data_1cvo_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1cvo _Structure_validation_residue.Date_analyzed 2016-10-06 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 ' 1' ' ' LEU . . . . . 0.43 ' CD2' ' CG ' ' A' ' 59' ' ' ASP . 3.2 tm? . . . . . 0 CA--C 1.54 0.588 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.487 ' HB3' ' HA ' ' A' ' 14' ' ' THR . 0.0 OUTLIER -122.99 150.01 43.56 Favored 'General case' 0 C--O 1.215 -0.757 0 CA-C-N 111.225 -2.716 . . . . 0.0 107.158 -174.683 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 t -155.56 -135.06 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 111.995 -2.366 . . . . 0.0 108.387 -160.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.436 ' CD2' ' HB3' ' A' ' 7' ' ' GLN . 0.3 OUTLIER -145.52 152.04 39.11 Favored 'General case' 0 C--N 1.379 1.858 0 O-C-N 117.992 -2.943 . . . . 0.0 110.726 -167.665 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -148.02 -56.31 0.22 Allowed 'General case' 0 C--N 1.359 1.004 0 O-C-N 117.937 -2.977 . . . . 0.0 110.248 168.061 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.602 ' O ' ' N ' ' A' ' 8' ' ' LEU . 2.4 m -67.02 -54.39 22.13 Favored 'General case' 0 CA--C 1.586 2.341 0 CA-C-O 113.696 -3.05 . . . . 0.0 109.762 -176.316 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.557 ' NE2' ' HD3' ' A' ' 38' ' ' ARG 0.516 1.6 pt20 64.06 -54.21 0.25 Allowed 'General case' 0 C--O 1.265 1.918 0 O-C-N 117.757 -3.089 . . . . 0.0 116.551 -175.914 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.602 ' N ' ' O ' ' A' ' 6' ' ' THR . 7.6 tp -52.93 126.76 43.52 Favored Pre-proline 0 CA--C 1.595 2.707 1 O-C-N 115.808 -4.308 . . . . 0.0 104.262 157.548 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.507 ' C ' ' N ' ' A' ' 11' ' ' ILE 0.353 75.6 Cg_exo -23.02 140.14 0.01 OUTLIER 'Trans proline' 0 C--N 1.273 -3.42 1 C-N-CA 129.069 6.513 . . . . 0.0 119.425 -93.627 . . . . . . . . 4 3 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.489 ' CD1' ' C ' ' A' ' 10' ' ' PHE . 0.0 OUTLIER -34.69 -18.7 0.0 OUTLIER 'General case' 0 C--N 1.365 1.281 1 O-C-N 115.668 -4.395 . . . . 0.0 112.753 -177.026 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.507 ' N ' ' C ' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -37.08 117.09 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.432 -1.369 0 CA-C-N 114.362 -1.29 . . . . 0.0 110.557 170.617 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.47 ' CD2' ' N ' ' A' ' 12' ' ' TYR . 0.8 OUTLIER -118.76 -163.01 0.93 Allowed 'General case' 0 CA--C 1.575 1.938 0 O-C-N 118.634 -2.541 . . . . 0.0 108.149 -161.139 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.65 169.35 23.5 Favored 'General case' 0 CA--C 1.586 2.346 0 CA-C-N 109.834 -3.348 . . . . 0.0 107.652 165.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.487 ' HA ' ' HB3' ' A' ' 2' ' ' LYS . 43.7 m -79.76 155.02 28.12 Favored 'General case' 0 C--O 1.248 1.02 0 CA-C-N 109.574 -3.466 . . . . 0.0 110.471 164.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 42.7 m -69.79 -173.29 0.21 Allowed Pre-proline 0 N--CA 1.425 -1.697 0 CA-C-O 122.85 1.31 . . . . 0.0 112.782 174.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.617 ' HD2' ' CB ' ' A' ' 19' ' ' LYS . 5.8 Cg_exo -116.34 -170.55 0.02 OUTLIER 'Trans proline' 0 CA--C 1.536 0.608 0 CA-C-N 111.855 -1.873 . . . . 0.0 109.064 177.097 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.432 ' N ' ' CD ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -82.84 133.93 35.12 Favored 'General case' 0 C--O 1.213 -0.858 0 CA-C-N 113.849 -1.523 . . . . 0.0 108.953 175.415 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.71 13.75 54.41 Favored Glycine 0 C--N 1.377 2.85 0 CA-C-N 111.034 -2.803 . . . . 0.0 113.372 -175.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.617 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 1.2 mmtt -136.88 74.09 1.47 Allowed 'General case' 0 N--CA 1.438 -1.045 0 CA-C-O 124.231 1.967 . . . . 0.0 110.971 -166.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.423 ' O ' HD22 ' A' ' 21' ' ' LEU . 0.1 OUTLIER -89.03 -17.98 28.26 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 114.482 -1.236 . . . . 0.0 109.343 -168.305 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.461 ' CB ' ' HB2' ' A' ' 41' ' ' ALA . 16.1 mt -105.46 -156.8 0.59 Allowed 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 127.271 2.228 . . . . 0.0 110.327 -169.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.657 ' CA ' ' HB1' ' A' ' 41' ' ' ALA . 62.8 m -161.96 132.67 5.01 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-N 113.812 -1.54 . . . . 0.0 110.808 174.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.451 ' HB3' ' HB3' ' A' ' 55' ' ' CYS 0.259 0.1 OUTLIER -128.06 -178.59 4.59 Favored 'General case' 0 CA--C 1.601 2.931 1 O-C-N 114.78 -4.95 . . . . 0.0 106.519 175.48 . . . . . . . . 5 4 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.1 pttt -165.13 154.22 12.49 Favored 'General case' 0 N--CA 1.426 -1.631 1 CA-C-N 103.954 -6.021 . . . . 0.0 105.231 173.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.486 ' HB1' ' CD2' ' A' ' 53' ' ' TYR 0.317 . . -134.35 178.53 6.91 Favored 'General case' 0 N--CA 1.415 -2.214 0 CA-C-N 111.511 -2.586 . . . . 0.0 112.805 172.212 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.708 ' HA ' ' N ' ' A' ' 36' ' ' VAL . 67.9 p -152.42 162.98 40.42 Favored 'General case' 0 C--O 1.279 2.625 0 CA-C-N 112.106 -2.315 . . . . 0.0 110.77 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.572 ' HG ' HD13 ' A' ' 51' ' ' LEU . 0.9 OUTLIER . . . . . 0 N--CA 1.481 1.088 1 O-C-N 116.282 -4.011 . . . . 0.0 109.983 -173.671 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.56 1.346 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.62 ' HA ' ' CB ' ' A' ' 26' ' ' THR . 27.5 Cg_exo 43.39 -167.75 0.0 OUTLIER 'Trans proline' 0 CA--C 1.463 -3.045 0 O-C-N 124.91 2.005 . . . . 0.0 116.04 171.383 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.708 ' N ' ' HA ' ' A' ' 26' ' ' THR . 0.5 OUTLIER -126.93 -72.04 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.368 1.407 0 O-C-N 117.309 -3.369 . . . . 0.0 112.29 -175.452 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.655 ' N ' ' CG1' ' A' ' 36' ' ' VAL . 35.8 mttm -153.84 167.49 29.49 Favored 'General case' 0 N--CA 1.419 -1.976 0 CA-C-N 111.159 -2.746 . . . . 0.0 108.281 -166.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.557 ' HD3' ' NE2' ' A' ' 7' ' ' GLN . 0.0 OUTLIER -169.5 175.71 5.33 Favored 'General case' 0 C--O 1.198 -1.649 0 O-C-N 117.998 -2.939 . . . . 0.0 108.995 167.101 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.437 ' O ' ' ND2' ' A' ' 62' ' ' ASN . . . 163.0 -158.44 30.74 Favored Glycine 0 N--CA 1.427 -1.953 0 CA-C-N 111.858 -2.428 . . . . 0.0 109.5 -166.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.591 ' HA ' ' HA ' ' A' ' 22' ' ' CYS . 76.1 m -91.04 -174.86 4.13 Favored 'General case' 0 C--O 1.209 -1.068 0 CA-C-O 126.572 3.082 . . . . 0.0 112.384 166.563 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . 0.657 ' HB1' ' CA ' ' A' ' 22' ' ' CYS . . . -147.96 -178.79 6.47 Favored 'General case' 0 C--O 1.251 1.145 0 CA-C-N 110.545 -3.025 . . . . 0.0 109.718 -159.446 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -164.3 -73.41 0.04 OUTLIER 'General case' 0 N--CA 1.427 -1.6 0 O-C-N 120.264 -1.522 . . . . 0.0 111.403 -164.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -88.05 -99.75 0.08 Allowed 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 114.867 -1.061 . . . . 0.0 108.198 170.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.496 ' HA ' ' HD2' ' A' ' 45' ' ' PRO . 0.1 OUTLIER 175.24 107.33 0.09 OUTLIER Pre-proline 0 C--N 1.314 -0.948 0 C-N-CA 125.292 1.437 . . . . 0.0 108.45 175.754 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.496 ' HD2' ' HA ' ' A' ' 44' ' ' CYS . 47.8 Cg_exo -45.1 166.93 0.04 OUTLIER 'Trans proline' 0 N--CA 1.438 -1.77 0 C-N-CA 123.955 3.104 . . . . 0.0 117.711 -161.604 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.9 tmtt? -100.52 76.87 1.87 Allowed 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 110.569 -3.014 . . . . 0.0 110.991 176.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.413 ' OD1' ' HB2' ' A' ' 53' ' ' TYR . 0.1 OUTLIER -37.81 162.34 0.0 OUTLIER 'General case' 0 C--O 1.253 1.254 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 -178.272 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.641 ' OG ' ' N ' ' A' ' 49' ' ' ALA . 0.1 OUTLIER -109.75 -166.75 1.12 Allowed 'General case' 0 C--N 1.366 1.289 1 O-C-N 115.621 -4.425 . . . . 0.0 115.397 -162.228 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.641 ' N ' ' OG ' ' A' ' 48' ' ' SER . . . -68.56 -13.3 62.24 Favored 'General case' 0 N--CA 1.412 -2.372 0 O-C-N 119.164 -2.21 . . . . 0.0 114.517 174.317 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.442 ' HA ' HD22 ' A' ' 50' ' ' LEU . 3.2 mt -162.06 22.71 0.11 Allowed 'General case' 0 C--O 1.258 1.539 0 CA-C-N 110.081 -3.236 . . . . 0.0 110.746 -170.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.572 HD13 ' HG ' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -133.38 -168.13 2.04 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 120.619 -1.3 . . . . 0.0 110.159 -176.484 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -151.39 142.04 22.72 Favored 'General case' 0 C--N 1.374 1.657 0 CA-C-N 108.511 -3.949 . . . . 0.0 108.963 169.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.486 ' CD2' ' HB1' ' A' ' 25' ' ' ALA . 7.8 m-85 -128.92 151.3 49.8 Favored 'General case' 0 C--O 1.22 -0.448 0 O-C-N 119.688 -1.883 . . . . 0.0 111.226 170.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 1.8 m -146.66 148.23 17.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 114.167 -1.379 . . . . 0.0 109.97 174.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.451 ' HB3' ' HB3' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -145.99 123.06 11.44 Favored 'General case' 0 C--O 1.252 1.219 0 O-C-N 121.031 -1.043 . . . . 0.0 113.265 -170.46 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.503 ' HB3' ' HB3' ' A' ' 61' ' ' CYS . 0.5 OUTLIER -94.2 -165.54 1.33 Allowed 'General case' 0 N--CA 1.423 -1.781 0 O-C-N 118.828 -2.42 . . . . 0.0 112.519 -176.973 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -121.22 -33.5 3.68 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 112.23 -2.259 . . . . 0.0 111.53 -176.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.466 ' OG1' ' N ' ' A' ' 59' ' ' ASP . 0.1 OUTLIER -101.9 -178.38 3.7 Favored 'General case' 0 C--O 1.209 -1.047 0 CA-C-O 125.461 2.553 . . . . 0.0 108.487 -167.549 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.577 ' O ' ' HG2' ' A' ' 60' ' ' LYS 0.321 0.0 OUTLIER -72.57 127.02 31.28 Favored 'General case' 0 N--CA 1.416 -2.135 0 CA-C-N 111.884 -2.416 . . . . 0.0 112.716 -168.95 . . . . . . . . 4 4 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.577 ' HG2' ' O ' ' A' ' 59' ' ' ASP . 0.1 OUTLIER 59.87 25.53 14.64 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 117.32 -1.752 . . . . 0.0 107.631 175.062 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.503 ' HB3' ' HB3' ' A' ' 56' ' ' CYS . 5.2 t -75.95 -31.22 58.97 Favored 'General case' 0 C--O 1.253 1.248 0 CA-C-N 111.969 -2.378 . . . . 0.0 111.379 -175.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.437 ' ND2' ' O ' ' A' ' 39' ' ' GLY . 0.3 OUTLIER . . . . . 0 C--O 1.247 0.958 0 O-C-N 120.018 -1.676 . . . . 0.0 108.736 -176.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' LEU . . . . . 0.598 HD22 ' N ' ' A' ' 59' ' ' ASP . 1.7 tm? . . . . . 0 C--O 1.244 0.78 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.417 ' O ' ' HB3' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -125.08 151.49 45.6 Favored 'General case' 0 C--O 1.167 -3.281 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 -177.426 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.0 t -169.16 -149.26 0.08 Allowed 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 108.914 -3.766 . . . . 0.0 108.111 -158.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 28.2 m80 -135.75 134.38 38.97 Favored 'General case' 0 C--N 1.359 0.993 0 O-C-N 118.993 -2.317 . . . . 0.0 110.241 -164.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ASN . . . . . 0.565 ' HB3' ' HA2' ' A' ' 39' ' ' GLY . 1.7 p-10 -126.17 -53.88 1.5 Allowed 'General case' 0 N--CA 1.444 -0.763 0 O-C-N 119.942 -1.724 . . . . 0.0 110.013 169.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.442 ' C ' ' HG2' ' A' ' 7' ' ' GLN . 4.3 m -69.24 -52.79 24.19 Favored 'General case' 0 CA--C 1.586 2.362 0 CA-C-O 116.336 -1.792 . . . . 0.0 106.31 -177.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . 0.442 ' HG2' ' C ' ' A' ' 6' ' ' THR 0.361 0.5 OUTLIER 58.07 -46.43 0.05 OUTLIER 'General case' 0 N--CA 1.423 -1.809 0 CA-C-N 111.001 -2.818 . . . . 0.0 118.499 -172.602 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.49 ' HG ' ' HD2' ' A' ' 9' ' ' PRO . 23.6 tp -52.02 124.52 29.37 Favored Pre-proline 0 N--CA 1.424 -1.769 0 O-C-N 116.886 -3.633 . . . . 0.0 109.097 160.285 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.49 ' HD2' ' HG ' ' A' ' 8' ' ' LEU 0.503 50.3 Cg_exo -14.85 153.14 0.0 OUTLIER 'Trans proline' 0 C--N 1.274 -3.359 1 C-N-CA 126.06 4.507 . . . . 0.0 117.037 -92.682 . . . . . . . . 4 3 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . 0.499 ' O ' ' C ' ' A' ' 11' ' ' ILE . 9.1 m-30 -52.18 -11.57 0.19 Allowed 'General case' 0 C--O 1.255 1.383 0 O-C-N 118.309 -2.745 . . . . 0.0 113.125 -172.629 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.499 ' C ' ' O ' ' A' ' 10' ' ' PHE . 0.1 OUTLIER -44.66 110.56 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 CA-C-N 114.284 -1.325 . . . . 0.0 107.459 171.787 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' TYR . . . . . 0.508 ' CD2' ' N ' ' A' ' 12' ' ' TYR . 0.4 OUTLIER -114.06 -161.99 0.79 Allowed 'General case' 0 C--N 1.311 -1.104 0 C-N-CA 126.745 2.018 . . . . 0.0 108.492 -166.779 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.8 tttp -159.08 170.0 23.0 Favored 'General case' 0 C--O 1.202 -1.399 0 CA-C-N 113.041 -1.891 . . . . 0.0 109.108 170.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 53.3 m -92.11 120.14 32.43 Favored 'General case' 0 C--O 1.263 1.791 0 CA-C-N 109.144 -3.662 . . . . 0.0 112.566 173.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.486 ' HB3' ' HB3' ' A' ' 40' ' ' CYS . 0.5 OUTLIER -105.09 139.15 19.83 Favored Pre-proline 0 CA--C 1.484 -1.582 0 O-C-N 118.508 -2.62 . . . . 0.0 113.32 -175.309 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.476 ' HD3' ' SG ' ' A' ' 40' ' ' CYS . 6.0 Cg_endo -123.31 -174.33 0.01 OUTLIER 'Trans proline' 0 CA--C 1.543 0.934 0 O-C-N 117.545 -1.871 . . . . 0.0 110.732 -115.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.9 129.14 16.92 Favored 'General case' 0 C--N 1.358 0.937 0 CA-C-O 126.48 3.038 . . . . 0.0 113.228 -174.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 85.56 -8.37 72.26 Favored Glycine 0 N--CA 1.422 -2.241 0 CA-C-N 110.742 -2.936 . . . . 0.0 110.116 -175.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.446 ' HG2' ' HB2' ' A' ' 40' ' ' CYS . 18.0 tptt -139.18 69.03 1.37 Allowed 'General case' 0 CA--C 1.571 1.783 0 N-CA-C 103.908 -2.627 . . . . 0.0 103.908 -172.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -67.79 -46.01 73.18 Favored 'General case' 0 CA--C 1.567 1.61 0 CA-C-N 109.923 -3.308 . . . . 0.0 110.709 -163.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 56' ' ' CYS . 0.3 OUTLIER -82.27 173.56 11.97 Favored 'General case' 0 C--O 1.214 -0.776 0 CA-C-N 110.213 -3.176 . . . . 0.0 108.919 -170.282 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 7.1 p -126.36 131.48 51.78 Favored 'General case' 0 C--O 1.258 1.522 0 CA-C-N 113.538 -1.665 . . . . 0.0 113.038 165.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.495 ' C ' ' HB2' ' A' ' 62' ' ' ASN 0.361 0.1 OUTLIER -113.04 175.12 5.57 Favored 'General case' 0 CA--C 1.622 3.723 0 O-C-N 117.798 -3.064 . . . . 0.0 106.21 -176.221 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -162.19 147.23 12.69 Favored 'General case' 0 N--CA 1.418 -2.065 1 CA-C-N 105.201 -5.454 . . . . 0.0 105.639 162.691 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.676 ' HB1' ' CD2' ' A' ' 53' ' ' TYR . . . -131.89 127.58 36.77 Favored 'General case' 0 C--N 1.392 2.418 1 CA-C-N 108.087 -4.142 . . . . 0.0 110.587 177.304 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.553 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -101.83 169.06 9.04 Favored 'General case' 0 C--O 1.267 1.974 0 CA-C-N 112.799 -2.0 . . . . 0.0 111.855 179.618 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mt . . . . . 0 C--O 1.247 0.932 0 O-C-N 118.359 -2.713 . . . . 0.0 108.184 173.533 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.659 ' N ' ' CD ' ' A' ' 35' ' ' PRO . 91.9 t80 . . . . . 0 CA--C 1.5 -0.975 0 CA-C-O 123.891 1.805 . . . . 0.0 112.702 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.659 ' CD ' ' N ' ' A' ' 34' ' ' PHE . 9.8 Cg_exo -75.29 104.4 1.9 Allowed 'Trans proline' 0 C--N 1.373 1.839 0 CA-C-N 112.685 -1.577 . . . . 0.0 113.15 158.399 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.693 HG21 ' N ' ' A' ' 37' ' ' LYS . 