 11.2 mm100 -89.74 -7.04 55.39 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.489 -177.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.537 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 14.6 p -85.19 162.17 19.31 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-O 121.089 0.471 . . . . 0.0 110.676 -179.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.83 -159.59 35.5 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.698 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 10.5 mp0 -78.69 168.91 19.06 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 120.817 0.342 . . . . 0.0 110.396 179.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 87.21 -0.99 86.18 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.659 178.779 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 32.0 t -84.55 -48.56 9.43 Favored 'General case' 0 C--N 1.318 -0.789 0 O-C-N 122.768 -0.254 . . . . 0.0 111.356 -179.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 60.4 p 53.0 43.31 31.9 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.587 0.755 . . . . 0.0 112.401 -179.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -68.92 165.12 20.64 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.424 178.181 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -113.35 11.14 18.5 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 121.29 0.567 . . . . 0.0 110.051 179.141 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -117.46 -64.43 1.3 Allowed 'General case' 0 N--CA 1.447 -0.621 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.608 -179.501 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.642 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 25.5 p -74.43 -42.92 58.34 Favored 'General case' 0 N--CA 1.446 -0.654 0 CA-C-O 121.134 0.492 . . . . 0.0 109.701 178.337 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.456 ' NZ ' ' SG ' ' A' ' 27' ' ' CYS . 14.0 mptt -83.76 87.6 7.07 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.027 176.068 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.5 t -142.21 154.76 45.05 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 179.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.428 ' H ' ' HB3' ' A' ' 55' ' ' PRO . 44.2 t -89.07 136.16 33.17 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.673 -0.491 . . . . 0.0 109.673 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -92.22 -3.75 55.1 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.116 -178.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . . . . . . . . . 62.3 m -77.98 141.47 38.93 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.502 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 62.8 p -102.76 164.84 11.4 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.965 -177.182 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 7.4 m -67.93 -31.59 71.45 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.919 0.39 . . . . 0.0 110.681 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -71.67 -34.11 69.41 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.986 179.85 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -163.69 136.52 4.3 Favored Glycine 0 N--CA 1.435 -1.422 0 C-N-CA 120.284 -0.96 . . . . 0.0 112.705 -178.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 37.2 t -73.0 147.81 44.8 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 177.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.44 ' HB3' ' NZ ' ' A' ' 47' ' ' LYS . 8.3 mtpm? -112.05 -19.6 12.26 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 112.467 0.543 . . . . 0.0 112.467 -177.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.435 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 17.4 p -96.99 -37.71 10.07 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 119.993 -0.683 . . . . 0.0 110.793 -179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 117.66 0.43 17.88 Favored Glycine 0 N--CA 1.445 -0.751 0 C-N-CA 120.618 -0.801 . . . . 0.0 113.306 178.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.799 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 73.9 mmtt -84.6 -9.17 58.54 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 117.078 0.439 . . . . 0.0 110.703 179.234 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 66.4 27.94 9.81 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.16 -179.842 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.582 ' HB2' ' HA ' ' A' ' 58' ' ' CYS . 0.8 OUTLIER -71.16 -47.46 57.58 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.445 -0.798 . . . . 0.0 110.312 178.197 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 77.5 p 55.89 35.99 26.47 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.182 0.993 . . . . 0.0 113.332 176.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 150.46 149.52 5.05 Favored Glycine 0 C--O 1.218 -0.899 0 C-N-CA 120.012 -1.09 . . . . 0.0 112.252 178.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.493 ' HA ' ' HB2' ' A' ' 58' ' ' CYS . 50.5 Cg_endo -70.82 -23.24 26.21 Favored 'Trans proline' 0 C--N 1.344 0.317 0 C-N-CA 122.875 2.383 . . . . 0.0 113.068 -178.451 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -82.68 -21.21 34.99 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.212 0.53 . . . . 0.0 109.878 -178.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.8 m -121.77 22.86 10.36 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.546 179.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.582 ' HA ' ' HB2' ' A' ' 52' ' ' CYS . 8.2 t -75.34 142.29 43.21 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.116 -177.508 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 45.1 mtpt -110.7 1.38 17.87 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.496 -176.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.799 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 4.7 m -101.17 143.88 30.73 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.798 -177.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -110.03 70.84 0.21 Allowed Glycine 0 CA--C 1.507 -0.45 0 N-CA-C 111.23 -0.748 . . . . 0.0 111.23 -178.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.6 t 60.59 -179.61 0.1 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.205 0.602 . . . . 