1.8 p -122.95 161.51 24.31 Favored 'Isoleucine or valine' 0 C--N 1.393 2.495 0 CA-C-N 108.696 -3.866 . . . . 0.0 115.916 167.188 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.693 ' N ' HG21 ' A' ' 36' ' ' VAL . 3.2 mttp -126.59 156.25 41.2 Favored 'General case' 0 C--O 1.27 2.167 0 C-N-CA 128.505 2.722 . . . . 0.0 108.861 163.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.52 ' HD2' ' N ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -158.01 -166.88 2.07 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 116.517 -3.865 . . . . 0.0 109.859 173.841 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLY . . . . . 0.565 ' HA2' ' HB3' ' A' ' 5' ' ' ASN . . . 140.44 -156.75 25.36 Favored Glycine 0 C--N 1.364 2.085 0 CA-C-N 110.513 -3.04 . . . . 0.0 110.224 -169.81 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' CYS . . . . . 0.486 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 0.0 OUTLIER -82.32 -176.89 6.43 Favored 'General case' 0 N--CA 1.416 -2.13 0 CA-C-N 112.442 -1.879 . . . . 0.0 111.971 176.827 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -166.92 -172.43 2.07 Favored 'General case' 0 C--N 1.408 3.111 1 CA-C-N 106.462 -4.881 . . . . 0.0 110.922 -159.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -175.86 -74.7 0.01 OUTLIER 'General case' 0 C--N 1.366 1.311 1 O-C-N 116.002 -4.186 . . . . 0.0 111.341 -162.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -81.65 -68.55 0.68 Allowed 'General case' 0 CA--C 1.562 1.425 0 C-N-CA 124.26 1.024 . . . . 0.0 109.332 170.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.2 m 138.27 54.83 0.0 OUTLIER Pre-proline 0 N--CA 1.426 -1.649 0 CA-C-N 111.904 -2.407 . . . . 0.0 110.686 -171.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.648 ' HB2' ' CG ' ' A' ' 53' ' ' TYR . 0.3 OUTLIER 20.75 171.99 0.0 OUTLIER 'Trans proline' 0 CA--C 1.474 -2.492 0 N-CA-C 119.51 2.85 . . . . 0.0 119.51 -173.267 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . 0.476 ' O ' ' C ' ' A' ' 47' ' ' ASN . 0.0 OUTLIER -99.97 87.14 3.42 Favored 'General case' 0 N--CA 1.423 -1.776 0 O-C-N 118.017 -2.927 . . . . 0.0 109.834 165.263 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASN . . . . . 0.562 ' OD1' ' HB2' ' A' ' 53' ' ' TYR . 0.5 OUTLIER -37.67 134.12 0.73 Allowed 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 174.53 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' SER . . . . . 0.425 ' C ' ' H ' ' A' ' 50' ' ' LEU . 25.0 t -81.04 -151.75 0.08 Allowed 'General case' 0 CA--C 1.488 -1.437 0 N-CA-C 116.769 2.136 . . . . 0.0 116.769 -168.046 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.508 ' O ' ' HB2' ' A' ' 50' ' ' LEU . . . -84.69 -2.44 57.56 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 119.763 -1.836 . . . . 0.0 110.654 -169.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.508 ' HB2' ' O ' ' A' ' 49' ' ' ALA . 17.8 tp -165.76 35.92 0.05 Allowed 'General case' 0 C--N 1.392 2.416 0 CA-C-N 109.151 -3.659 . . . . 0.0 112.965 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 26' ' ' THR . 0.3 OUTLIER -133.7 -166.76 1.83 Allowed 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 118.948 -2.345 . . . . 0.0 113.239 -172.31 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.5 tttp -158.82 109.17 2.03 Favored 'General case' 0 C--N 1.379 1.888 1 CA-C-N 107.828 -4.26 . . . . 0.0 106.632 177.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.676 ' CD2' ' HB1' ' A' ' 25' ' ' ALA . 12.4 m-85 -97.19 132.17 43.22 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-O 122.692 1.234 . . . . 0.0 113.525 166.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 1.5 m -130.45 130.2 65.04 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.547 0 CA-C-N 114.539 -1.21 . . . . 0.0 111.366 170.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.422 ' HB3' ' HB3' ' A' ' 23' ' ' PHE . 4.4 p -132.9 111.16 10.83 Favored 'General case' 0 C--O 1.283 2.863 0 CA-C-O 116.332 -1.794 . . . . 0.0 109.87 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' CYS . . . . . 0.529 ' O ' ' HG ' ' A' ' 21' ' ' LEU 0.423 1.6 p -108.63 176.81 4.98 Favored 'General case' 0 C--N 1.374 1.638 1 O-C-N 114.589 -5.069 . . . . 0.0 112.966 174.623 . . . . . . . . 4 3 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -78.55 -41.26 32.54 Favored 'General case' 0 N--CA 1.423 -1.803 0 CA-C-N 114.375 -1.284 . . . . 0.0 110.365 -171.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.465 ' O ' ' HB2' ' A' ' 61' ' ' CYS . 0.1 OUTLIER -75.55 144.22 42.02 Favored 'General case' 0 C--O 1.283 2.828 0 CA-C-N 111.045 -2.798 . . . . 0.0 109.164 -159.624 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.598 ' N ' HD22 ' A' ' 1' ' ' LEU . 0.6 OUTLIER -53.58 140.93 27.18 Favored 'General case' 0 C--N 1.394 2.537 1 O-C-N 112.07 -6.644 . . . . 0.0 109.158 -175.88 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.53 10.71 6.05 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 122.62 1.2 . . . . 0.0 111.296 178.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 58' ' ' THR . 0.5 OUTLIER -55.33 -38.59 68.93 Favored 'General case' 0 N--CA 1.42 -1.938 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 -179.728 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.495 ' HB2' ' C ' ' A' ' 23' ' ' PHE . 39.3 p30 . . . . . 0 C--O 1.203 -1.375 0 CA-C-O 126.978 3.275 . . . . 0.0 110.12 -168.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.43 ' CD2' ' CG ' ' A' ' 59' ' ' ASP . 3.2 tm? . . . . . 0 CA--C 1.54 0.588 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.487 ' HB3' ' HA ' ' A' ' 14' ' ' THR . 0.0 OUTLIER -122.99 150.01 43.56 Favored 'General case' 0 C--O 1.215 -0.757 0 CA-C-N 111.225 -2.716 . . . . 0.0 107.158 -174.683 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.8 t -155.56 -135.06 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 111.995 -2.366 . . . . 0.0 108.387 -160.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.436 ' CD2' ' HB3' ' A' ' 7' ' ' GLN . 0.3 OUTLIER -145.52 152.04 39.11 Favored 'General case' 0 C--N 1.379 1.858 0 O-C-N 117.992 -2.943 . . . . 0.0 110.726 -167.665 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -148.02 -56.31 0.22 Allowed 'General case' 0 C--N 1.359 1.004 0 O-C-N 117.937 -2.977 . . . . 0.0 110.248 168.061 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.602 ' O ' ' N ' ' A' ' 8' ' ' LEU . 2.4 m -67.02 -54.39 22.13 Favored 'General case' 0 CA--C 1.586 2.341 0 CA-C-O 113.696 -3.05 . . . . 0.0 109.762 -176.316 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.557 ' NE2' ' HD3' ' A' ' 38' ' ' ARG 0.516 1.6 pt20 64.06 -54.21 0.25 Allowed 'General case' 0 C--O 1.265 1.918 0 O-C-N 117.757 -3.089 . . . . 0.0 116.551 -175.914 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.602 ' N ' ' O ' ' A' ' 6' ' ' THR . 7.6 tp -52.93 126.76 43.52 Favored Pre-proline 0 CA--C 1.595 2.707 1 O-C-N 115.808 -4.308 . . . . 0.0 104.262 157.548 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.507 ' C ' ' N ' ' A' ' 11' ' ' ILE 0.353 75.6 Cg_exo -23.02 140.14 0.01 OUTLIER 'Trans proline' 0 C--N 1.273 -3.42 1 C-N-CA 129.069 6.513 . . . . 0.0 119.425 -93.627 . . . . . . . . 4 3 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.489 ' CD1' ' C ' ' A' ' 10' ' ' PHE . 0.0 OUTLIER -34.69 -18.7 0.0 OUTLIER 'General case' 0 C--N 1.365 1.281 1 O-C-N 115.668 -4.395 . . . . 0.0 112.753 -177.026 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.507 ' N ' ' C ' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -37.08 117.09 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.432 -1.369 0 CA-C-N 114.362 -1.29 . . . . 0.0 110.557 170.617 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.47 ' CD2' ' N ' ' A' ' 12' ' ' TYR . 0.8 OUTLIER -118.76 -163.01 0.93 Allowed 'General case' 0 CA--C 1.575 1.938 0 O-C-N 118.634 -2.541 . . . . 0.0 108.149 -161.139 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.65 169.35 23.5 Favored 'General case' 0 CA--C 1.586 2.346 0 CA-C-N 109.834 -3.348 . . . . 0.0 107.652 165.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.487 ' HA ' ' HB3' ' A' ' 2' ' ' LYS . 43.7 m -79.76 155.02 28.12 Favored 'General case' 0 C--O 1.248 1.02 0 CA-C-N 109.574 -3.466 . . . . 0.0 110.471 164.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 42.7 m -69.79 -173.29 0.21 Allowed Pre-proline 0 N--CA 1.425 -1.697 0 CA-C-O 122.85 1.31 . . . . 0.0 112.782 174.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.617 ' HD2' ' CB ' ' A' ' 19' ' ' LYS . 5.8 Cg_exo -116.34 -170.55 0.02 OUTLIER 'Trans proline' 0 CA--C 1.536 0.608 0 CA-C-N 111.855 -1.873 . . . . 0.0 109.064 177.097 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.432 ' N ' ' CD ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -82.84 133.93 35.12 Favored 'General case' 0 C--O 1.213 -0.858 0 CA-C-N 113.849 -1.523 . . . . 0.0 108.953 175.415 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.71 13.75 54.41 Favored Glycine 0 C--N 1.377 2.85 0 CA-C-N 111.034 -2.803 . . . . 0.0 113.372 -175.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.617 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 1.2 mmtt -136.88 74.09 1.47 Allowed 'General case' 0 N--CA 1.438 -1.045 0 CA-C-O 124.231 1.967 . . . . 0.0 110.971 -166.761 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.423 ' O ' HD22 ' A' ' 21' ' ' LEU . 0.1 OUTLIER -89.03 -17.98 28.26 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 114.482 -1.236 . . . . 0.0 109.343 -168.305 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.461 ' CB ' ' HB2' ' A' ' 41' ' ' ALA . 16.1 mt -105.46 -156.8 0.59 Allowed 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 127.271 2.228 . . . . 0.0 110.327 -169.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.657 ' CA ' ' HB1' ' A' ' 41' ' ' ALA . 62.8 m -161.96 132.67 5.01 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-N 113.812 -1.54 . . . . 0.0 110.808 174.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.451 ' HB3' ' HB3' ' A' ' 55' ' ' CYS 0.259 0.1 OUTLIER -128.06 -178.59 4.59 Favored 'General case' 0 CA--C 1.601 2.931 1 O-C-N 114.78 -4.95 . . . . 0.0 106.519 175.48 . . . . . . . . 5 4 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 2.1 pttt -165.13 154.22 12.49 Favored 'General case' 0 N--CA 1.426 -1.631 1 CA-C-N 103.954 -6.021 . . . . 0.0 105.231 173.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.486 ' HB1' ' CD2' ' A' ' 53' ' ' TYR 0.317 . . -134.35 178.53 6.91 Favored 'General case' 0 N--CA 1.415 -2.214 0 CA-C-N 111.511 -2.586 . . . . 0.0 112.805 172.212 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.708 ' HA ' ' N ' ' A' ' 36' ' ' VAL . 67.9 p -152.42 162.98 40.42 Favored 'General case' 0 C--O 1.279 2.625 0 CA-C-N 112.106 -2.315 . . . . 0.0 110.77 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.572 ' HG ' HD13 ' A' ' 51' ' ' LEU . 0.9 OUTLIER -111.78 147.96 34.56 Favored 'General case' 0 N--CA 1.481 1.088 1 O-C-N 116.282 -4.011 . . . . 0.0 109.983 -173.671 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.25 47.79 1.39 Allowed 'General case' 0 C--O 1.217 -0.644 0 CA-C-O 123.988 1.851 . . . . 0.0 109.868 172.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -61.95 -69.41 0.25 Allowed 'General case' 0 C--O 1.242 0.691 0 CA-C-N 113.511 -1.677 . . . . 0.0 112.471 176.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.607 ' CD2' HD11 ' A' ' 32' ' ' LEU . 0.4 OUTLIER -122.23 139.48 30.69 Favored Pre-proline 0 C--N 1.359 1.006 0 O-C-N 118.312 -2.743 . . . . 0.0 108.573 -167.897 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.448 ' O ' ' HB2' ' A' ' 32' ' ' LEU . 40.2 Cg_exo -57.63 76.93 0.04 OUTLIER 'Trans proline' 0 C--O 1.247 0.96 0 CA-C-N 113.783 -1.185 . . . . 0.0 110.922 173.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.607 HD11 ' CD2' ' A' ' 30' ' ' PHE 0.354 0.0 OUTLIER 150.94 -74.98 0.0 OUTLIER 'General case' 0 N--CA 1.531 3.598 2 O-C-N 114.628 -5.045 . . . . 0.0 101.501 -160.654 . . . . . . . . 5 4 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.458 ' CB ' ' O ' ' A' ' 32' ' ' LEU . 1.3 pttm 81.69 -176.26 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.454 0 CA-C-N 109.634 -3.439 . . . . 0.0 114.392 164.348 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -160.11 38.8 0.06 OUTLIER Pre-proline 0 CA--C 1.56 1.346 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 -162.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.62 ' HA ' ' CB ' ' A' ' 26' ' ' THR . 27.5 Cg_exo 43.39 -167.75 0.0 OUTLIER 'Trans proline' 0 CA--C 1.463 -3.045 0 O-C-N 124.91 2.005 . . . . 0.0 116.04 171.383 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.708 ' N ' ' HA ' ' A' ' 26' ' ' THR . 0.5 OUTLIER -126.93 -72.04 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.368 1.407 0 O-C-N 117.309 -3.369 . . . . 0.0 112.29 -175.452 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.655 ' N ' ' CG1' ' A' ' 36' ' ' VAL . 35.8 mttm -153.84 167.49 29.49 Favored 'General case' 0 N--CA 1.419 -1.976 0 CA-C-N 111.159 -2.746 . . . . 0.0 108.281 -166.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.557 ' HD3' ' NE2' ' A' ' 7' ' ' GLN . 0.0 OUTLIER -169.5 175.71 5.33 Favored 'General case' 0 C--O 1.198 -1.649 0 O-C-N 117.998 -2.939 . . . . 0.0 108.995 167.101 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.437 ' O ' ' ND2' ' A' ' 62' ' ' ASN . . . 163.0 -158.44 30.74 Favored Glycine 0 N--CA 1.427 -1.953 0 CA-C-N 111.858 -2.428 . . . . 0.0 109.5 -166.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.591 ' HA ' ' HA ' ' A' ' 22' ' ' CYS . 76.1 m -91.04 -174.86 4.13 Favored 'General case' 0 C--O 1.209 -1.068 0 CA-C-O 126.572 3.082 . . . . 0.0 112.384 166.563 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . 0.657 ' HB1' ' CA ' ' A' ' 22' ' ' CYS . . . -147.96 -178.79 6.47 Favored 'General case' 0 C--O 1.251 1.145 0 CA-C-N 110.545 -3.025 . . . . 0.0 109.718 -159.446 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -164.3 -73.41 0.04 OUTLIER 'General case' 0 N--CA 1.427 -1.6 0 O-C-N 120.264 -1.522 . . . . 0.0 111.403 -164.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -88.05 -99.75 0.08 Allowed 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 114.867 -1.061 . . . . 0.0 108.198 170.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.496 ' HA ' ' HD2' ' A' ' 45' ' ' PRO . 0.1 OUTLIER 175.24 107.33 0.09 OUTLIER Pre-proline 0 C--N 1.314 -0.948 0 C-N-CA 125.292 1.437 . . . . 0.0 108.45 175.754 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.496 ' HD2' ' HA ' ' A' ' 44' ' ' CYS . 47.8 Cg_exo -45.1 166.93 0.04 OUTLIER 'Trans proline' 0 N--CA 1.438 -1.77 0 C-N-CA 123.955 3.104 . . . . 0.0 117.711 -161.604 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.9 tmtt? -100.52 76.87 1.87 Allowed 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 110.569 -3.014 . . . . 0.0 110.991 176.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.413 ' OD1' ' HB2' ' A' ' 53' ' ' TYR . 0.1 OUTLIER -37.81 162.34 0.0 OUTLIER 'General case' 0 C--O 1.253 1.254 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 -178.272 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.641 ' OG ' ' N ' ' A' ' 49' ' ' ALA . 0.1 OUTLIER -109.75 -166.75 1.12 Allowed 'General case' 0 C--N 1.366 1.289 1 O-C-N 115.621 -4.425 . . . . 0.0 115.397 -162.228 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.641 ' N ' ' OG ' ' A' ' 48' ' ' SER . . . -68.56 -13.3 62.24 Favored 'General case' 0 N--CA 1.412 -2.372 0 O-C-N 119.164 -2.21 . . . . 0.0 114.517 174.317 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.442 ' HA ' HD22 ' A' ' 50' ' ' LEU . 3.2 mt -162.06 22.71 0.11 Allowed 'General case' 0 C--O 1.258 1.539 0 CA-C-N 110.081 -3.236 . . . . 0.0 110.746 -170.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.572 HD13 ' HG ' ' A' ' 27' ' ' LEU . 0.6 OUTLIER -133.38 -168.13 2.04 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 120.619 -1.3 . . . . 0.0 110.159 -176.484 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -151.39 142.04 22.72 Favored 'General case' 0 C--N 1.374 1.657 0 CA-C-N 108.511 -3.949 . . . . 0.0 108.963 169.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.486 ' CD2' ' HB1' ' A' ' 25' ' ' ALA . 7.8 m-85 -128.92 151.3 49.8 Favored 'General case' 0 C--O 1.22 -0.448 0 O-C-N 119.688 -1.883 . . . . 0.0 111.226 170.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 1.8 m -146.66 148.23 17.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 114.167 -1.379 . . . . 0.0 109.97 174.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.451 ' HB3' ' HB3' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -145.99 123.06 11.44 Favored 'General case' 0 C--O 1.252 1.219 0 O-C-N 121.031 -1.043 . . . . 0.0 113.265 -170.46 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.503 ' HB3' ' HB3' ' A' ' 61' ' ' CYS . 0.5 OUTLIER -94.2 -165.54 1.33 Allowed 'General case' 0 N--CA 1.423 -1.781 0 O-C-N 118.828 -2.42 . . . . 0.0 112.519 -176.973 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -121.22 -33.5 3.68 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 112.23 -2.259 . . . . 0.0 111.53 -176.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.466 ' OG1' ' N ' ' A' ' 59' ' ' ASP . 0.1 OUTLIER -101.9 -178.38 3.7 Favored 'General case' 0 C--O 1.209 -1.047 0 CA-C-O 125.461 2.553 . . . . 0.0 108.487 -167.549 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.577 ' O ' ' HG2' ' A' ' 60' ' ' LYS 0.321 0.0 OUTLIER -72.57 127.02 31.28 Favored 'General case' 0 N--CA 1.416 -2.135 0 CA-C-N 111.884 -2.416 . . . . 0.0 112.716 -168.95 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.577 ' HG2' ' O ' ' A' ' 59' ' ' ASP . 0.1 OUTLIER 59.87 25.53 14.64 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 117.32 -1.752 . . . . 0.0 107.631 175.062 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.503 ' HB3' ' HB3' ' A' ' 56' ' ' CYS . 5.2 t -75.95 -31.22 58.97 Favored 'General case' 0 C--O 1.253 1.248 0 CA-C-N 111.969 -2.378 . . . . 0.0 111.379 -175.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.437 ' ND2' ' O ' ' A' ' 39' ' ' GLY . 0.3 OUTLIER . . . . . 0 C--O 1.247 0.958 0 O-C-N 120.018 -1.676 . . . . 0.0 108.736 -176.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . 0.598 HD22 ' N ' ' A' ' 59' ' ' ASP . 1.7 tm? . . . . . 0 C--O 1.244 0.78 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.417 ' O ' ' HB3' ' A' ' 59' ' ' ASP . 0.0 OUTLIER -125.08 151.49 45.6 Favored 'General case' 0 C--O 1.167 -3.281 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 -177.426 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.0 t -169.16 -149.26 0.08 Allowed 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 108.914 -3.766 . . . . 0.0 108.111 -158.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 28.2 m80 -135.75 134.38 38.97 Favored 'General case' 0 C--N 1.359 0.993 0 O-C-N 118.993 -2.317 . . . . 0.0 110.241 -164.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . 0.565 ' HB3' ' HA2' ' A' ' 39' ' ' GLY . 1.7 p-10 -126.17 -53.88 1.5 Allowed 'General case' 0 N--CA 1.444 -0.763 0 O-C-N 119.942 -1.724 . . . . 0.0 110.013 169.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.442 ' C ' ' HG2' ' A' ' 7' ' ' GLN . 4.3 m -69.24 -52.79 24.19 Favored 'General case' 0 CA--C 1.586 2.362 0 CA-C-O 116.336 -1.792 . . . . 0.0 106.31 -177.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . 0.442 ' HG2' ' C ' ' A' ' 6' ' ' THR 0.361 0.5 OUTLIER 58.07 -46.43 0.05 OUTLIER 'General case' 0 N--CA 1.423 -1.809 0 CA-C-N 111.001 -2.818 . . . . 0.0 118.499 -172.602 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.49 ' HG ' ' HD2' ' A' ' 9' ' ' PRO . 23.6 tp -52.02 124.52 29.37 Favored Pre-proline 0 N--CA 1.424 -1.769 0 O-C-N 116.886 -3.633 . . . . 0.0 109.097 160.285 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.49 ' HD2' ' HG ' ' A' ' 8' ' ' LEU 0.503 50.3 Cg_exo -14.85 153.14 0.0 OUTLIER 'Trans proline' 0 C--N 1.274 -3.359 1 C-N-CA 126.06 4.507 . . . . 0.0 117.037 -92.682 . . . . . . . . 4 3 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . 0.499 ' O ' ' C ' ' A' ' 11' ' ' ILE . 9.1 m-30 -52.18 -11.57 0.19 Allowed 'General case' 0 C--O 1.255 1.383 0 O-C-N 118.309 -2.745 . . . . 0.0 113.125 -172.629 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.499 ' C ' ' O ' ' A' ' 10' ' ' PHE . 0.1 OUTLIER -44.66 110.56 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 CA-C-N 114.284 -1.325 . . . . 0.0 107.459 171.787 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.508 ' CD2' ' N ' ' A' ' 12' ' ' TYR . 0.4 OUTLIER -114.06 -161.99 0.79 Allowed 'General case' 0 C--N 1.311 -1.104 0 C-N-CA 126.745 2.018 . . . . 0.0 108.492 -166.779 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.8 tttp -159.08 170.0 23.0 Favored 'General case' 0 C--O 1.202 -1.399 0 CA-C-N 113.041 -1.891 . . . . 0.0 109.108 170.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 53.3 m -92.11 120.14 32.43 Favored 'General case' 0 C--O 1.263 1.791 0 CA-C-N 109.144 -3.662 . . . . 0.0 112.566 173.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.486 ' HB3' ' HB3' ' A' ' 40' ' ' CYS . 0.5 OUTLIER -105.09 139.15 19.83 Favored Pre-proline 0 CA--C 1.484 -1.582 0 O-C-N 118.508 -2.62 . . . . 0.0 113.32 -175.309 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.476 ' HD3' ' SG ' ' A' ' 40' ' ' CYS . 6.0 Cg_endo -123.31 -174.33 0.01 OUTLIER 'Trans proline' 0 CA--C 1.543 0.934 0 O-C-N 117.545 -1.871 . . . . 0.0 110.732 -115.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.9 129.14 16.92 Favored 'General case' 0 C--N 1.358 0.937 0 CA-C-O 126.48 3.038 . . . . 0.0 113.228 -174.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 85.56 -8.37 72.26 Favored Glycine 0 N--CA 1.422 -2.241 0 CA-C-N 110.742 -2.936 . . . . 0.0 110.116 -175.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.446 ' HG2' ' HB2' ' A' ' 40' ' ' CYS . 18.0 tptt -139.18 69.03 1.37 Allowed 'General case' 0 CA--C 1.571 1.783 0 N-CA-C 103.908 -2.627 . . . . 0.0 103.908 -172.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -67.79 -46.01 73.18 Favored 'General case' 0 CA--C 1.567 1.61 0 CA-C-N 109.923 -3.308 . . . . 0.0 110.709 -163.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 56' ' ' CYS . 0.3 OUTLIER -82.27 173.56 11.97 Favored 'General case' 0 C--O 1.214 -0.776 0 CA-C-N 110.213 -3.176 . . . . 0.0 108.919 -170.282 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 7.1 p -126.36 131.48 51.78 Favored 'General case' 0 C--O 1.258 1.522 0 CA-C-N 113.538 -1.665 . . . . 0.0 113.038 165.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.495 ' C ' ' HB2' ' A' ' 62' ' ' ASN 0.361 0.1 OUTLIER -113.04 175.12 5.57 Favored 'General case' 0 CA--C 1.622 3.723 0 O-C-N 117.798 -3.064 . . . . 0.0 106.21 -176.221 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -162.19 147.23 12.69 Favored 'General case' 0 N--CA 1.418 -2.065 1 CA-C-N 105.201 -5.454 . . . . 0.0 105.639 162.691 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.676 ' HB1' ' CD2' ' A' ' 53' ' ' TYR . . . -131.89 127.58 36.77 Favored 'General case' 0 C--N 1.392 2.418 1 CA-C-N 108.087 -4.142 . . . . 0.0 110.587 177.304 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.553 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -101.83 169.06 9.04 Favored 'General case' 0 C--O 1.267 1.974 0 CA-C-N 112.799 -2.0 . . . . 0.0 111.855 179.618 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mt -98.34 148.36 23.74 Favored 'General case' 0 C--O 1.247 0.932 0 O-C-N 118.359 -2.713 . . . . 0.0 108.184 173.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.95 75.95 0.64 Allowed 'General case' 0 CA--C 1.576 1.973 0 N-CA-C 105.013 -2.218 . . . . 0.0 105.013 171.187 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.514 ' HD2' ' HB2' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -86.44 -111.22 0.05 Allowed 'General case' 0 C--O 1.252 1.187 0 CA-C-N 112.726 -2.033 . . . . 0.0 110.33 -173.307 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.489 ' H ' ' CG ' ' A' ' 29' ' ' LYS . 8.0 t80 -154.2 94.1 2.87 Favored Pre-proline 0 C--O 1.259 1.585 0 O-C-N 119.897 -1.752 . . . . 0.0 107.934 -174.13 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.47 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 2.2 Cg_exo -43.11 93.46 0.02 OUTLIER 'Trans proline' 0 C--N 1.3 -1.978 0 C-N-CA 121.794 1.662 . . . . 0.0 112.269 -162.446 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.446 ' CD1' ' C ' ' A' ' 32' ' ' LEU . 0.2 OUTLIER 152.76 -45.78 0.01 OUTLIER 'General case' 0 C--N 1.38 1.903 0 O-C-N 116.991 -3.568 . . . . 0.0 109.844 -162.632 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.613 ' HB3' ' HD3' ' A' ' 35' ' ' PRO . 0.1 OUTLIER -64.75 -60.99 2.47 Favored 'General case' 0 CA--C 1.554 1.131 0 O-C-N 119.415 -2.053 . . . . 0.0 110.326 -178.917 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.659 ' N ' ' CD ' ' A' ' 35' ' ' PRO . 91.9 t80 73.79 51.02 0.24 Allowed Pre-proline 0 C--N 1.367 1.359 1 CA-C-N 108.225 -4.08 . . . . 0.0 112.702 169.748 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.659 ' CD ' ' N ' ' A' ' 34' ' ' PHE . 9.8 Cg_exo -75.29 104.4 1.9 Allowed 'Trans proline' 0 C--N 1.373 1.839 0 CA-C-N 112.685 -1.577 . . . . 0.0 113.15 158.399 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.693 HG21 ' N ' ' A' ' 37' ' ' LYS . 1.8 p -122.95 161.51 24.31 Favored 'Isoleucine or valine' 0 C--N 1.393 2.495 0 CA-C-N 108.696 -3.866 . . . . 0.0 115.916 167.188 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.693 ' N ' HG21 ' A' ' 36' ' ' VAL . 3.2 mttp -126.59 156.25 41.2 Favored 'General case' 0 C--O 1.27 2.167 0 C-N-CA 128.505 2.722 . . . . 0.0 108.861 163.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.52 ' HD2' ' N ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -158.01 -166.88 2.07 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 116.517 -3.865 . . . . 0.0 109.859 173.841 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.565 ' HA2' ' HB3' ' A' ' 5' ' ' ASN . . . 140.44 -156.75 25.36 Favored Glycine 0 C--N 1.364 2.085 0 CA-C-N 110.513 -3.04 . . . . 0.0 110.224 -169.81 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.486 ' HB3' ' HB3' ' A' ' 15' ' ' CYS . 0.0 OUTLIER -82.32 -176.89 6.43 Favored 'General case' 0 N--CA 1.416 -2.13 0 CA-C-N 112.442 -1.879 . . . . 0.0 111.971 176.827 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -166.92 -172.43 2.07 Favored 'General case' 0 C--N 1.408 3.111 1 CA-C-N 106.462 -4.881 . . . . 0.0 110.922 -159.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -175.86 -74.7 0.01 OUTLIER 'General case' 0 C--N 1.366 1.311 1 O-C-N 116.002 -4.186 . . . . 0.0 111.341 -162.47 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -81.65 -68.55 0.68 Allowed 'General case' 0 CA--C 1.562 1.425 0 C-N-CA 124.26 1.024 . . . . 0.0 109.332 170.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.2 m 138.27 54.83 0.0 OUTLIER Pre-proline 0 N--CA 1.426 -1.649 0 CA-C-N 111.904 -2.407 . . . . 0.0 110.686 -171.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.648 ' HB2' ' CG ' ' A' ' 53' ' ' TYR . 0.3 OUTLIER 20.75 171.99 0.0 OUTLIER 'Trans proline' 0 CA--C 1.474 -2.492 0 N-CA-C 119.51 2.85 . . . . 0.0 119.51 -173.267 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . 0.476 ' O ' ' C ' ' A' ' 47' ' ' ASN . 0.0 OUTLIER -99.97 87.14 3.42 Favored 'General case' 0 N--CA 1.423 -1.776 0 O-C-N 118.017 -2.927 . . . . 0.0 109.834 165.263 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASN . . . . . 0.562 ' OD1' ' HB2' ' A' ' 53' ' ' TYR . 0.5 OUTLIER -37.67 134.12 0.73 Allowed 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 174.53 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' SER . . . . . 0.425 ' C ' ' H ' ' A' ' 50' ' ' LEU . 25.0 t -81.04 -151.75 0.08 Allowed 'General case' 0 CA--C 1.488 -1.437 0 N-CA-C 116.769 2.136 . . . . 0.0 116.769 -168.046 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.508 ' O ' ' HB2' ' A' ' 50' ' ' LEU . . . -84.69 -2.44 57.56 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 119.763 -1.836 . . . . 0.0 110.654 -169.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.508 ' HB2' ' O ' ' A' ' 49' ' ' ALA . 17.8 tp -165.76 35.92 0.05 Allowed 'General case' 0 C--N 1.392 2.416 0 CA-C-N 109.151 -3.659 . . . . 0.0 112.965 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 26' ' ' THR . 0.3 OUTLIER -133.7 -166.76 1.83 Allowed 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 118.948 -2.345 . . . . 0.0 113.239 -172.31 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.5 tttp -158.82 109.17 2.03 Favored 'General case' 0 C--N 1.379 1.888 1 CA-C-N 107.828 -4.26 . . . . 0.0 106.632 177.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.676 ' CD2' ' HB1' ' A' ' 25' ' ' ALA . 12.4 m-85 -97.19 132.17 43.22 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-O 122.692 1.234 . . . . 0.0 113.525 166.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 1.5 m -130.45 130.2 65.04 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.547 0 CA-C-N 114.539 -1.21 . . . . 0.0 111.366 170.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.422 ' HB3' ' HB3' ' A' ' 23' ' ' PHE . 4.4 p -132.9 111.16 10.83 Favored 'General case' 0 C--O 1.283 2.863 0 CA-C-O 116.332 -1.794 . . . . 0.0 109.87 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.529 ' O ' ' HG ' ' A' ' 21' ' ' LEU 0.423 1.6 p -108.63 176.81 4.98 Favored 'General case' 0 C--N 1.374 1.638 1 O-C-N 114.589 -5.069 . . . . 0.0 112.966 174.623 . . . . . . . . 4 3 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -78.55 -41.26 32.54 Favored 'General case' 0 N--CA 1.423 -1.803 0 CA-C-N 114.375 -1.284 . . . . 0.0 110.365 -171.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.465 ' O ' ' HB2' ' A' ' 61' ' ' CYS . 0.1 OUTLIER -75.55 144.22 42.02 Favored 'General case' 0 C--O 1.283 2.828 0 CA-C-N 111.045 -2.798 . . . . 0.0 109.164 -159.624 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.598 ' N ' HD22 ' A' ' 1' ' ' LEU . 0.6 OUTLIER -53.58 140.93 27.18 Favored 'General case' 0 C--N 1.394 2.537 1 O-C-N 112.07 -6.644 . . . . 0.0 109.158 -175.88 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.53 10.71 6.05 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 122.62 1.2 . . . . 0.0 111.296 178.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 58' ' ' THR . 0.5 OUTLIER -55.33 -38.59 68.93 Favored 'General case' 0 N--CA 1.42 -1.938 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 -179.728 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.495 ' HB2' ' C ' ' A' ' 23' ' ' PHE . 39.3 p30 . . . . . 0 C--O 1.203 -1.375 0 CA-C-O 126.978 3.275 . . . . 0.0 110.12 -168.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 1' ' ' LEU . . . . . 0.43 ' CD2' ' CG ' ' A' ' 59' ' ' ASP . 3.2 tm? . . . . . 0 CA--C 1.54 0.588 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.463 ' HA ' ' HA ' ' A' ' 14' ' ' THR . 0.0 OUTLIER -122.99 150.01 43.56 Favored 'General case' 0 C--O 1.215 -0.757 0 CA-C-N 111.225 -2.716 . . . . 0.0 107.158 -174.683 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.482 ' O ' ' HB2' ' A' ' 12' ' ' TYR . 1.8 t -155.56 -135.06 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 111.995 -2.366 . . . . 0.0 108.387 -160.353 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.419 ' CD2' ' HB3' ' A' ' 7' ' ' GLN . 0.3 OUTLIER -145.52 152.04 39.11 Favored 'General case' 0 C--N 1.379 1.858 0 O-C-N 117.992 -2.943 . . . . 0.0 110.726 -167.665 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -148.02 -56.31 0.22 Allowed 'General case' 0 C--N 1.359 1.004 0 O-C-N 117.937 -2.977 . . . . 0.0 110.248 168.061 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.65 ' O ' ' N ' ' A' ' 8' ' ' LEU . 2.4 m -67.02 -54.39 22.13 Favored 'General case' 0 CA--C 1.586 2.341 0 CA-C-O 113.696 -3.05 . . . . 0.0 109.762 -176.316 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.563 ' NE2' ' HD3' ' A' ' 38' ' ' ARG 0.516 1.6 pt20 64.06 -54.21 0.25 Allowed 'General case' 0 C--O 1.265 1.918 0 O-C-N 117.757 -3.089 . . . . 0.0 116.551 -175.914 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.65 ' N ' ' O ' ' A' ' 6' ' ' THR . 7.6 tp -52.93 126.76 43.52 Favored Pre-proline 0 CA--C 1.595 2.707 1 O-C-N 115.808 -4.308 . . . . 0.0 104.262 157.548 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.507 ' C ' ' N ' ' A' ' 11' ' ' ILE 0.353 75.6 Cg_exo -23.02 140.14 0.01 OUTLIER 'Trans proline' 0 C--N 1.273 -3.42 1 C-N-CA 129.069 6.513 . . . . 0.0 119.425 -93.627 . . . . . . . . 4 3 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.489 ' CD1' ' C ' ' A' ' 10' ' ' PHE . 0.0 OUTLIER -34.69 -18.7 0.0 OUTLIER 'General case' 0 C--N 1.365 1.281 1 O-C-N 115.668 -4.395 . . . . 0.0 112.753 -177.026 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.507 ' N ' ' C ' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -37.08 117.09 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.432 -1.369 0 CA-C-N 114.362 -1.29 . . . . 0.0 110.557 170.617 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.482 ' HB2' ' O ' ' A' ' 3' ' ' CYS . 0.8 OUTLIER -118.76 -163.01 0.93 Allowed 'General case' 0 CA--C 1.575 1.938 0 O-C-N 118.634 -2.541 . . . . 0.0 108.149 -161.139 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.65 169.35 23.5 Favored 'General case' 0 CA--C 1.586 2.346 0 CA-C-N 109.834 -3.348 . . . . 0.0 107.652 165.4 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.463 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 43.7 m -79.76 155.02 28.12 Favored 'General case' 0 C--O 1.248 1.02 0 CA-C-N 109.574 -3.466 . . . . 0.0 110.471 164.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 42.7 m -69.79 -173.29 0.21 Allowed Pre-proline 0 N--CA 1.425 -1.697 0 CA-C-O 122.85 1.31 . . . . 0.0 112.782 174.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.681 ' HD2' ' CB ' ' A' ' 19' ' ' LYS . 5.8 Cg_exo -116.34 -170.55 0.02 OUTLIER 'Trans proline' 0 CA--C 1.536 0.608 0 CA-C-N 111.855 -1.873 . . . . 0.0 109.064 177.097 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.432 ' CD ' ' N ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -82.84 133.93 35.12 Favored 'General case' 0 C--O 1.213 -0.858 0 CA-C-N 113.849 -1.523 . . . . 0.0 108.953 175.415 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.71 13.75 54.41 Favored Glycine 0 C--N 1.377 2.85 0 CA-C-N 111.034 -2.803 . . . . 0.0 113.372 -175.332 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.681 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 1.2 mmtt -136.88 74.09 1.47 Allowed 'General case' 0 N--CA 1.438 -1.045 0 CA-C-O 124.231 1.967 . . . . 0.0 110.971 -166.761 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.477 ' O ' HD23 ' A' ' 21' ' ' LEU . 0.1 OUTLIER -89.03 -17.98 28.26 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 114.482 -1.236 . . . . 0.0 109.343 -168.305 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.488 ' HB2' ' HB3' ' A' ' 41' ' ' ALA . 