0.0 110.323 -177.037 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 15.7 m 62.92 -0.28 0.61 Allowed 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 177.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 36.2 t -93.77 162.68 13.83 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.285 178.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 51.0 m -70.1 -12.02 61.3 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -177.26 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.661 ' SG ' ' HE3' ' A' ' 67' ' ' LYS . 24.8 p -86.91 0.34 55.2 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 120.027 -0.669 . . . . 0.0 110.531 177.024 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.661 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 23.5 mmtp . . . . . 0 C--O 1.25 1.123 0 CA-C-O 117.767 -1.111 . . . . 0.0 110.532 -179.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.276 0 N-CA-C 112.254 -0.338 . . . . 0.0 112.254 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.4 m -87.86 -34.23 18.27 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.176 0.513 . . . . 0.0 110.443 179.825 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 115.82 157.29 11.21 Favored Glycine 0 N--CA 1.438 -1.207 0 N-CA-C 111.208 -0.757 . . . . 0.0 111.208 -178.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.9 pttt -154.65 18.47 0.46 Allowed 'General case' 0 C--N 1.312 -1.027 0 CA-C-O 120.959 0.409 . . . . 0.0 110.861 -178.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -167.63 -86.6 0.06 OUTLIER Glycine 0 N--CA 1.444 -0.808 0 C-N-CA 120.826 -0.702 . . . . 0.0 111.623 -179.424 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt 59.17 91.58 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.279 0.631 . . . . 0.0 112.679 178.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . -104.41 -75.41 1.03 Allowed Glycine 0 N--CA 1.444 -0.813 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 176.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 58.23 101.36 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.879 0.872 . . . . 0.0 113.23 176.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 60.8 mttm -90.57 4.07 52.29 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.992 179.206 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.566 ' HA ' ' HB2' ' A' ' 27' ' ' CYS . 60.4 m -99.97 163.65 12.35 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.371 0.605 . . . . 0.0 112.603 -176.167 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 76.8 p -100.02 175.5 5.74 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.657 -178.453 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.4 m -62.16 -31.52 72.02 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.22 179.235 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -67.0 -44.07 81.3 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-O 120.919 0.39 . . . . 0.0 110.536 179.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 41.9 t -70.89 -43.07 69.13 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.93 -178.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.437 ' O ' ' HG2' ' A' ' 15' ' ' ARG . 40.6 ttt180 -79.17 3.45 17.67 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.025 0.441 . . . . 0.0 111.307 -178.741 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 12.5 t -73.33 165.0 25.88 Favored 'General case' 0 N--CA 1.439 -1.02 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 178.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.454 ' HA ' ' HA ' ' A' ' 18' ' ' PRO . 6.5 mm-40 -119.77 105.78 42.69 Favored Pre-proline 0 C--N 1.312 -1.05 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -179.121 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PRO . . . . . 0.454 ' HA ' ' HA ' ' A' ' 17' ' ' GLU . 93.3 Cg_endo -82.45 -177.02 17.89 Favored 'Cis proline' 0 C--N 1.352 0.715 0 C-N-CA 124.026 -1.239 . . . . 0.0 111.939 -0.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 37.5 t -61.62 129.68 42.25 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 120.949 0.404 . . . . 0.0 111.179 -177.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 76.4 mm-40 -114.58 13.61 17.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.575 -178.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.629 ' HB3' ' HB3' ' A' ' 36' ' ' CYS . 1.8 t -68.68 -31.77 71.12 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 108.787 -0.82 . . . . 0.0 108.787 -179.574 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 60.3 -162.4 18.94 Favored Glycine 0 C--N 1.34 0.759 0 CA-C-N 115.091 -0.959 . . . . 0.0 114.627 175.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.0 m -76.49 -7.23 54.71 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 120.97 0.414 . . . . 0.0 110.818 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 54.4 mtpt -78.53 -45.02 22.89 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 177.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.528 ' HA ' ' SG ' ' A' ' 21' ' ' CYS . 5.0 t 59.99 95.25 0.03 OUTLIER 'General case' 0 N--CA 1.444 -0.734 0 CA-C-N 114.922 -1.035 . . . . 0.0 111.877 176.465 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -102.56 2.03 35.68 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 115.391 -0.822 . . . . 0.0 111.668 -178.255 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.566 ' HB2' ' HA ' ' A' ' 10' ' ' CYS . 14.8 p -90.49 -158.69 0.56 Allowed 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.202 0.525 . . . . 0.0 111.298 -178.318 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -140.86 157.18 25.79 Favored Glycine 0 N--CA 1.438 -1.204 0 N-CA-C 109.7 -1.36 . . . . 0.0 109.7 177.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -59.71 93.99 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.517 0.675 . . . . 0.0 112.055 -177.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -165.53 6.44 0.06 OUTLIER Glycine 0 N--CA 1.434 -1.445 0 N-CA-C 110.574 -1.011 . . . . 0.0 110.574 179.003 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.49 ' HB3' ' SG ' ' A' ' 10' ' ' CYS . 31.7 p -120.22 178.2 4.73 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.03 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.3 p -129.09 33.21 4.61 Favored 'General case' 0 C--N 1.304 -1.376 0 CA-C-O 121.306 0.574 . . . . 