16.1 mt -105.46 -156.8 0.59 Allowed 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 127.271 2.228 . . . . 0.0 110.327 -169.586 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.74 ' HA ' ' HA ' ' A' ' 40' ' ' CYS . 62.8 m -161.96 132.67 5.01 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-N 113.812 -1.54 . . . . 0.0 110.808 174.582 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.475 ' HB3' ' HB3' ' A' ' 55' ' ' CYS 0.259 0.1 OUTLIER -128.06 -178.59 4.59 Favored 'General case' 0 CA--C 1.601 2.931 1 O-C-N 114.78 -4.95 . . . . 0.0 106.519 175.48 . . . . . . . . 5 4 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.482 ' HA ' ' HA ' ' A' ' 38' ' ' ARG . 2.1 pttt -165.13 154.22 12.49 Favored 'General case' 0 N--CA 1.426 -1.631 1 CA-C-N 103.954 -6.021 . . . . 0.0 105.231 173.947 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.717 ' HB2' ' CG ' ' A' ' 53' ' ' TYR 0.317 . . -134.35 178.53 6.91 Favored 'General case' 0 N--CA 1.415 -2.214 0 CA-C-N 111.511 -2.586 . . . . 0.0 112.805 172.212 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.696 ' HA ' ' N ' ' A' ' 36' ' ' VAL . 67.9 p -152.42 162.98 40.42 Favored 'General case' 0 C--O 1.279 2.625 0 CA-C-N 112.106 -2.315 . . . . 0.0 110.77 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.481 1.088 1 O-C-N 116.282 -4.011 . . . . 0.0 109.983 -173.671 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.56 1.346 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.66 ' HA ' ' CB ' ' A' ' 26' ' ' THR . 27.5 Cg_exo 43.39 -167.75 0.0 OUTLIER 'Trans proline' 0 CA--C 1.463 -3.045 0 O-C-N 124.91 2.005 . . . . 0.0 116.04 171.383 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.912 HG21 HD11 ' A' ' 51' ' ' LEU . 0.5 OUTLIER -126.93 -72.04 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.368 1.407 0 O-C-N 117.309 -3.369 . . . . 0.0 112.29 -175.452 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.655 ' N ' ' CG1' ' A' ' 36' ' ' VAL . 35.8 mttm -153.84 167.49 29.49 Favored 'General case' 0 N--CA 1.419 -1.976 0 CA-C-N 111.159 -2.746 . . . . 0.0 108.281 -166.409 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.563 ' HD3' ' NE2' ' A' ' 7' ' ' GLN . 0.0 OUTLIER -169.5 175.71 5.33 Favored 'General case' 0 C--O 1.198 -1.649 0 O-C-N 117.998 -2.939 . . . . 0.0 108.995 167.101 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.437 ' O ' ' ND2' ' A' ' 62' ' ' ASN . . . 163.0 -158.44 30.74 Favored Glycine 0 N--CA 1.427 -1.953 0 CA-C-N 111.858 -2.428 . . . . 0.0 109.5 -166.72 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.74 ' HA ' ' HA ' ' A' ' 22' ' ' CYS . 76.1 m -91.04 -174.86 4.13 Favored 'General case' 0 C--O 1.209 -1.068 0 CA-C-O 126.572 3.082 . . . . 0.0 112.384 166.563 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.683 ' HB3' ' N ' ' A' ' 22' ' ' CYS . . . -147.96 -178.79 6.47 Favored 'General case' 0 C--O 1.251 1.145 0 CA-C-N 110.545 -3.025 . . . . 0.0 109.718 -159.446 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -164.3 -73.41 0.04 OUTLIER 'General case' 0 N--CA 1.427 -1.6 0 O-C-N 120.264 -1.522 . . . . 0.0 111.403 -164.686 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -88.05 -99.75 0.08 Allowed 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 114.867 -1.061 . . . . 0.0 108.198 170.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.415 ' O ' ' O ' ' A' ' 45' ' ' PRO . 0.1 OUTLIER 175.24 107.33 0.09 OUTLIER Pre-proline 0 C--N 1.314 -0.948 0 C-N-CA 125.292 1.437 . . . . 0.0 108.45 175.754 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.418 ' HB2' ' CB ' ' A' ' 53' ' ' TYR . 47.8 Cg_exo -45.1 166.93 0.04 OUTLIER 'Trans proline' 0 N--CA 1.438 -1.77 0 C-N-CA 123.955 3.104 . . . . 0.0 117.711 -161.604 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.9 tmtt? -100.52 76.87 1.87 Allowed 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 110.569 -3.014 . . . . 0.0 110.991 176.627 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.426 ' OD1' ' HB2' ' A' ' 53' ' ' TYR . 0.1 OUTLIER -37.81 162.34 0.0 OUTLIER 'General case' 0 C--O 1.253 1.254 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 -178.272 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 48' ' ' SER . . . . . 0.641 ' OG ' ' N ' ' A' ' 49' ' ' ALA . 0.1 OUTLIER -109.75 -166.75 1.12 Allowed 'General case' 0 C--N 1.366 1.289 1 O-C-N 115.621 -4.425 . . . . 0.0 115.397 -162.228 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.641 ' N ' ' OG ' ' A' ' 48' ' ' SER . . . -68.56 -13.3 62.24 Favored 'General case' 0 N--CA 1.412 -2.372 0 O-C-N 119.164 -2.21 . . . . 0.0 114.517 174.317 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 3.2 mt -162.06 22.71 0.11 Allowed 'General case' 0 C--O 1.258 1.539 0 CA-C-N 110.081 -3.236 . . . . 0.0 110.746 -170.598 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.912 HD11 HG21 ' A' ' 36' ' ' VAL . 0.6 OUTLIER -133.38 -168.13 2.04 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 120.619 -1.3 . . . . 0.0 110.159 -176.484 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.598 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.4 OUTLIER -151.39 142.04 22.72 Favored 'General case' 0 C--N 1.374 1.657 0 CA-C-N 108.511 -3.949 . . . . 0.0 108.963 169.162 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.717 ' CG ' ' HB2' ' A' ' 25' ' ' ALA . 7.8 m-85 -128.92 151.3 49.8 Favored 'General case' 0 C--O 1.22 -0.448 0 O-C-N 119.688 -1.883 . . . . 0.0 111.226 170.274 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 1.8 m -146.66 148.23 17.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 114.167 -1.379 . . . . 0.0 109.97 174.067 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.475 ' HB3' ' HB3' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -145.99 123.06 11.44 Favored 'General case' 0 C--O 1.252 1.219 0 O-C-N 121.031 -1.043 . . . . 0.0 113.265 -170.46 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.54 ' HB3' ' HB3' ' A' ' 61' ' ' CYS . 0.5 OUTLIER -94.2 -165.54 1.33 Allowed 'General case' 0 N--CA 1.423 -1.781 0 O-C-N 118.828 -2.42 . . . . 0.0 112.519 -176.973 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -121.22 -33.5 3.68 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 112.23 -2.259 . . . . 0.0 111.53 -176.58 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.637 HG23 ' SG ' ' A' ' 61' ' ' CYS . 0.1 OUTLIER -101.9 -178.38 3.7 Favored 'General case' 0 C--O 1.209 -1.047 0 CA-C-O 125.461 2.553 . . . . 0.0 108.487 -167.549 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.575 ' O ' ' HG2' ' A' ' 60' ' ' LYS 0.321 0.0 OUTLIER -72.57 127.02 31.28 Favored 'General case' 0 N--CA 1.416 -2.135 0 CA-C-N 111.884 -2.416 . . . . 0.0 112.716 -168.95 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.575 ' HG2' ' O ' ' A' ' 59' ' ' ASP . 0.1 OUTLIER 59.87 25.53 14.64 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 117.32 -1.752 . . . . 0.0 107.631 175.062 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.637 ' SG ' HG23 ' A' ' 58' ' ' THR . 5.2 t -75.95 -31.22 58.97 Favored 'General case' 0 C--O 1.253 1.248 0 CA-C-N 111.969 -2.378 . . . . 0.0 111.379 -175.384 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.44 ' CG ' ' HB3' ' A' ' 22' ' ' CYS . 0.3 OUTLIER . . . . . 0 C--O 1.247 0.958 0 O-C-N 120.018 -1.676 . . . . 0.0 108.736 -176.838 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 1' ' ' LEU . . . . . 0.615 HD21 ' N ' ' A' ' 59' ' ' ASP . 1.7 tm? . . . . . 0 C--O 1.244 0.78 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.521 ' N ' HD13 ' A' ' 1' ' ' LEU . 0.0 OUTLIER -125.08 151.49 45.6 Favored 'General case' 0 C--O 1.167 -3.281 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 -177.426 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 12' ' ' TYR . 3.0 t -169.16 -149.26 0.08 Allowed 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 108.914 -3.766 . . . . 0.0 108.111 -158.803 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 28.2 m80 -135.75 134.38 38.97 Favored 'General case' 0 C--N 1.359 0.993 0 O-C-N 118.993 -2.317 . . . . 0.0 110.241 -164.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ASN . . . . . 0.587 ' HB3' ' HA2' ' A' ' 39' ' ' GLY . 8.7 p30 -126.17 -53.88 1.5 Allowed 'General case' 0 N--CA 1.444 -0.763 0 O-C-N 119.942 -1.724 . . . . 0.0 110.013 169.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.609 ' O ' ' N ' ' A' ' 8' ' ' LEU . 4.3 m -69.24 -52.79 24.19 Favored 'General case' 0 CA--C 1.586 2.362 0 CA-C-O 116.336 -1.792 . . . . 0.0 106.31 -177.609 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLN . . . . . 0.484 ' HG2' ' C ' ' A' ' 6' ' ' THR 0.361 1.1 pt20 58.07 -46.43 0.05 OUTLIER 'General case' 0 N--CA 1.423 -1.809 0 CA-C-N 111.001 -2.818 . . . . 0.0 118.499 -172.602 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.609 ' N ' ' O ' ' A' ' 6' ' ' THR . 23.6 tp -52.02 124.52 29.37 Favored Pre-proline 0 N--CA 1.424 -1.769 0 O-C-N 116.886 -3.633 . . . . 0.0 109.097 160.285 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.434 ' HD2' ' HG ' ' A' ' 8' ' ' LEU 0.503 50.3 Cg_exo -14.85 153.14 0.0 OUTLIER 'Trans proline' 0 C--N 1.274 -3.359 1 C-N-CA 126.06 4.507 . . . . 0.0 117.037 -92.682 . . . . . . . . 4 3 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.499 ' O ' ' C ' ' A' ' 11' ' ' ILE . 9.1 m-30 -52.18 -11.57 0.19 Allowed 'General case' 0 C--O 1.255 1.383 0 O-C-N 118.309 -2.745 . . . . 0.0 113.125 -172.629 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.499 ' C ' ' O ' ' A' ' 10' ' ' PHE . 0.1 OUTLIER -44.66 110.56 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 CA-C-N 114.284 -1.325 . . . . 0.0 107.459 171.787 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 12' ' ' TYR . . . . . 0.508 ' CD2' ' N ' ' A' ' 12' ' ' TYR . 0.4 OUTLIER -114.06 -161.99 0.79 Allowed 'General case' 0 C--N 1.311 -1.104 0 C-N-CA 126.745 2.018 . . . . 0.0 108.492 -166.779 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.8 tttp -159.08 170.0 23.0 Favored 'General case' 0 C--O 1.202 -1.399 0 CA-C-N 113.041 -1.891 . . . . 0.0 109.108 170.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.476 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 53.3 m -92.11 120.14 32.43 Favored 'General case' 0 C--O 1.263 1.791 0 CA-C-N 109.144 -3.662 . . . . 0.0 112.566 173.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.493 ' HB3' ' HB3' ' A' ' 40' ' ' CYS . 0.5 OUTLIER -105.09 139.15 19.83 Favored Pre-proline 0 CA--C 1.484 -1.582 0 O-C-N 118.508 -2.62 . . . . 0.0 113.32 -175.309 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.505 ' HD3' ' SG ' ' A' ' 40' ' ' CYS . 6.0 Cg_endo -123.31 -174.33 0.01 OUTLIER 'Trans proline' 0 CA--C 1.543 0.934 0 O-C-N 117.545 -1.871 . . . . 0.0 110.732 -115.637 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.9 129.14 16.92 Favored 'General case' 0 C--N 1.358 0.937 0 CA-C-O 126.48 3.038 . . . . 0.0 113.228 -174.218 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 85.56 -8.37 72.26 Favored Glycine 0 N--CA 1.422 -2.241 0 CA-C-N 110.742 -2.936 . . . . 0.0 110.116 -175.375 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.588 ' HG2' ' HB2' ' A' ' 40' ' ' CYS . 18.0 tptt -139.18 69.03 1.37 Allowed 'General case' 0 CA--C 1.571 1.783 0 N-CA-C 103.908 -2.627 . . . . 0.0 103.908 -172.626 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -67.79 -46.01 73.18 Favored 'General case' 0 CA--C 1.567 1.61 0 CA-C-N 109.923 -3.308 . . . . 0.0 110.709 -163.727 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.567 HD23 ' SG ' ' A' ' 55' ' ' CYS . 0.3 OUTLIER -82.27 173.56 11.97 Favored 'General case' 0 C--O 1.214 -0.776 0 CA-C-N 110.213 -3.176 . . . . 0.0 108.919 -170.282 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 7.1 p -126.36 131.48 51.78 Favored 'General case' 0 C--O 1.258 1.522 0 CA-C-N 113.538 -1.665 . . . . 0.0 113.038 165.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.565 ' C ' ' HB2' ' A' ' 62' ' ' ASN 0.361 0.1 OUTLIER -113.04 175.12 5.57 Favored 'General case' 0 CA--C 1.622 3.723 0 O-C-N 117.798 -3.064 . . . . 0.0 106.21 -176.221 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.537 ' HA ' ' HA ' ' A' ' 38' ' ' ARG . 0.4 OUTLIER -162.19 147.23 12.69 Favored 'General case' 0 N--CA 1.418 -2.065 1 CA-C-N 105.201 -5.454 . . . . 0.0 105.639 162.691 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.847 ' HB2' ' CD2' ' A' ' 53' ' ' TYR . . . -131.89 127.58 36.77 Favored 'General case' 0 C--N 1.392 2.418 1 CA-C-N 108.087 -4.142 . . . . 0.0 110.587 177.304 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.9 HG23 ' HB ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -101.83 169.06 9.04 Favored 'General case' 0 C--O 1.267 1.974 0 CA-C-N 112.799 -2.0 . . . . 0.0 111.855 179.618 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mt . . . . . 0 C--O 1.247 0.932 0 O-C-N 118.359 -2.713 . . . . 0.0 108.184 173.533 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.659 ' N ' ' CD ' ' A' ' 35' ' ' PRO . 91.9 t80 . . . . . 0 CA--C 1.5 -0.975 0 CA-C-O 123.891 1.805 . . . . 0.0 112.702 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.659 ' CD ' ' N ' ' A' ' 34' ' ' PHE . 9.8 Cg_exo -75.29 104.4 1.9 Allowed 'Trans proline' 0 C--N 1.373 1.839 0 CA-C-N 112.685 -1.577 . . . . 0.0 113.15 158.399 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.9 ' HB ' HG23 ' A' ' 26' ' ' THR . 1.8 p -122.95 161.51 24.31 Favored 'Isoleucine or valine' 0 C--N 1.393 2.495 0 CA-C-N 108.696 -3.866 . . . . 0.0 115.916 167.188 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.508 ' N ' ' CG2' ' A' ' 36' ' ' VAL . 3.2 mttp -126.59 156.25 41.2 Favored 'General case' 0 C--O 1.27 2.167 0 C-N-CA 128.505 2.722 . . . . 0.0 108.861 163.762 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.544 ' N ' ' HD2' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -158.01 -166.88 2.07 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 116.517 -3.865 . . . . 0.0 109.859 173.841 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLY . . . . . 0.587 ' HA2' ' HB3' ' A' ' 5' ' ' ASN . . . 140.44 -156.75 25.36 Favored Glycine 0 C--N 1.364 2.085 0 CA-C-N 110.513 -3.04 . . . . 0.0 110.224 -169.81 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' CYS . . . . . 0.588 ' HB2' ' HG2' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -82.32 -176.89 6.43 Favored 'General case' 0 N--CA 1.416 -2.13 0 CA-C-N 112.442 -1.879 . . . . 0.0 111.971 176.827 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -166.92 -172.43 2.07 Favored 'General case' 0 C--N 1.408 3.111 1 CA-C-N 106.462 -4.881 . . . . 0.0 110.922 -159.587 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -175.86 -74.7 0.01 OUTLIER 'General case' 0 C--N 1.366 1.311 1 O-C-N 116.002 -4.186 . . . . 0.0 111.341 -162.47 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -81.65 -68.55 0.68 Allowed 'General case' 0 CA--C 1.562 1.425 0 C-N-CA 124.26 1.024 . . . . 0.0 109.332 170.148 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.2 m 138.27 54.83 0.0 OUTLIER Pre-proline 0 N--CA 1.426 -1.649 0 CA-C-N 111.904 -2.407 . . . . 0.0 110.686 -171.496 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.665 ' HB2' ' CG ' ' A' ' 53' ' ' TYR . 0.3 OUTLIER 20.75 171.99 0.0 OUTLIER 'Trans proline' 0 CA--C 1.474 -2.492 0 N-CA-C 119.51 2.85 . . . . 0.0 119.51 -173.267 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.476 ' O ' ' C ' ' A' ' 47' ' ' ASN . 0.0 OUTLIER -99.97 87.14 3.42 Favored 'General case' 0 N--CA 1.423 -1.776 0 O-C-N 118.017 -2.927 . . . . 0.0 109.834 165.263 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASN . . . . . 0.584 ' OD1' ' HB2' ' A' ' 53' ' ' TYR . 0.5 OUTLIER -37.67 134.12 0.73 Allowed 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 174.53 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.0 t -81.04 -151.75 0.08 Allowed 'General case' 0 CA--C 1.488 -1.437 0 N-CA-C 116.769 2.136 . . . . 0.0 116.769 -168.046 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.538 ' O ' ' HB2' ' A' ' 50' ' ' LEU . . . -84.69 -2.44 57.56 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 119.763 -1.836 . . . . 0.0 110.654 -169.582 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.538 ' HB2' ' O ' ' A' ' 49' ' ' ALA . 17.8 tp -165.76 35.92 0.05 Allowed 'General case' 0 C--N 1.392 2.416 0 CA-C-N 109.151 -3.659 . . . . 0.0 112.965 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.81 ' CD2' ' HB1' ' A' ' 25' ' ' ALA . 0.3 OUTLIER -133.7 -166.76 1.83 Allowed 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 118.948 -2.345 . . . . 0.0 113.239 -172.31 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.412 ' H ' ' CG ' ' A' ' 51' ' ' LEU . 1.5 tttp -158.82 109.17 2.03 Favored 'General case' 0 C--N 1.379 1.888 1 CA-C-N 107.828 -4.26 . . . . 0.0 106.632 177.705 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.847 ' CD2' ' HB2' ' A' ' 25' ' ' ALA . 12.4 m-85 -97.19 132.17 43.22 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-O 122.692 1.234 . . . . 0.0 113.525 166.523 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 1.5 m -130.45 130.2 65.04 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.547 0 CA-C-N 114.539 -1.21 . . . . 0.0 111.366 170.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.567 ' SG ' HD23 ' A' ' 21' ' ' LEU . 4.4 p -132.9 111.16 10.83 Favored 'General case' 0 C--O 1.283 2.863 0 CA-C-O 116.332 -1.794 . . . . 0.0 109.87 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' CYS . . . . . 0.522 ' O ' ' HG ' ' A' ' 21' ' ' LEU 0.423 1.6 p -108.63 176.81 4.98 Favored 'General case' 0 C--N 1.374 1.638 1 O-C-N 114.589 -5.069 . . . . 0.0 112.966 174.623 . . . . . . . . 4 3 . 1 . 002 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -78.55 -41.26 32.54 Favored 'General case' 0 N--CA 1.423 -1.803 0 CA-C-N 114.375 -1.284 . . . . 0.0 110.365 -171.79 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.498 ' O ' ' HB2' ' A' ' 61' ' ' CYS . 0.1 OUTLIER -75.55 144.22 42.02 Favored 'General case' 0 C--O 1.283 2.828 0 CA-C-N 111.045 -2.798 . . . . 0.0 109.164 -159.624 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.615 ' N ' HD21 ' A' ' 1' ' ' LEU . 0.6 OUTLIER -53.58 140.93 27.18 Favored 'General case' 0 C--N 1.394 2.537 1 O-C-N 112.07 -6.644 . . . . 0.0 109.158 -175.88 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.53 10.71 6.05 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 122.62 1.2 . . . . 0.0 111.296 178.295 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.498 ' HB2' ' O ' ' A' ' 58' ' ' THR . 0.5 OUTLIER -55.33 -38.59 68.93 Favored 'General case' 0 N--CA 1.42 -1.938 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 -179.728 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.565 ' HB2' ' C ' ' A' ' 23' ' ' PHE . 39.3 p30 . . . . . 0 C--O 1.203 -1.375 0 CA-C-O 126.978 3.275 . . . . 0.0 110.12 -168.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.43 ' CD2' ' CG ' ' A' ' 59' ' ' ASP . 3.2 tm? . . . . . 0 CA--C 1.54 0.588 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.463 ' HA ' ' HA ' ' A' ' 14' ' ' THR . 0.0 OUTLIER -122.99 150.01 43.56 Favored 'General case' 0 C--O 1.215 -0.757 0 CA-C-N 111.225 -2.716 . . . . 0.0 107.158 -174.683 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.482 ' O ' ' HB2' ' A' ' 12' ' ' TYR . 1.8 t -155.56 -135.06 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 111.995 -2.366 . . . . 0.0 108.387 -160.353 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.419 ' CD2' ' HB3' ' A' ' 7' ' ' GLN . 0.3 OUTLIER -145.52 152.04 39.11 Favored 'General case' 0 C--N 1.379 1.858 0 O-C-N 117.992 -2.943 . . . . 0.0 110.726 -167.665 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -148.02 -56.31 0.22 Allowed 'General case' 0 C--N 1.359 1.004 0 O-C-N 117.937 -2.977 . . . . 0.0 110.248 168.061 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.65 ' O ' ' N ' ' A' ' 8' ' ' LEU . 2.4 m -67.02 -54.39 22.13 Favored 'General case' 0 CA--C 1.586 2.341 0 CA-C-O 113.696 -3.05 . . . . 0.0 109.762 -176.316 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.563 ' NE2' ' HD3' ' A' ' 38' ' ' ARG 0.516 1.6 pt20 64.06 -54.21 0.25 Allowed 'General case' 0 C--O 1.265 1.918 0 O-C-N 117.757 -3.089 . . . . 0.0 116.551 -175.914 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.65 ' N ' ' O ' ' A' ' 6' ' ' THR . 7.6 tp -52.93 126.76 43.52 Favored Pre-proline 0 CA--C 1.595 2.707 1 O-C-N 115.808 -4.308 . . . . 0.0 104.262 157.548 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.507 ' C ' ' N ' ' A' ' 11' ' ' ILE 0.353 75.6 Cg_exo -23.02 140.14 0.01 OUTLIER 'Trans proline' 0 C--N 1.273 -3.42 1 C-N-CA 129.069 6.513 . . . . 0.0 119.425 -93.627 . . . . . . . . 4 3 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.489 ' CD1' ' C ' ' A' ' 10' ' ' PHE . 0.0 OUTLIER -34.69 -18.7 0.0 OUTLIER 'General case' 0 C--N 1.365 1.281 1 O-C-N 115.668 -4.395 . . . . 0.0 112.753 -177.026 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.507 ' N ' ' C ' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -37.08 117.09 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.432 -1.369 0 CA-C-N 114.362 -1.29 . . . . 0.0 110.557 170.617 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.482 ' HB2' ' O ' ' A' ' 3' ' ' CYS . 0.8 OUTLIER -118.76 -163.01 0.93 Allowed 'General case' 0 CA--C 1.575 1.938 0 O-C-N 118.634 -2.541 . . . . 0.0 108.149 -161.139 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.65 169.35 23.5 Favored 'General case' 0 CA--C 1.586 2.346 0 CA-C-N 109.834 -3.348 . . . . 0.0 107.652 165.4 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.463 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 43.7 m -79.76 155.02 28.12 Favored 'General case' 0 C--O 1.248 1.02 0 CA-C-N 109.574 -3.466 . . . . 0.0 110.471 164.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 42.7 m -69.79 -173.29 0.21 Allowed Pre-proline 0 N--CA 1.425 -1.697 0 CA-C-O 122.85 1.31 . . . . 0.0 112.782 174.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.681 ' HD2' ' CB ' ' A' ' 19' ' ' LYS . 5.8 Cg_exo -116.34 -170.55 0.02 OUTLIER 'Trans proline' 0 CA--C 1.536 0.608 0 CA-C-N 111.855 -1.873 . . . . 0.0 109.064 177.097 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.432 ' CD ' ' N ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -82.84 133.93 35.12 Favored 'General case' 0 C--O 1.213 -0.858 0 CA-C-N 113.849 -1.523 . . . . 0.0 108.953 175.415 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.71 13.75 54.41 Favored Glycine 0 C--N 1.377 2.85 0 CA-C-N 111.034 -2.803 . . . . 0.0 113.372 -175.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.681 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 1.2 mmtt -136.88 74.09 1.47 Allowed 'General case' 0 N--CA 1.438 -1.045 0 CA-C-O 124.231 1.967 . . . . 0.0 110.971 -166.761 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.477 ' O ' HD23 ' A' ' 21' ' ' LEU . 0.1 OUTLIER -89.03 -17.98 28.26 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 114.482 -1.236 . . . . 0.0 109.343 -168.305 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.488 ' HB2' ' HB3' ' A' ' 41' ' ' ALA . 16.1 mt -105.46 -156.8 0.59 Allowed 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 127.271 2.228 . . . . 0.0 110.327 -169.586 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.74 ' HA ' ' HA ' ' A' ' 40' ' ' CYS . 62.8 m -161.96 132.67 5.01 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-N 113.812 -1.54 . . . . 0.0 110.808 174.582 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.475 ' HB3' ' HB3' ' A' ' 55' ' ' CYS 0.259 0.1 OUTLIER -128.06 -178.59 4.59 Favored 'General case' 0 CA--C 1.601 2.931 1 O-C-N 114.78 -4.95 . . . . 0.0 106.519 175.48 . . . . . . . . 5 4 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.482 ' HA ' ' HA ' ' A' ' 38' ' ' ARG . 2.1 pttt -165.13 154.22 12.49 Favored 'General case' 0 N--CA 1.426 -1.631 1 CA-C-N 103.954 -6.021 . . . . 0.0 105.231 173.947 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.717 ' HB2' ' CG ' ' A' ' 53' ' ' TYR 0.317 . . -134.35 178.53 6.91 Favored 'General case' 0 N--CA 1.415 -2.214 0 CA-C-N 111.511 -2.586 . . . . 0.0 112.805 172.212 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.696 ' HA ' ' N ' ' A' ' 36' ' ' VAL . 67.9 p -152.42 162.98 40.42 Favored 'General case' 0 C--O 1.279 2.625 0 CA-C-N 112.106 -2.315 . . . . 0.0 110.77 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -111.78 147.96 34.56 Favored 'General case' 0 N--CA 1.481 1.088 1 O-C-N 116.282 -4.011 . . . . 0.0 109.983 -173.671 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.25 47.79 1.39 Allowed 'General case' 0 C--O 1.217 -0.644 0 CA-C-O 123.988 1.851 . . . . 0.0 109.868 172.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -61.95 -69.41 0.25 Allowed 'General case' 0 C--O 1.242 0.691 0 CA-C-N 113.511 -1.677 . . . . 0.0 112.471 176.121 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.624 ' CD2' HD12 ' A' ' 32' ' ' LEU . 0.4 OUTLIER -122.23 139.48 30.69 Favored Pre-proline 0 C--N 1.359 1.006 0 O-C-N 118.312 -2.743 . . . . 0.0 108.573 -167.897 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.448 ' O ' ' HB2' ' A' ' 32' ' ' LEU . 40.2 Cg_exo -57.63 76.93 0.04 OUTLIER 'Trans proline' 0 C--O 1.247 0.96 0 CA-C-N 113.783 -1.185 . . . . 0.0 110.922 173.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.676 ' C ' HD22 ' A' ' 32' ' ' LEU 0.354 0.0 OUTLIER 150.94 -74.98 0.0 OUTLIER 'General case' 0 N--CA 1.531 3.598 2 O-C-N 114.628 -5.045 . . . . 0.0 101.501 -160.654 . . . . . . . . 5 4 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.572 ' N ' HD22 ' A' ' 32' ' ' LEU . 1.3 pttm 81.69 -176.26 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.454 0 CA-C-N 109.634 -3.439 . . . . 0.0 114.392 164.348 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -160.11 38.8 0.06 OUTLIER Pre-proline 0 CA--C 1.56 1.346 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 -162.675 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.66 ' HA ' ' CB ' ' A' ' 26' ' ' THR . 27.5 Cg_exo 43.39 -167.75 0.0 OUTLIER 'Trans proline' 0 CA--C 1.463 -3.045 0 O-C-N 124.91 2.005 . . . . 0.0 116.04 171.383 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.912 HG21 HD11 ' A' ' 51' ' ' LEU . 0.5 OUTLIER -126.93 -72.04 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.368 1.407 0 O-C-N 117.309 -3.369 . . . . 0.0 112.29 -175.452 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.655 ' N ' ' CG1' ' A' ' 36' ' ' VAL . 35.8 mttm -153.84 167.49 29.49 Favored 'General case' 0 N--CA 1.419 -1.976 0 CA-C-N 111.159 -2.746 . . . . 0.0 108.281 -166.409 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.563 ' HD3' ' NE2' ' A' ' 7' ' ' GLN . 0.0 OUTLIER -169.5 175.71 5.33 Favored 'General case' 0 C--O 1.198 -1.649 0 O-C-N 117.998 -2.939 . . . . 0.0 108.995 167.101 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.437 ' O ' ' ND2' ' A' ' 62' ' ' ASN . . . 163.0 -158.44 30.74 Favored Glycine 0 N--CA 1.427 -1.953 0 CA-C-N 111.858 -2.428 . . . . 0.0 109.5 -166.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.74 ' HA ' ' HA ' ' A' ' 22' ' ' CYS . 76.1 m -91.04 -174.86 4.13 Favored 'General case' 0 C--O 1.209 -1.068 0 CA-C-O 126.572 3.082 . . . . 0.0 112.384 166.563 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.683 ' HB3' ' N ' ' A' ' 22' ' ' CYS . . . -147.96 -178.79 6.47 Favored 'General case' 0 C--O 1.251 1.145 0 CA-C-N 110.545 -3.025 . . . . 0.0 109.718 -159.446 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -164.3 -73.41 0.04 OUTLIER 'General case' 0 N--CA 1.427 -1.6 0 O-C-N 120.264 -1.522 . . . . 0.0 111.403 -164.686 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -88.05 -99.75 0.08 Allowed 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 114.867 -1.061 . . . . 0.0 108.198 170.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.415 ' O ' ' O ' ' A' ' 45' ' ' PRO . 0.1 OUTLIER 175.24 107.33 0.09 OUTLIER Pre-proline 0 C--N 1.314 -0.948 0 C-N-CA 125.292 1.437 . . . . 0.0 108.45 175.754 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.418 ' HB2' ' CB ' ' A' ' 53' ' ' TYR . 47.8 Cg_exo -45.1 166.93 0.04 OUTLIER 'Trans proline' 0 N--CA 1.438 -1.77 0 C-N-CA 123.955 3.104 . . . . 0.0 117.711 -161.604 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.9 tmtt? -100.52 76.87 1.87 Allowed 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 110.569 -3.014 . . . . 0.0 110.991 176.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.426 ' OD1' ' HB2' ' A' ' 53' ' ' TYR . 0.1 OUTLIER -37.81 162.34 0.0 OUTLIER 'General case' 0 C--O 1.253 1.254 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 -178.272 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 48' ' ' SER . . . . . 0.641 ' OG ' ' N ' ' A' ' 49' ' ' ALA . 0.1 OUTLIER -109.75 -166.75 1.12 Allowed 'General case' 0 C--N 1.366 1.289 1 O-C-N 115.621 -4.425 . . . . 0.0 115.397 -162.228 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.641 ' N ' ' OG ' ' A' ' 48' ' ' SER . . . -68.56 -13.3 62.24 Favored 'General case' 0 N--CA 1.412 -2.372 0 O-C-N 119.164 -2.21 . . . . 0.0 114.517 174.317 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 3.2 mt -162.06 22.71 0.11 Allowed 'General case' 0 C--O 1.258 1.539 0 CA-C-N 110.081 -3.236 . . . . 0.0 110.746 -170.598 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.912 HD11 HG21 ' A' ' 36' ' ' VAL . 0.6 OUTLIER -133.38 -168.13 2.04 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 120.619 -1.3 . . . . 0.0 110.159 -176.484 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.598 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.4 OUTLIER -151.39 142.04 22.72 Favored 'General case' 0 C--N 1.374 1.657 0 CA-C-N 108.511 -3.949 . . . . 0.0 108.963 169.162 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.717 ' CG ' ' HB2' ' A' ' 25' ' ' ALA . 7.8 m-85 -128.92 151.3 49.8 Favored 'General case' 0 C--O 1.22 -0.448 0 O-C-N 119.688 -1.883 . . . . 0.0 111.226 170.274 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 1.8 m -146.66 148.23 17.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 114.167 -1.379 . . . . 0.0 109.97 174.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.475 ' HB3' ' HB3' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -145.99 123.06 11.44 Favored 'General case' 0 C--O 1.252 1.219 0 O-C-N 121.031 -1.043 . . . . 0.0 113.265 -170.46 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.54 ' HB3' ' HB3' ' A' ' 61' ' ' CYS . 0.5 OUTLIER -94.2 -165.54 1.33 Allowed 'General case' 0 N--CA 1.423 -1.781 0 O-C-N 118.828 -2.42 . . . . 0.0 112.519 -176.973 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -121.22 -33.5 3.68 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 112.23 -2.259 . . . . 0.0 111.53 -176.58 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.637 HG23 ' SG ' ' A' ' 61' ' ' CYS . 0.1 OUTLIER -101.9 -178.38 3.7 Favored 'General case' 0 C--O 1.209 -1.047 0 CA-C-O 125.461 2.553 . . . . 0.0 108.487 -167.549 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.575 ' O ' ' HG2' ' A' ' 60' ' ' LYS 0.321 0.0 OUTLIER -72.57 127.02 31.28 Favored 'General case' 0 N--CA 1.416 -2.135 0 CA-C-N 111.884 -2.416 . . . . 0.0 112.716 -168.95 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.575 ' HG2' ' O ' ' A' ' 59' ' ' ASP . 0.1 OUTLIER 59.87 25.53 14.64 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 117.32 -1.752 . . . . 0.0 107.631 175.062 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.637 ' SG ' HG23 ' A' ' 58' ' ' THR . 5.2 t -75.95 -31.22 58.97 Favored 'General case' 0 C--O 1.253 1.248 0 CA-C-N 111.969 -2.378 . . . . 0.0 111.379 -175.384 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.44 ' CG ' ' HB3' ' A' ' 22' ' ' CYS . 0.3 OUTLIER . . . . . 0 C--O 1.247 0.958 0 O-C-N 120.018 -1.676 . . . . 0.0 108.736 -176.838 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.615 HD21 ' N ' ' A' ' 59' ' ' ASP . 1.7 tm? . . . . . 0 C--O 1.244 0.78 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.521 ' N ' HD13 ' A' ' 1' ' ' LEU . 0.0 OUTLIER -125.08 151.49 45.6 Favored 'General case' 0 C--O 1.167 -3.281 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 -177.426 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 12' ' ' TYR . 3.0 t -169.16 -149.26 0.08 Allowed 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 108.914 -3.766 . . . . 0.0 108.111 -158.803 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 28.2 m80 -135.75 134.38 38.97 Favored 'General case' 0 C--N 1.359 0.993 0 O-C-N 118.993 -2.317 . . . . 0.0 110.241 -164.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASN . . . . . 0.587 ' HB3' ' HA2' ' A' ' 39' ' ' GLY . 8.7 p30 -126.17 -53.88 1.5 Allowed 'General case' 0 N--CA 1.444 -0.763 0 O-C-N 119.942 -1.724 . . . . 0.0 110.013 169.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.609 ' O ' ' N ' ' A' ' 8' ' ' LEU . 4.3 m -69.24 -52.79 24.19 Favored 'General case' 0 CA--C 1.586 2.362 0 CA-C-O 116.336 -1.792 . . . . 0.0 106.31 -177.609 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLN . . . . . 0.484 ' HG2' ' C ' ' A' ' 6' ' ' THR 0.361 1.1 pt20 58.07 -46.43 0.05 OUTLIER 'General case' 0 N--CA 1.423 -1.809 0 CA-C-N 111.001 -2.818 . . . . 0.0 118.499 -172.602 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.609 ' N ' ' O ' ' A' ' 6' ' ' THR . 23.6 tp -52.02 124.52 29.37 Favored Pre-proline 0 N--CA 1.424 -1.769 0 O-C-N 116.886 -3.633 . . . . 0.0 109.097 160.285 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.434 ' HD2' ' HG ' ' A' ' 8' ' ' LEU 0.503 50.3 Cg_exo -14.85 153.14 0.0 OUTLIER 'Trans proline' 0 C--N 1.274 -3.359 1 C-N-CA 126.06 4.507 . . . . 0.0 117.037 -92.682 . . . . . . . . 4 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.499 ' O ' ' C ' ' A' ' 11' ' ' ILE . 9.1 m-30 -52.18 -11.57 0.19 Allowed 'General case' 0 C--O 1.255 1.383 0 O-C-N 118.309 -2.745 . . . . 0.0 113.125 -172.629 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.499 ' C ' ' O ' ' A' ' 10' ' ' PHE . 0.1 OUTLIER -44.66 110.56 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 CA-C-N 114.284 -1.325 . . . . 0.0 107.459 171.787 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.508 ' CD2' ' N ' ' A' ' 12' ' ' TYR . 0.4 OUTLIER -114.06 -161.99 0.79 Allowed 'General case' 0 C--N 1.311 -1.104 0 C-N-CA 126.745 2.018 . . . . 0.0 108.492 -166.779 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.8 tttp -159.08 170.0 23.0 Favored 'General case' 0 C--O 1.202 -1.399 0 CA-C-N 113.041 -1.891 . . . . 0.0 109.108 170.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.476 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 53.3 m -92.11 120.14 32.43 Favored 'General case' 0 C--O 1.263 1.791 0 CA-C-N 109.144 -3.662 . . . . 0.0 112.566 173.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.493 ' HB3' ' HB3' ' A' ' 40' ' ' CYS . 0.5 OUTLIER -105.09 139.15 19.83 Favored Pre-proline 0 CA--C 1.484 -1.582 0 O-C-N 118.508 -2.62 . . . . 