0.0 110.538 -178.517 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 83.4 m -63.35 146.83 52.71 Favored 'General case' 0 CA--C 1.506 -0.727 0 N-CA-C 113.542 0.941 . . . . 0.0 113.542 -177.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.549 ' C ' ' HB ' ' A' ' 38' ' ' THR . . . -114.95 21.67 14.09 Favored 'General case' 0 N--CA 1.435 -1.187 0 CA-C-N 114.069 -1.423 . . . . 0.0 107.254 173.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -113.48 -63.28 1.47 Allowed 'General case' 0 N--CA 1.448 -0.526 0 CA-C-N 114.702 -1.135 . . . . 0.0 110.476 -178.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.629 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 29.2 p -89.19 -45.66 9.39 Favored 'General case' 0 N--CA 1.443 -0.819 0 CA-C-O 121.588 0.708 . . . . 0.0 109.845 179.044 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.415 ' HG3' ' OG ' ' A' ' 62' ' ' SER . 2.0 ttpm? -95.97 44.81 1.07 Allowed 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.059 -178.255 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.549 ' HB ' ' C ' ' A' ' 34' ' ' ALA . 14.1 t -100.91 142.07 32.91 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.731 -178.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 49.5 t -80.53 137.17 36.4 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.655 178.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -106.54 7.28 30.73 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-O 120.919 0.39 . . . . 0.0 111.308 -178.372 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' CYS . . . . . 0.573 ' SG ' ' HB3' ' A' ' 66' ' ' CYS . 85.2 m -80.91 133.28 35.53 Favored 'General case' 0 N--CA 1.435 -1.188 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.181 178.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 55.8 p -88.61 156.34 19.1 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.583 -177.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.433 ' HA ' ' HB ' ' A' ' 53' ' ' THR . 14.5 m -65.18 -29.73 70.58 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.645 0.736 . . . . 0.0 109.133 176.606 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -65.24 -42.77 93.01 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.696 -1.138 . . . . 0.0 110.744 178.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -159.88 135.77 4.26 Favored Glycine 0 N--CA 1.44 -1.083 0 C-N-CA 121.048 -0.596 . . . . 0.0 111.906 -178.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 12.7 t -71.89 147.98 46.55 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 109.996 -0.372 . . . . 0.0 109.996 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -108.02 -31.74 7.84 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.585 0.587 . . . . 0.0 112.585 -177.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.462 ' SG ' ' HG2' ' A' ' 50' ' ' LYS . 20.7 p -89.75 -39.03 13.41 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.136 -0.625 . . . . 0.0 111.416 -177.61 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 118.48 -5.13 14.98 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.495 -0.859 . . . . 0.0 112.885 -179.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.675 ' HG3' ' SG ' ' A' ' 60' ' ' CYS . 74.0 mmtt -76.22 -13.42 60.17 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 120.8 0.333 . . . . 0.0 110.604 179.171 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 71.3 28.07 3.05 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.704 -179.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' CYS . . . . . 0.534 ' CB ' ' HA ' ' A' ' 58' ' ' CYS . 1.8 p -74.33 -43.88 54.8 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.268 178.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.433 ' HB ' ' HA ' ' A' ' 43' ' ' SER . 55.0 p 54.03 31.96 14.64 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.087 0.955 . . . . 0.0 113.106 177.574 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 144.01 154.77 6.22 Favored Glycine 0 N--CA 1.442 -0.922 0 C-N-CA 120.353 -0.927 . . . . 0.0 112.299 179.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -60.47 -28.46 86.76 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 123.02 2.48 . . . . 0.0 112.677 -177.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ASP . . . . . . . . . . . . . 20.5 m-20 -63.05 -29.29 70.7 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.104 -178.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 13.6 t -126.48 22.75 6.98 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.471 -178.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.534 ' HA ' ' CB ' ' A' ' 52' ' ' CYS . 17.8 t -82.71 137.0 34.57 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.078 0.466 . . . . 0.0 110.871 -178.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -117.31 10.54 13.74 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.157 -178.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.675 ' SG ' ' HG3' ' A' ' 50' ' ' LYS . 2.6 m -102.01 156.3 17.63 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.154 -176.028 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . -85.58 -115.68 0.83 Allowed Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 121.002 -0.618 . . . . 0.0 112.8 -178.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . 0.415 ' OG ' ' HG3' ' A' ' 37' ' ' LYS . 14.9 m -123.49 -13.46 7.56 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-O 120.832 0.349 . . . . 0.0 111.073 -177.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 58.3 m -107.33 24.24 13.17 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -177.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' CYS . . . . . 0.42 ' SG ' ' N ' ' A' ' 65' ' ' SER . 42.4 t -93.3 171.98 8.58 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 177.537 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.42 ' N ' ' SG ' ' A' ' 64' ' ' CYS . 19.4 m -67.33 -23.01 65.58 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -177.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.573 ' HB3' ' SG ' ' A' ' 41' ' ' CYS . 20.6 p -90.9 4.65 51.31 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 120.794 -0.362 . . . . 0.0 111.647 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.416 ' HE3' ' SG ' ' A' ' 66' ' ' CYS . 22.1 mmtp . . . . . 0 C--O 1.26 1.626 0 CA-C-O 117.574 -1.203 . . . . 0.0 110.676 -178.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_