0.0 113.32 -175.309 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.505 ' HD3' ' SG ' ' A' ' 40' ' ' CYS . 6.0 Cg_endo -123.31 -174.33 0.01 OUTLIER 'Trans proline' 0 CA--C 1.543 0.934 0 O-C-N 117.545 -1.871 . . . . 0.0 110.732 -115.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.9 129.14 16.92 Favored 'General case' 0 C--N 1.358 0.937 0 CA-C-O 126.48 3.038 . . . . 0.0 113.228 -174.218 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 85.56 -8.37 72.26 Favored Glycine 0 N--CA 1.422 -2.241 0 CA-C-N 110.742 -2.936 . . . . 0.0 110.116 -175.375 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.588 ' HG2' ' HB2' ' A' ' 40' ' ' CYS . 18.0 tptt -139.18 69.03 1.37 Allowed 'General case' 0 CA--C 1.571 1.783 0 N-CA-C 103.908 -2.627 . . . . 0.0 103.908 -172.626 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -67.79 -46.01 73.18 Favored 'General case' 0 CA--C 1.567 1.61 0 CA-C-N 109.923 -3.308 . . . . 0.0 110.709 -163.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.567 HD23 ' SG ' ' A' ' 55' ' ' CYS . 0.3 OUTLIER -82.27 173.56 11.97 Favored 'General case' 0 C--O 1.214 -0.776 0 CA-C-N 110.213 -3.176 . . . . 0.0 108.919 -170.282 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 7.1 p -126.36 131.48 51.78 Favored 'General case' 0 C--O 1.258 1.522 0 CA-C-N 113.538 -1.665 . . . . 0.0 113.038 165.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.565 ' C ' ' HB2' ' A' ' 62' ' ' ASN 0.361 0.1 OUTLIER -113.04 175.12 5.57 Favored 'General case' 0 CA--C 1.622 3.723 0 O-C-N 117.798 -3.064 . . . . 0.0 106.21 -176.221 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.537 ' HA ' ' HA ' ' A' ' 38' ' ' ARG . 0.4 OUTLIER -162.19 147.23 12.69 Favored 'General case' 0 N--CA 1.418 -2.065 1 CA-C-N 105.201 -5.454 . . . . 0.0 105.639 162.691 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.847 ' HB2' ' CD2' ' A' ' 53' ' ' TYR . . . -131.89 127.58 36.77 Favored 'General case' 0 C--N 1.392 2.418 1 CA-C-N 108.087 -4.142 . . . . 0.0 110.587 177.304 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.9 HG23 ' HB ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -101.83 169.06 9.04 Favored 'General case' 0 C--O 1.267 1.974 0 CA-C-N 112.799 -2.0 . . . . 0.0 111.855 179.618 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.43 ' O ' ' N ' ' A' ' 29' ' ' LYS . 1.3 mt -98.34 148.36 23.74 Favored 'General case' 0 C--O 1.247 0.932 0 O-C-N 118.359 -2.713 . . . . 0.0 108.184 173.533 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.95 75.95 0.64 Allowed 'General case' 0 CA--C 1.576 1.973 0 N-CA-C 105.013 -2.218 . . . . 0.0 105.013 171.187 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.751 ' CD ' ' H ' ' A' ' 34' ' ' PHE . 0.0 OUTLIER -86.44 -111.22 0.05 Allowed 'General case' 0 C--O 1.252 1.187 0 CA-C-N 112.726 -2.033 . . . . 0.0 110.33 -173.307 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.414 ' H ' ' CG ' ' A' ' 29' ' ' LYS . 8.0 t80 -154.2 94.1 2.87 Favored Pre-proline 0 C--O 1.259 1.585 0 O-C-N 119.897 -1.752 . . . . 0.0 107.934 -174.13 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.432 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 2.2 Cg_exo -43.11 93.46 0.02 OUTLIER 'Trans proline' 0 C--N 1.3 -1.978 0 C-N-CA 121.794 1.662 . . . . 0.0 112.269 -162.446 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.733 ' C ' HD12 ' A' ' 32' ' ' LEU . 0.2 OUTLIER 152.76 -45.78 0.01 OUTLIER 'General case' 0 C--N 1.38 1.903 0 O-C-N 116.991 -3.568 . . . . 0.0 109.844 -162.632 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.631 ' HB3' ' HD3' ' A' ' 35' ' ' PRO . 0.1 OUTLIER -64.75 -60.99 2.47 Favored 'General case' 0 CA--C 1.554 1.131 0 O-C-N 119.415 -2.053 . . . . 0.0 110.326 -178.917 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.751 ' H ' ' CD ' ' A' ' 29' ' ' LYS . 91.9 t80 73.79 51.02 0.24 Allowed Pre-proline 0 C--N 1.367 1.359 1 CA-C-N 108.225 -4.08 . . . . 0.0 112.702 169.748 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.659 ' CD ' ' N ' ' A' ' 34' ' ' PHE . 9.8 Cg_exo -75.29 104.4 1.9 Allowed 'Trans proline' 0 C--N 1.373 1.839 0 CA-C-N 112.685 -1.577 . . . . 0.0 113.15 158.399 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.9 ' HB ' HG23 ' A' ' 26' ' ' THR . 1.8 p -122.95 161.51 24.31 Favored 'Isoleucine or valine' 0 C--N 1.393 2.495 0 CA-C-N 108.696 -3.866 . . . . 0.0 115.916 167.188 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.508 ' N ' ' CG2' ' A' ' 36' ' ' VAL . 3.2 mttp -126.59 156.25 41.2 Favored 'General case' 0 C--O 1.27 2.167 0 C-N-CA 128.505 2.722 . . . . 0.0 108.861 163.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.544 ' N ' ' HD2' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -158.01 -166.88 2.07 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 116.517 -3.865 . . . . 0.0 109.859 173.841 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.587 ' HA2' ' HB3' ' A' ' 5' ' ' ASN . . . 140.44 -156.75 25.36 Favored Glycine 0 C--N 1.364 2.085 0 CA-C-N 110.513 -3.04 . . . . 0.0 110.224 -169.81 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.588 ' HB2' ' HG2' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -82.32 -176.89 6.43 Favored 'General case' 0 N--CA 1.416 -2.13 0 CA-C-N 112.442 -1.879 . . . . 0.0 111.971 176.827 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -166.92 -172.43 2.07 Favored 'General case' 0 C--N 1.408 3.111 1 CA-C-N 106.462 -4.881 . . . . 0.0 110.922 -159.587 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -175.86 -74.7 0.01 OUTLIER 'General case' 0 C--N 1.366 1.311 1 O-C-N 116.002 -4.186 . . . . 0.0 111.341 -162.47 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -81.65 -68.55 0.68 Allowed 'General case' 0 CA--C 1.562 1.425 0 C-N-CA 124.26 1.024 . . . . 0.0 109.332 170.148 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.2 m 138.27 54.83 0.0 OUTLIER Pre-proline 0 N--CA 1.426 -1.649 0 CA-C-N 111.904 -2.407 . . . . 0.0 110.686 -171.496 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.665 ' HB2' ' CG ' ' A' ' 53' ' ' TYR . 0.3 OUTLIER 20.75 171.99 0.0 OUTLIER 'Trans proline' 0 CA--C 1.474 -2.492 0 N-CA-C 119.51 2.85 . . . . 0.0 119.51 -173.267 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.476 ' O ' ' C ' ' A' ' 47' ' ' ASN . 0.0 OUTLIER -99.97 87.14 3.42 Favored 'General case' 0 N--CA 1.423 -1.776 0 O-C-N 118.017 -2.927 . . . . 0.0 109.834 165.263 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASN . . . . . 0.584 ' OD1' ' HB2' ' A' ' 53' ' ' TYR . 0.5 OUTLIER -37.67 134.12 0.73 Allowed 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 174.53 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.0 t -81.04 -151.75 0.08 Allowed 'General case' 0 CA--C 1.488 -1.437 0 N-CA-C 116.769 2.136 . . . . 0.0 116.769 -168.046 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.538 ' O ' ' HB2' ' A' ' 50' ' ' LEU . . . -84.69 -2.44 57.56 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 119.763 -1.836 . . . . 0.0 110.654 -169.582 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.538 ' HB2' ' O ' ' A' ' 49' ' ' ALA . 17.8 tp -165.76 35.92 0.05 Allowed 'General case' 0 C--N 1.392 2.416 0 CA-C-N 109.151 -3.659 . . . . 0.0 112.965 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.81 ' CD2' ' HB1' ' A' ' 25' ' ' ALA . 0.3 OUTLIER -133.7 -166.76 1.83 Allowed 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 118.948 -2.345 . . . . 0.0 113.239 -172.31 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.412 ' H ' ' CG ' ' A' ' 51' ' ' LEU . 1.5 tttp -158.82 109.17 2.03 Favored 'General case' 0 C--N 1.379 1.888 1 CA-C-N 107.828 -4.26 . . . . 0.0 106.632 177.705 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.847 ' CD2' ' HB2' ' A' ' 25' ' ' ALA . 12.4 m-85 -97.19 132.17 43.22 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-O 122.692 1.234 . . . . 0.0 113.525 166.523 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 1.5 m -130.45 130.2 65.04 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.547 0 CA-C-N 114.539 -1.21 . . . . 0.0 111.366 170.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.567 ' SG ' HD23 ' A' ' 21' ' ' LEU . 4.4 p -132.9 111.16 10.83 Favored 'General case' 0 C--O 1.283 2.863 0 CA-C-O 116.332 -1.794 . . . . 0.0 109.87 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.522 ' O ' ' HG ' ' A' ' 21' ' ' LEU 0.423 1.6 p -108.63 176.81 4.98 Favored 'General case' 0 C--N 1.374 1.638 1 O-C-N 114.589 -5.069 . . . . 0.0 112.966 174.623 . . . . . . . . 4 3 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -78.55 -41.26 32.54 Favored 'General case' 0 N--CA 1.423 -1.803 0 CA-C-N 114.375 -1.284 . . . . 0.0 110.365 -171.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.498 ' O ' ' HB2' ' A' ' 61' ' ' CYS . 0.1 OUTLIER -75.55 144.22 42.02 Favored 'General case' 0 C--O 1.283 2.828 0 CA-C-N 111.045 -2.798 . . . . 0.0 109.164 -159.624 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.615 ' N ' HD21 ' A' ' 1' ' ' LEU . 0.6 OUTLIER -53.58 140.93 27.18 Favored 'General case' 0 C--N 1.394 2.537 1 O-C-N 112.07 -6.644 . . . . 0.0 109.158 -175.88 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.53 10.71 6.05 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 122.62 1.2 . . . . 0.0 111.296 178.295 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.498 ' HB2' ' O ' ' A' ' 58' ' ' THR . 0.5 OUTLIER -55.33 -38.59 68.93 Favored 'General case' 0 N--CA 1.42 -1.938 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 -179.728 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.565 ' HB2' ' C ' ' A' ' 23' ' ' PHE . 39.3 p30 . . . . . 0 C--O 1.203 -1.375 0 CA-C-O 126.978 3.275 . . . . 0.0 110.12 -168.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . 0.43 ' CD2' ' CG ' ' A' ' 59' ' ' ASP . 3.2 tm? . . . . . 0 CA--C 1.54 0.588 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.463 ' HA ' ' HA ' ' A' ' 14' ' ' THR . 0.0 OUTLIER -122.99 150.01 43.56 Favored 'General case' 0 C--O 1.215 -0.757 0 CA-C-N 111.225 -2.716 . . . . 0.0 107.158 -174.683 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.482 ' O ' ' HB2' ' A' ' 12' ' ' TYR . 1.8 t -155.56 -135.06 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 111.995 -2.366 . . . . 0.0 108.387 -160.353 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.419 ' CD2' ' HB3' ' A' ' 7' ' ' GLN . 0.3 OUTLIER -145.52 152.04 39.11 Favored 'General case' 0 C--N 1.379 1.858 0 O-C-N 117.992 -2.943 . . . . 0.0 110.726 -167.665 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -148.02 -56.31 0.22 Allowed 'General case' 0 C--N 1.359 1.004 0 O-C-N 117.937 -2.977 . . . . 0.0 110.248 168.061 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.65 ' O ' ' N ' ' A' ' 8' ' ' LEU . 2.4 m -67.02 -54.39 22.13 Favored 'General case' 0 CA--C 1.586 2.341 0 CA-C-O 113.696 -3.05 . . . . 0.0 109.762 -176.316 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.563 ' NE2' ' HD3' ' A' ' 38' ' ' ARG 0.516 1.6 pt20 64.06 -54.21 0.25 Allowed 'General case' 0 C--O 1.265 1.918 0 O-C-N 117.757 -3.089 . . . . 0.0 116.551 -175.914 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.65 ' N ' ' O ' ' A' ' 6' ' ' THR . 7.6 tp -52.93 126.76 43.52 Favored Pre-proline 0 CA--C 1.595 2.707 1 O-C-N 115.808 -4.308 . . . . 0.0 104.262 157.548 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.507 ' C ' ' N ' ' A' ' 11' ' ' ILE 0.353 75.6 Cg_exo -23.02 140.14 0.01 OUTLIER 'Trans proline' 0 C--N 1.273 -3.42 1 C-N-CA 129.069 6.513 . . . . 0.0 119.425 -93.627 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.489 ' CD1' ' C ' ' A' ' 10' ' ' PHE . 0.0 OUTLIER -34.69 -18.7 0.0 OUTLIER 'General case' 0 C--N 1.365 1.281 1 O-C-N 115.668 -4.395 . . . . 0.0 112.753 -177.026 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.507 ' N ' ' C ' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -37.08 117.09 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.432 -1.369 0 CA-C-N 114.362 -1.29 . . . . 0.0 110.557 170.617 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.482 ' HB2' ' O ' ' A' ' 3' ' ' CYS . 0.8 OUTLIER -118.76 -163.01 0.93 Allowed 'General case' 0 CA--C 1.575 1.938 0 O-C-N 118.634 -2.541 . . . . 0.0 108.149 -161.139 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.65 169.35 23.5 Favored 'General case' 0 CA--C 1.586 2.346 0 CA-C-N 109.834 -3.348 . . . . 0.0 107.652 165.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.463 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 43.7 m -79.76 155.02 28.12 Favored 'General case' 0 C--O 1.248 1.02 0 CA-C-N 109.574 -3.466 . . . . 0.0 110.471 164.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 42.7 m -69.79 -173.29 0.21 Allowed Pre-proline 0 N--CA 1.425 -1.697 0 CA-C-O 122.85 1.31 . . . . 0.0 112.782 174.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.681 ' HD2' ' CB ' ' A' ' 19' ' ' LYS . 5.8 Cg_exo -116.34 -170.55 0.02 OUTLIER 'Trans proline' 0 CA--C 1.536 0.608 0 CA-C-N 111.855 -1.873 . . . . 0.0 109.064 177.097 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.432 ' CD ' ' N ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -82.84 133.93 35.12 Favored 'General case' 0 C--O 1.213 -0.858 0 CA-C-N 113.849 -1.523 . . . . 0.0 108.953 175.415 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.71 13.75 54.41 Favored Glycine 0 C--N 1.377 2.85 0 CA-C-N 111.034 -2.803 . . . . 0.0 113.372 -175.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.681 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 1.2 mmtt -136.88 74.09 1.47 Allowed 'General case' 0 N--CA 1.438 -1.045 0 CA-C-O 124.231 1.967 . . . . 0.0 110.971 -166.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.477 ' O ' HD23 ' A' ' 21' ' ' LEU . 0.1 OUTLIER -89.03 -17.98 28.26 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 114.482 -1.236 . . . . 0.0 109.343 -168.305 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.488 ' HB2' ' HB3' ' A' ' 41' ' ' ALA . 16.1 mt -105.46 -156.8 0.59 Allowed 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 127.271 2.228 . . . . 0.0 110.327 -169.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.74 ' HA ' ' HA ' ' A' ' 40' ' ' CYS . 62.8 m -161.96 132.67 5.01 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-N 113.812 -1.54 . . . . 0.0 110.808 174.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.475 ' HB3' ' HB3' ' A' ' 55' ' ' CYS 0.259 0.1 OUTLIER -128.06 -178.59 4.59 Favored 'General case' 0 CA--C 1.601 2.931 1 O-C-N 114.78 -4.95 . . . . 0.0 106.519 175.48 . . . . . . . . 5 4 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.482 ' HA ' ' HA ' ' A' ' 38' ' ' ARG . 2.1 pttt -165.13 154.22 12.49 Favored 'General case' 0 N--CA 1.426 -1.631 1 CA-C-N 103.954 -6.021 . . . . 0.0 105.231 173.947 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.717 ' HB2' ' CG ' ' A' ' 53' ' ' TYR 0.317 . . -134.35 178.53 6.91 Favored 'General case' 0 N--CA 1.415 -2.214 0 CA-C-N 111.511 -2.586 . . . . 0.0 112.805 172.212 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.696 ' HA ' ' N ' ' A' ' 36' ' ' VAL . 67.9 p -152.42 162.98 40.42 Favored 'General case' 0 C--O 1.279 2.625 0 CA-C-N 112.106 -2.315 . . . . 0.0 110.77 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.481 1.088 1 O-C-N 116.282 -4.011 . . . . 0.0 109.983 -173.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.56 1.346 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.66 ' HA ' ' CB ' ' A' ' 26' ' ' THR . 27.5 Cg_exo 43.39 -167.75 0.0 OUTLIER 'Trans proline' 0 CA--C 1.463 -3.045 0 O-C-N 124.91 2.005 . . . . 0.0 116.04 171.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.912 HG21 HD11 ' A' ' 51' ' ' LEU . 0.5 OUTLIER -126.93 -72.04 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.368 1.407 0 O-C-N 117.309 -3.369 . . . . 0.0 112.29 -175.452 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.655 ' N ' ' CG1' ' A' ' 36' ' ' VAL . 35.8 mttm -153.84 167.49 29.49 Favored 'General case' 0 N--CA 1.419 -1.976 0 CA-C-N 111.159 -2.746 . . . . 0.0 108.281 -166.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.563 ' HD3' ' NE2' ' A' ' 7' ' ' GLN . 0.0 OUTLIER -169.5 175.71 5.33 Favored 'General case' 0 C--O 1.198 -1.649 0 O-C-N 117.998 -2.939 . . . . 0.0 108.995 167.101 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.437 ' O ' ' ND2' ' A' ' 62' ' ' ASN . . . 163.0 -158.44 30.74 Favored Glycine 0 N--CA 1.427 -1.953 0 CA-C-N 111.858 -2.428 . . . . 0.0 109.5 -166.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.74 ' HA ' ' HA ' ' A' ' 22' ' ' CYS . 76.1 m -91.04 -174.86 4.13 Favored 'General case' 0 C--O 1.209 -1.068 0 CA-C-O 126.572 3.082 . . . . 0.0 112.384 166.563 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.683 ' HB3' ' N ' ' A' ' 22' ' ' CYS . . . -147.96 -178.79 6.47 Favored 'General case' 0 C--O 1.251 1.145 0 CA-C-N 110.545 -3.025 . . . . 0.0 109.718 -159.446 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -164.3 -73.41 0.04 OUTLIER 'General case' 0 N--CA 1.427 -1.6 0 O-C-N 120.264 -1.522 . . . . 0.0 111.403 -164.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -88.05 -99.75 0.08 Allowed 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 114.867 -1.061 . . . . 0.0 108.198 170.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.415 ' O ' ' O ' ' A' ' 45' ' ' PRO . 0.1 OUTLIER 175.24 107.33 0.09 OUTLIER Pre-proline 0 C--N 1.314 -0.948 0 C-N-CA 125.292 1.437 . . . . 0.0 108.45 175.754 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.418 ' HB2' ' CB ' ' A' ' 53' ' ' TYR . 47.8 Cg_exo -45.1 166.93 0.04 OUTLIER 'Trans proline' 0 N--CA 1.438 -1.77 0 C-N-CA 123.955 3.104 . . . . 0.0 117.711 -161.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.9 tmtt? -100.52 76.87 1.87 Allowed 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 110.569 -3.014 . . . . 0.0 110.991 176.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.426 ' OD1' ' HB2' ' A' ' 53' ' ' TYR . 0.1 OUTLIER -37.81 162.34 0.0 OUTLIER 'General case' 0 C--O 1.253 1.254 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 -178.272 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . 0.641 ' OG ' ' N ' ' A' ' 49' ' ' ALA . 0.1 OUTLIER -109.75 -166.75 1.12 Allowed 'General case' 0 C--N 1.366 1.289 1 O-C-N 115.621 -4.425 . . . . 0.0 115.397 -162.228 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.641 ' N ' ' OG ' ' A' ' 48' ' ' SER . . . -68.56 -13.3 62.24 Favored 'General case' 0 N--CA 1.412 -2.372 0 O-C-N 119.164 -2.21 . . . . 0.0 114.517 174.317 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 3.2 mt -162.06 22.71 0.11 Allowed 'General case' 0 C--O 1.258 1.539 0 CA-C-N 110.081 -3.236 . . . . 0.0 110.746 -170.598 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.912 HD11 HG21 ' A' ' 36' ' ' VAL . 0.6 OUTLIER -133.38 -168.13 2.04 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 120.619 -1.3 . . . . 0.0 110.159 -176.484 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.598 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.4 OUTLIER -151.39 142.04 22.72 Favored 'General case' 0 C--N 1.374 1.657 0 CA-C-N 108.511 -3.949 . . . . 0.0 108.963 169.162 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.717 ' CG ' ' HB2' ' A' ' 25' ' ' ALA . 7.8 m-85 -128.92 151.3 49.8 Favored 'General case' 0 C--O 1.22 -0.448 0 O-C-N 119.688 -1.883 . . . . 0.0 111.226 170.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 1.8 m -146.66 148.23 17.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 114.167 -1.379 . . . . 0.0 109.97 174.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.475 ' HB3' ' HB3' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -145.99 123.06 11.44 Favored 'General case' 0 C--O 1.252 1.219 0 O-C-N 121.031 -1.043 . . . . 0.0 113.265 -170.46 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.54 ' HB3' ' HB3' ' A' ' 61' ' ' CYS . 0.5 OUTLIER -94.2 -165.54 1.33 Allowed 'General case' 0 N--CA 1.423 -1.781 0 O-C-N 118.828 -2.42 . . . . 0.0 112.519 -176.973 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -121.22 -33.5 3.68 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 112.23 -2.259 . . . . 0.0 111.53 -176.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.637 HG23 ' SG ' ' A' ' 61' ' ' CYS . 0.1 OUTLIER -101.9 -178.38 3.7 Favored 'General case' 0 C--O 1.209 -1.047 0 CA-C-O 125.461 2.553 . . . . 0.0 108.487 -167.549 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.575 ' O ' ' HG2' ' A' ' 60' ' ' LYS 0.321 0.0 OUTLIER -72.57 127.02 31.28 Favored 'General case' 0 N--CA 1.416 -2.135 0 CA-C-N 111.884 -2.416 . . . . 0.0 112.716 -168.95 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.575 ' HG2' ' O ' ' A' ' 59' ' ' ASP . 0.1 OUTLIER 59.87 25.53 14.64 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 117.32 -1.752 . . . . 0.0 107.631 175.062 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.637 ' SG ' HG23 ' A' ' 58' ' ' THR . 5.2 t -75.95 -31.22 58.97 Favored 'General case' 0 C--O 1.253 1.248 0 CA-C-N 111.969 -2.378 . . . . 0.0 111.379 -175.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.44 ' CG ' ' HB3' ' A' ' 22' ' ' CYS . 0.3 OUTLIER . . . . . 0 C--O 1.247 0.958 0 O-C-N 120.018 -1.676 . . . . 0.0 108.736 -176.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' LEU . . . . . 0.615 HD21 ' N ' ' A' ' 59' ' ' ASP . 1.7 tm? . . . . . 0 C--O 1.244 0.78 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.521 ' N ' HD13 ' A' ' 1' ' ' LEU . 0.0 OUTLIER -125.08 151.49 45.6 Favored 'General case' 0 C--O 1.167 -3.281 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 -177.426 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 12' ' ' TYR . 3.0 t -169.16 -149.26 0.08 Allowed 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 108.914 -3.766 . . . . 0.0 108.111 -158.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 28.2 m80 -135.75 134.38 38.97 Favored 'General case' 0 C--N 1.359 0.993 0 O-C-N 118.993 -2.317 . . . . 0.0 110.241 -164.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ASN . . . . . 0.587 ' HB3' ' HA2' ' A' ' 39' ' ' GLY . 1.7 p-10 -126.17 -53.88 1.5 Allowed 'General case' 0 N--CA 1.444 -0.763 0 O-C-N 119.942 -1.724 . . . . 0.0 110.013 169.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.609 ' O ' ' N ' ' A' ' 8' ' ' LEU . 4.3 m -69.24 -52.79 24.19 Favored 'General case' 0 CA--C 1.586 2.362 0 CA-C-O 116.336 -1.792 . . . . 0.0 106.31 -177.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . 0.484 ' HG2' ' C ' ' A' ' 6' ' ' THR 0.361 0.5 OUTLIER 58.07 -46.43 0.05 OUTLIER 'General case' 0 N--CA 1.423 -1.809 0 CA-C-N 111.001 -2.818 . . . . 0.0 118.499 -172.602 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.609 ' N ' ' O ' ' A' ' 6' ' ' THR . 23.6 tp -52.02 124.52 29.37 Favored Pre-proline 0 N--CA 1.424 -1.769 0 O-C-N 116.886 -3.633 . . . . 0.0 109.097 160.285 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.434 ' HD2' ' HG ' ' A' ' 8' ' ' LEU 0.503 50.3 Cg_exo -14.85 153.14 0.0 OUTLIER 'Trans proline' 0 C--N 1.274 -3.359 1 C-N-CA 126.06 4.507 . . . . 0.0 117.037 -92.682 . . . . . . . . 4 3 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.499 ' O ' ' C ' ' A' ' 11' ' ' ILE . 9.1 m-30 -52.18 -11.57 0.19 Allowed 'General case' 0 C--O 1.255 1.383 0 O-C-N 118.309 -2.745 . . . . 0.0 113.125 -172.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.499 ' C ' ' O ' ' A' ' 10' ' ' PHE . 0.1 OUTLIER -44.66 110.56 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 CA-C-N 114.284 -1.325 . . . . 0.0 107.459 171.787 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' TYR . . . . . 0.508 ' CD2' ' N ' ' A' ' 12' ' ' TYR . 0.4 OUTLIER -114.06 -161.99 0.79 Allowed 'General case' 0 C--N 1.311 -1.104 0 C-N-CA 126.745 2.018 . . . . 0.0 108.492 -166.779 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.8 tttp -159.08 170.0 23.0 Favored 'General case' 0 C--O 1.202 -1.399 0 CA-C-N 113.041 -1.891 . . . . 0.0 109.108 170.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.476 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 53.3 m -92.11 120.14 32.43 Favored 'General case' 0 C--O 1.263 1.791 0 CA-C-N 109.144 -3.662 . . . . 0.0 112.566 173.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.493 ' HB3' ' HB3' ' A' ' 40' ' ' CYS . 0.5 OUTLIER -105.09 139.15 19.83 Favored Pre-proline 0 CA--C 1.484 -1.582 0 O-C-N 118.508 -2.62 . . . . 0.0 113.32 -175.309 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.505 ' HD3' ' SG ' ' A' ' 40' ' ' CYS . 6.0 Cg_endo -123.31 -174.33 0.01 OUTLIER 'Trans proline' 0 CA--C 1.543 0.934 0 O-C-N 117.545 -1.871 . . . . 0.0 110.732 -115.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.9 129.14 16.92 Favored 'General case' 0 C--N 1.358 0.937 0 CA-C-O 126.48 3.038 . . . . 0.0 113.228 -174.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 85.56 -8.37 72.26 Favored Glycine 0 N--CA 1.422 -2.241 0 CA-C-N 110.742 -2.936 . . . . 0.0 110.116 -175.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.588 ' HG2' ' HB2' ' A' ' 40' ' ' CYS . 18.0 tptt -139.18 69.03 1.37 Allowed 'General case' 0 CA--C 1.571 1.783 0 N-CA-C 103.908 -2.627 . . . . 0.0 103.908 -172.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -67.79 -46.01 73.18 Favored 'General case' 0 CA--C 1.567 1.61 0 CA-C-N 109.923 -3.308 . . . . 0.0 110.709 -163.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.567 HD23 ' SG ' ' A' ' 55' ' ' CYS . 0.3 OUTLIER -82.27 173.56 11.97 Favored 'General case' 0 C--O 1.214 -0.776 0 CA-C-N 110.213 -3.176 . . . . 0.0 108.919 -170.282 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 7.1 p -126.36 131.48 51.78 Favored 'General case' 0 C--O 1.258 1.522 0 CA-C-N 113.538 -1.665 . . . . 0.0 113.038 165.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.565 ' C ' ' HB2' ' A' ' 62' ' ' ASN 0.361 0.1 OUTLIER -113.04 175.12 5.57 Favored 'General case' 0 CA--C 1.622 3.723 0 O-C-N 117.798 -3.064 . . . . 0.0 106.21 -176.221 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.537 ' HA ' ' HA ' ' A' ' 38' ' ' ARG . 0.4 OUTLIER -162.19 147.23 12.69 Favored 'General case' 0 N--CA 1.418 -2.065 1 CA-C-N 105.201 -5.454 . . . . 0.0 105.639 162.691 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.847 ' HB2' ' CD2' ' A' ' 53' ' ' TYR . . . -131.89 127.58 36.77 Favored 'General case' 0 C--N 1.392 2.418 1 CA-C-N 108.087 -4.142 . . . . 0.0 110.587 177.304 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.9 HG23 ' HB ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -101.83 169.06 9.04 Favored 'General case' 0 C--O 1.267 1.974 0 CA-C-N 112.799 -2.0 . . . . 0.0 111.855 179.618 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.3 mt . . . . . 0 C--O 1.247 0.932 0 O-C-N 118.359 -2.713 . . . . 0.0 108.184 173.533 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.659 ' N ' ' CD ' ' A' ' 35' ' ' PRO . 91.9 t80 . . . . . 0 CA--C 1.5 -0.975 0 CA-C-O 123.891 1.805 . . . . 0.0 112.702 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.659 ' CD ' ' N ' ' A' ' 34' ' ' PHE . 9.8 Cg_exo -75.29 104.4 1.9 Allowed 'Trans proline' 0 C--N 1.373 1.839 0 CA-C-N 112.685 -1.577 . . . . 0.0 113.15 158.399 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.9 ' HB ' HG23 ' A' ' 26' ' ' THR . 1.8 p -122.95 161.51 24.31 Favored 'Isoleucine or valine' 0 C--N 1.393 2.495 0 CA-C-N 108.696 -3.866 . . . . 0.0 115.916 167.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.508 ' N ' ' CG2' ' A' ' 36' ' ' VAL . 3.2 mttp -126.59 156.25 41.2 Favored 'General case' 0 C--O 1.27 2.167 0 C-N-CA 128.505 2.722 . . . . 0.0 108.861 163.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.544 ' N ' ' HD2' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -158.01 -166.88 2.07 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 116.517 -3.865 . . . . 0.0 109.859 173.841 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLY . . . . . 0.587 ' HA2' ' HB3' ' A' ' 5' ' ' ASN . . . 140.44 -156.75 25.36 Favored Glycine 0 C--N 1.364 2.085 0 CA-C-N 110.513 -3.04 . . . . 0.0 110.224 -169.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' CYS . . . . . 0.588 ' HB2' ' HG2' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -82.32 -176.89 6.43 Favored 'General case' 0 N--CA 1.416 -2.13 0 CA-C-N 112.442 -1.879 . . . . 0.0 111.971 176.827 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -166.92 -172.43 2.07 Favored 'General case' 0 C--N 1.408 3.111 1 CA-C-N 106.462 -4.881 . . . . 0.0 110.922 -159.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -175.86 -74.7 0.01 OUTLIER 'General case' 0 C--N 1.366 1.311 1 O-C-N 116.002 -4.186 . . . . 0.0 111.341 -162.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -81.65 -68.55 0.68 Allowed 'General case' 0 CA--C 1.562 1.425 0 C-N-CA 124.26 1.024 . . . . 0.0 109.332 170.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.2 m 138.27 54.83 0.0 OUTLIER Pre-proline 0 N--CA 1.426 -1.649 0 CA-C-N 111.904 -2.407 . . . . 0.0 110.686 -171.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.665 ' HB2' ' CG ' ' A' ' 53' ' ' TYR . 0.3 OUTLIER 20.75 171.99 0.0 OUTLIER 'Trans proline' 0 CA--C 1.474 -2.492 0 N-CA-C 119.51 2.85 . . . . 0.0 119.51 -173.267 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.476 ' O ' ' C ' ' A' ' 47' ' ' ASN . 0.0 OUTLIER -99.97 87.14 3.42 Favored 'General case' 0 N--CA 1.423 -1.776 0 O-C-N 118.017 -2.927 . . . . 0.0 109.834 165.263 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASN . . . . . 0.584 ' OD1' ' HB2' ' A' ' 53' ' ' TYR . 0.5 OUTLIER -37.67 134.12 0.73 Allowed 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 174.53 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.0 t -81.04 -151.75 0.08 Allowed 'General case' 0 CA--C 1.488 -1.437 0 N-CA-C 116.769 2.136 . . . . 0.0 116.769 -168.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.538 ' O ' ' HB2' ' A' ' 50' ' ' LEU . . . -84.69 -2.44 57.56 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 119.763 -1.836 . . . . 0.0 110.654 -169.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.538 ' HB2' ' O ' ' A' ' 49' ' ' ALA . 17.8 tp -165.76 35.92 0.05 Allowed 'General case' 0 C--N 1.392 2.416 0 CA-C-N 109.151 -3.659 . . . . 0.0 112.965 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.81 ' CD2' ' HB1' ' A' ' 25' ' ' ALA . 0.3 OUTLIER -133.7 -166.76 1.83 Allowed 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 118.948 -2.345 . . . . 0.0 113.239 -172.31 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.412 ' H ' ' CG ' ' A' ' 51' ' ' LEU . 1.5 tttp -158.82 109.17 2.03 Favored 'General case' 0 C--N 1.379 1.888 1 CA-C-N 107.828 -4.26 . . . . 0.0 106.632 177.705 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.847 ' CD2' ' HB2' ' A' ' 25' ' ' ALA . 12.4 m-85 -97.19 132.17 43.22 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-O 122.692 1.234 . . . . 0.0 113.525 166.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 1.5 m -130.45 130.2 65.04 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.547 0 CA-C-N 114.539 -1.21 . . . . 0.0 111.366 170.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.567 ' SG ' HD23 ' A' ' 21' ' ' LEU . 4.4 p -132.9 111.16 10.83 Favored 'General case' 0 C--O 1.283 2.863 0 CA-C-O 116.332 -1.794 . . . . 0.0 109.87 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' CYS . . . . . 0.522 ' O ' ' HG ' ' A' ' 21' ' ' LEU 0.423 1.6 p -108.63 176.81 4.98 Favored 'General case' 0 C--N 1.374 1.638 1 O-C-N 114.589 -5.069 . . . . 0.0 112.966 174.623 . . . . . . . . 4 3 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -78.55 -41.26 32.54 Favored 'General case' 0 N--CA 1.423 -1.803 0 CA-C-N 114.375 -1.284 . . . . 0.0 110.365 -171.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.498 ' O ' ' HB2' ' A' ' 61' ' ' CYS . 0.1 OUTLIER -75.55 144.22 42.02 Favored 'General case' 0 C--O 1.283 2.828 0 CA-C-N 111.045 -2.798 . . . . 0.0 109.164 -159.624 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.615 ' N ' HD21 ' A' ' 1' ' ' LEU . 0.6 OUTLIER -53.58 140.93 27.18 Favored 'General case' 0 C--N 1.394 2.537 1 O-C-N 112.07 -6.644 . . . . 0.0 109.158 -175.88 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.53 10.71 6.05 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 122.62 1.2 . . . . 0.0 111.296 178.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.498 ' HB2' ' O ' ' A' ' 58' ' ' THR . 0.5 OUTLIER -55.33 -38.59 68.93 Favored 'General case' 0 N--CA 1.42 -1.938 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 -179.728 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.565 ' HB2' ' C ' ' A' ' 23' ' ' PHE . 39.3 p30 . . . . . 0 C--O 1.203 -1.375 0 CA-C-O 126.978 3.275 . . . . 0.0 110.12 -168.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.43 ' CD2' ' CG ' ' A' ' 59' ' ' ASP . 3.2 tm? . . . . . 0 CA--C 1.54 0.588 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.463 ' HA ' ' HA ' ' A' ' 14' ' ' THR . 0.0 OUTLIER -122.99 150.01 43.56 Favored 'General case' 0 C--O 1.215 -0.757 0 CA-C-N 111.225 -2.716 . . . . 0.0 107.158 -174.683 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.482 ' O ' ' HB2' ' A' ' 12' ' ' TYR . 1.8 t -155.56 -135.06 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 111.995 -2.366 . . . . 0.0 108.387 -160.353 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.419 ' CD2' ' HB3' ' A' ' 7' ' ' GLN . 0.3 OUTLIER -145.52 152.04 39.11 Favored 'General case' 0 C--N 1.379 1.858 0 O-C-N 117.992 -2.943 . . . . 0.0 110.726 -167.665 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -148.02 -56.31 0.22 Allowed 'General case' 0 C--N 1.359 1.004 0 O-C-N 117.937 -2.977 . . . . 0.0 110.248 168.061 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.65 ' O ' ' N ' ' A' ' 8' ' ' LEU . 2.4 m -67.02 -54.39 22.13 Favored 'General case' 0 CA--C 1.586 2.341 0 CA-C-O 113.696 -3.05 . . . . 0.0 109.762 -176.316 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.563 ' NE2' ' HD3' ' A' ' 38' ' ' ARG 0.516 1.6 pt20 64.06 -54.21 0.25 Allowed 'General case' 0 C--O 1.265 1.918 0 O-C-N 117.757 -3.089 . . . . 0.0 116.551 -175.914 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.65 ' N ' ' O ' ' A' ' 6' ' ' THR . 7.6 tp -52.93 126.76 43.52 Favored Pre-proline 0 CA--C 1.595 2.707 1 O-C-N 115.808 -4.308 . . . . 0.0 104.262 157.548 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.507 ' C ' ' N ' ' A' ' 11' ' ' ILE 0.353 75.6 Cg_exo -23.02 140.14 0.01 OUTLIER 'Trans proline' 0 C--N 1.273 -3.42 1 C-N-CA 129.069 6.513 . . . . 0.0 119.425 -93.627 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.489 ' CD1' ' C ' ' A' ' 10' ' ' PHE . 0.0 OUTLIER -34.69 -18.7 0.0 OUTLIER 'General case' 0 C--N 1.365 1.281 1 O-C-N 115.668 -4.395 . . . . 0.0 112.753 -177.026 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.507 ' N ' ' C ' ' A' ' 9' ' ' PRO . 0.1 OUTLIER -37.08 117.09 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.432 -1.369 0 CA-C-N 114.362 -1.29 . . . . 0.0 110.557 170.617 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.482 ' HB2' ' O ' ' A' ' 3' ' ' CYS . 0.8 OUTLIER -118.76 -163.01 0.93 Allowed 'General case' 0 CA--C 1.575 1.938 0 O-C-N 118.634 -2.541 . . . . 0.0 108.149 -161.139 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.65 169.35 23.5 Favored 'General case' 0 CA--C 1.586 2.346 0 CA-C-N 109.834 -3.348 . . . . 0.0 107.652 165.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.463 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 43.7 m -79.76 155.02 28.12 Favored 'General case' 0 C--O 1.248 1.02 0 CA-C-N 109.574 -3.466 . . . . 0.0 110.471 164.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 42.7 m -69.79 -173.29 0.21 Allowed Pre-proline 0 N--CA 1.425 -1.697 0 CA-C-O 122.85 1.31 . . . . 0.0 112.782 174.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.681 ' HD2' ' CB ' ' A' ' 19' ' ' LYS . 5.8 Cg_exo -116.34 -170.55 0.02 OUTLIER 'Trans proline' 0 CA--C 1.536 0.608 0 CA-C-N 111.855 -1.873 . . . . 0.0 109.064 177.097 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.432 ' CD ' ' N ' ' A' ' 17' ' ' GLU . 0.1 OUTLIER -82.84 133.93 35.12 Favored 'General case' 0 C--O 1.213 -0.858 0 CA-C-N 113.849 -1.523 . . . . 0.0 108.953 175.415 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.71 13.75 54.41 Favored Glycine 0 C--N 1.377 2.85 0 CA-C-N 111.034 -2.803 . . . . 0.0 113.372 -175.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.681 ' CB ' ' HD2' ' A' ' 16' ' ' PRO . 1.2 mmtt -136.88 74.09 1.47 Allowed 'General case' 0 N--CA 1.438 -1.045 0 CA-C-O 124.231 1.967 . . . . 0.0 110.971 -166.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.477 ' O ' HD23 ' A' ' 21' ' ' LEU . 0.1 OUTLIER -89.03 -17.98 28.26 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 114.482 -1.236 . . . . 0.0 109.343 -168.305 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.488 ' HB2' ' HB3' ' A' ' 41' ' ' ALA . 16.1 mt -105.46 -156.8 0.59 Allowed 'General case' 0 C--N 1.306 -1.283 0 C-N-CA 127.271 2.228 . . . . 0.0 110.327 -169.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.74 ' HA ' ' HA ' ' A' ' 40' ' ' CYS . 62.8 m -161.96 132.67 5.01 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-N 113.812 -1.54 . . . . 0.0 110.808 174.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.475 ' HB3' ' HB3' ' A' ' 55' ' ' CYS 0.259 0.1 OUTLIER -128.06 -178.59 4.59 Favored 'General case' 0 CA--C 1.601 2.931 1 O-C-N 114.78 -4.95 . . . . 0.0 106.519 175.48 . . . . . . . . 5 4 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.482 ' HA ' ' HA ' ' A' ' 38' ' ' ARG . 2.1 pttt -165.13 154.22 12.49 Favored 'General case' 0 N--CA 1.426 -1.631 1 CA-C-N 103.954 -6.021 . . . . 0.0 105.231 173.947 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.717 ' HB2' ' CG ' ' A' ' 53' ' ' TYR 0.317 . . -134.35 178.53 6.91 Favored 'General case' 0 N--CA 1.415 -2.214 0 CA-C-N 111.511 -2.586 . . . . 0.0 112.805 172.212 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.696 ' HA ' ' N ' ' A' ' 36' ' ' VAL . 67.9 p -152.42 162.98 40.42 Favored 'General case' 0 C--O 1.279 2.625 0 CA-C-N 112.106 -2.315 . . . . 0.0 110.77 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -111.78 147.96 34.56 Favored 'General case' 0 N--CA 1.481 1.088 1 O-C-N 116.282 -4.011 . . . . 0.0 109.983 -173.671 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.25 47.79 1.39 Allowed 'General case' 0 C--O 1.217 -0.644 0 CA-C-O 123.988 1.851 . . . . 0.0 109.868 172.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 1.5 mtmt -61.95 -69.41 0.25 Allowed 'General case' 0 C--O 1.242 0.691 0 CA-C-N 113.511 -1.677 . . . . 0.0 112.471 176.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.624 ' CD2' HD12 ' A' ' 32' ' ' LEU . 0.4 OUTLIER -122.23 139.48 30.69 Favored Pre-proline 0 C--N 1.359 1.006 0 O-C-N 118.312 -2.743 . . . . 0.0 108.573 -167.897 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.448 ' O ' ' HB2' ' A' ' 32' ' ' LEU . 40.2 Cg_exo -57.63 76.93 0.04 OUTLIER 'Trans proline' 0 C--O 1.247 0.96 0 CA-C-N 113.783 -1.185 . . . . 0.0 110.922 173.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.676 ' C ' HD22 ' A' ' 32' ' ' LEU 0.354 0.0 OUTLIER 150.94 -74.98 0.0 OUTLIER 'General case' 0 N--CA 1.531 3.598 2 O-C-N 114.628 -5.045 . . . . 0.0 101.501 -160.654 . . . . . . . . 5 4 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.572 ' N ' HD22 ' A' ' 32' ' ' LEU . 1.3 pttm 81.69 -176.26 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.454 0 CA-C-N 109.634 -3.439 . . . . 0.0 114.392 164.348 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -160.11 38.8 0.06 OUTLIER Pre-proline 0 CA--C 1.56 1.346 0 N-CA-C 106.334 -1.728 . . . . 0.0 106.334 -162.675 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.66 ' HA ' ' CB ' ' A' ' 26' ' ' THR . 27.5 Cg_exo 43.39 -167.75 0.0 OUTLIER 'Trans proline' 0 CA--C 1.463 -3.045 0 O-C-N 124.91 2.005 . . . . 0.0 116.04 171.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.912 HG21 HD11 ' A' ' 51' ' ' LEU . 0.5 OUTLIER -126.93 -72.04 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.368 1.407 0 O-C-N 117.309 -3.369 . . . . 0.0 112.29 -175.452 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.655 ' N ' ' CG1' ' A' ' 36' ' ' VAL . 35.8 mttm -153.84 167.49 29.49 Favored 'General case' 0 N--CA 1.419 -1.976 0 CA-C-N 111.159 -2.746 . . . . 0.0 108.281 -166.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.563 ' HD3' ' NE2' ' A' ' 7' ' ' GLN . 0.0 OUTLIER -169.5 175.71 5.33 Favored 'General case' 0 C--O 1.198 -1.649 0 O-C-N 117.998 -2.939 . . . . 0.0 108.995 167.101 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.437 ' O ' ' ND2' ' A' ' 62' ' ' ASN . . . 163.0 -158.44 30.74 Favored Glycine 0 N--CA 1.427 -1.953 0 CA-C-N 111.858 -2.428 . . . . 0.0 109.5 -166.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.74 ' HA ' ' HA ' ' A' ' 22' ' ' CYS . 76.1 m -91.04 -174.86 4.13 Favored 'General case' 0 C--O 1.209 -1.068 0 CA-C-O 126.572 3.082 . . . . 0.0 112.384 166.563 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.683 ' HB3' ' N ' ' A' ' 22' ' ' CYS . . . -147.96 -178.79 6.47 Favored 'General case' 0 C--O 1.251 1.145 0 CA-C-N 110.545 -3.025 . . . . 0.0 109.718 -159.446 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 34.9 t0 -164.3 -73.41 0.04 OUTLIER 'General case' 0 N--CA 1.427 -1.6 0 O-C-N 120.264 -1.522 . . . . 0.0 111.403 -164.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -88.05 -99.75 0.08 Allowed 'General case' 0 N--CA 1.477 0.878 0 CA-C-N 114.867 -1.061 . . . . 0.0 108.198 170.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.415 ' O ' ' O ' ' A' ' 45' ' ' PRO . 0.1 OUTLIER 175.24 107.33 0.09 OUTLIER Pre-proline 0 C--N 1.314 -0.948 0 C-N-CA 125.292 1.437 . . . . 0.0 108.45 175.754 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.418 ' HB2' ' CB ' ' A' ' 53' ' ' TYR . 47.8 Cg_exo -45.1 166.93 0.04 OUTLIER 'Trans proline' 0 N--CA 1.438 -1.77 0 C-N-CA 123.955 3.104 . . . . 0.0 117.711 -161.604 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 3.9 tmtt? -100.52 76.87 1.87 Allowed 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 110.569 -3.014 . . . . 0.0 110.991 176.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.426 ' OD1' ' HB2' ' A' ' 53' ' ' TYR . 0.1 OUTLIER -37.81 162.34 0.0 OUTLIER 'General case' 0 C--O 1.253 1.254 0 N-CA-C 106.594 -1.632 . . . . 0.0 106.594 -178.272 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . 0.641 ' OG ' ' N ' ' A' ' 49' ' ' ALA . 0.1 OUTLIER -109.75 -166.75 1.12 Allowed 'General case' 0 C--N 1.366 1.289 1 O-C-N 115.621 -4.425 . . . . 0.0 115.397 -162.228 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.641 ' N ' ' OG ' ' A' ' 48' ' ' SER . . . -68.56 -13.3 62.24 Favored 'General case' 0 N--CA 1.412 -2.372 0 O-C-N 119.164 -2.21 . . . . 0.0 114.517 174.317 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.441 ' HG ' ' O ' ' A' ' 49' ' ' ALA . 3.2 mt -162.06 22.71 0.11 Allowed 'General case' 0 C--O 1.258 1.539 0 CA-C-N 110.081 -3.236 . . . . 0.0 110.746 -170.598 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.912 HD11 HG21 ' A' ' 36' ' ' VAL . 0.6 OUTLIER -133.38 -168.13 2.04 Favored 'General case' 0 C--N 1.322 -0.612 0 O-C-N 120.619 -1.3 . . . . 0.0 110.159 -176.484 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.598 ' H ' ' HG ' ' A' ' 51' ' ' LEU . 0.4 OUTLIER -151.39 142.04 22.72 Favored 'General case' 0 C--N 1.374 1.657 0 CA-C-N 108.511 -3.949 . . . . 0.0 108.963 169.162 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.717 ' CG ' ' HB2' ' A' ' 25' ' ' ALA . 7.8 m-85 -128.92 151.3 49.8 Favored 'General case' 0 C--O 1.22 -0.448 0 O-C-N 119.688 -1.883 . . . . 0.0 111.226 170.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 1.8 m -146.66 148.23 17.08 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-N 114.167 -1.379 . . . . 0.0 109.97 174.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.475 ' HB3' ' HB3' ' A' ' 23' ' ' PHE . 0.5 OUTLIER -145.99 123.06 11.44 Favored 'General case' 0 C--O 1.252 1.219 0 O-C-N 121.031 -1.043 . . . . 0.0 113.265 -170.46 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.54 ' HB3' ' HB3' ' A' ' 61' ' ' CYS . 0.5 OUTLIER -94.2 -165.54 1.33 Allowed 'General case' 0 N--CA 1.423 -1.781 0 O-C-N 118.828 -2.42 . . . . 0.0 112.519 -176.973 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -121.22 -33.5 3.68 Favored 'General case' 0 N--CA 1.436 -1.174 0 CA-C-N 112.23 -2.259 . . . . 0.0 111.53 -176.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.637 HG23 ' SG ' ' A' ' 61' ' ' CYS . 0.1 OUTLIER -101.9 -178.38 3.7 Favored 'General case' 0 C--O 1.209 -1.047 0 CA-C-O 125.461 2.553 . . . . 0.0 108.487 -167.549 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.575 ' O ' ' HG2' ' A' ' 60' ' ' LYS 0.321 0.0 OUTLIER -72.57 127.02 31.28 Favored 'General case' 0 N--CA 1.416 -2.135 0 CA-C-N 111.884 -2.416 . . . . 0.0 112.716 -168.95 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.575 ' HG2' ' O ' ' A' ' 59' ' ' ASP . 0.1 OUTLIER 59.87 25.53 14.64 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 117.32 -1.752 . . . . 0.0 107.631 175.062 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.637 ' SG ' HG23 ' A' ' 58' ' ' THR . 5.2 t -75.95 -31.22 58.97 Favored 'General case' 0 C--O 1.253 1.248 0 CA-C-N 111.969 -2.378 . . . . 0.0 111.379 -175.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.44 ' CG ' ' HB3' ' A' ' 22' ' ' CYS . 0.3 OUTLIER . . . . . 0 C--O 1.247 0.958 0 O-C-N 120.018 -1.676 . . . . 0.0 108.736 -176.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.615 HD21 ' N ' ' A' ' 59' ' ' ASP . 1.7 tm? . . . . . 0 C--O 1.244 0.78 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.521 ' N ' HD13 ' A' ' 1' ' ' LEU . 0.0 OUTLIER -125.08 151.49 45.6 Favored 'General case' 0 C--O 1.167 -3.281 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 -177.426 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 12' ' ' TYR . 3.0 t -169.16 -149.26 0.08 Allowed 'General case' 0 N--CA 1.483 1.184 0 CA-C-N 108.914 -3.766 . . . . 0.0 108.111 -158.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 28.2 m80 -135.75 134.38 38.97 Favored 'General case' 0 C--N 1.359 0.993 0 O-C-N 118.993 -2.317 . . . . 0.0 110.241 -164.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.587 ' HB3' ' HA2' ' A' ' 39' ' ' GLY . 1.7 p-10 -126.17 -53.88 1.5 Allowed 'General case' 0 N--CA 1.444 -0.763 0 O-C-N 119.942 -1.724 . . . . 0.0 110.013 169.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.609 ' O ' ' N ' ' A' ' 8' ' ' LEU . 4.3 m -69.24 -52.79 24.19 Favored 'General case' 0 CA--C 1.586 2.362 0 CA-C-O 116.336 -1.792 . . . . 0.0 106.31 -177.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . 0.484 ' HG2' ' C ' ' A' ' 6' ' ' THR 0.361 0.5 OUTLIER 58.07 -46.43 0.05 OUTLIER 'General case' 0 N--CA 1.423 -1.809 0 CA-C-N 111.001 -2.818 . . . . 0.0 118.499 -172.602 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.609 ' N ' ' O ' ' A' ' 6' ' ' THR . 23.6 tp -52.02 124.52 29.37 Favored Pre-proline 0 N--CA 1.424 -1.769 0 O-C-N 116.886 -3.633 . . . . 0.0 109.097 160.285 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.434 ' HD2' ' HG ' ' A' ' 8' ' ' LEU 0.503 50.3 Cg_exo -14.85 153.14 0.0 OUTLIER 'Trans proline' 0 C--N 1.274 -3.359 1 C-N-CA 126.06 4.507 . . . . 0.0 117.037 -92.682 . . . . . . . . 4 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.499 ' O ' ' C ' ' A' ' 11' ' ' ILE . 9.1 m-30 -52.18 -11.57 0.19 Allowed 'General case' 0 C--O 1.255 1.383 0 O-C-N 118.309 -2.745 . . . . 0.0 113.125 -172.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.499 ' C ' ' O ' ' A' ' 10' ' ' PHE . 0.1 OUTLIER -44.66 110.56 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.758 0 CA-C-N 114.284 -1.325 . . . . 0.0 107.459 171.787 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.508 ' CD2' ' N ' ' A' ' 12' ' ' TYR . 0.4 OUTLIER -114.06 -161.99 0.79 Allowed 'General case' 0 C--N 1.311 -1.104 0 C-N-CA 126.745 2.018 . . . . 0.0 108.492 -166.779 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 4.8 tttp -159.08 170.0 23.0 Favored 'General case' 0 C--O 1.202 -1.399 0 CA-C-N 113.041 -1.891 . . . . 0.0 109.108 170.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.476 ' HA ' ' HA ' ' A' ' 2' ' ' LYS . 53.3 m -92.11 120.14 32.43 Favored 'General case' 0 C--O 1.263 1.791 0 CA-C-N 109.144 -3.662 . . . . 0.0 112.566 173.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.493 ' HB3' ' HB3' ' A' ' 40' ' ' CYS . 0.5 OUTLIER -105.09 139.15 19.83 Favored Pre-proline 0 CA--C 1.484 -1.582 0 O-C-N 118.508 -2.62 . . . . 0.0 113.32 -175.309 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.505 ' HD3' ' SG ' ' A' ' 40' ' ' CYS . 6.0 Cg_endo -123.31 -174.33 0.01 OUTLIER 'Trans proline' 0 CA--C 1.543 0.934 0 O-C-N 117.545 -1.871 . . . . 0.0 110.732 -115.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -48.9 129.14 16.92 Favored 'General case' 0 C--N 1.358 0.937 0 CA-C-O 126.48 3.038 . . . . 0.0 113.228 -174.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 85.56 -8.37 72.26 Favored Glycine 0 N--CA 1.422 -2.241 0 CA-C-N 110.742 -2.936 . . . . 0.0 110.116 -175.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.588 ' HG2' ' HB2' ' A' ' 40' ' ' CYS . 18.0 tptt -139.18 69.03 1.37 Allowed 'General case' 0 CA--C 1.571 1.783 0 N-CA-C 103.908 -2.627 . . . . 0.0 103.908 -172.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -67.79 -46.01 73.18 Favored 'General case' 0 CA--C 1.567 1.61 0 CA-C-N 109.923 -3.308 . . . . 0.0 110.709 -163.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.567 HD23 ' SG ' ' A' ' 55' ' ' CYS . 0.3 OUTLIER -82.27 173.56 11.97 Favored 'General case' 0 C--O 1.214 -0.776 0 CA-C-N 110.213 -3.176 . . . . 0.0 108.919 -170.282 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 7.1 p -126.36 131.48 51.78 Favored 'General case' 0 C--O 1.258 1.522 0 CA-C-N 113.538 -1.665 . . . . 0.0 113.038 165.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.565 ' C ' ' HB2' ' A' ' 62' ' ' ASN 0.361 0.1 OUTLIER -113.04 175.12 5.57 Favored 'General case' 0 CA--C 1.622 3.723 0 O-C-N 117.798 -3.064 . . . . 0.0 106.21 -176.221 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.537 ' HA ' ' HA ' ' A' ' 38' ' ' ARG . 0.4 OUTLIER -162.19 147.23 12.69 Favored 'General case' 0 N--CA 1.418 -2.065 1 CA-C-N 105.201 -5.454 . . . . 0.0 105.639 162.691 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.847 ' HB2' ' CD2' ' A' ' 53' ' ' TYR . . . -131.89 127.58 36.77 Favored 'General case' 0 C--N 1.392 2.418 1 CA-C-N 108.087 -4.142 . . . . 0.0 110.587 177.304 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.9 HG23 ' HB ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -101.83 169.06 9.04 Favored 'General case' 0 C--O 1.267 1.974 0 CA-C-N 112.799 -2.0 . . . . 0.0 111.855 179.618 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.43 ' O ' ' N ' ' A' ' 29' ' ' LYS . 1.3 mt -98.34 148.36 23.74 Favored 'General case' 0 C--O 1.247 0.932 0 O-C-N 118.359 -2.713 . . . . 0.0 108.184 173.533 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.95 75.95 0.64 Allowed 'General case' 0 CA--C 1.576 1.973 0 N-CA-C 105.013 -2.218 . . . . 0.0 105.013 171.187 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.751 ' CD ' ' H ' ' A' ' 34' ' ' PHE . 0.0 OUTLIER -86.44 -111.22 0.05 Allowed 'General case' 0 C--O 1.252 1.187 0 CA-C-N 112.726 -2.033 . . . . 0.0 110.33 -173.307 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.414 ' H ' ' CG ' ' A' ' 29' ' ' LYS . 8.0 t80 -154.2 94.1 2.87 Favored Pre-proline 0 C--O 1.259 1.585 0 O-C-N 119.897 -1.752 . . . . 0.0 107.934 -174.13 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.432 ' HA ' ' HE2' ' A' ' 29' ' ' LYS . 2.2 Cg_exo -43.11 93.46 0.02 OUTLIER 'Trans proline' 0 C--N 1.3 -1.978 0 C-N-CA 121.794 1.662 . . . . 0.0 112.269 -162.446 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.733 ' C ' HD12 ' A' ' 32' ' ' LEU . 0.2 OUTLIER 152.76 -45.78 0.01 OUTLIER 'General case' 0 C--N 1.38 1.903 0 O-C-N 116.991 -3.568 . . . . 0.0 109.844 -162.632 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.631 ' HB3' ' HD3' ' A' ' 35' ' ' PRO . 0.1 OUTLIER -64.75 -60.99 2.47 Favored 'General case' 0 CA--C 1.554 1.131 0 O-C-N 119.415 -2.053 . . . . 0.0 110.326 -178.917 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.751 ' H ' ' CD ' ' A' ' 29' ' ' LYS . 91.9 t80 73.79 51.02 0.24 Allowed Pre-proline 0 C--N 1.367 1.359 1 CA-C-N 108.225 -4.08 . . . . 0.0 112.702 169.748 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.659 ' CD ' ' N ' ' A' ' 34' ' ' PHE . 9.8 Cg_exo -75.29 104.4 1.9 Allowed 'Trans proline' 0 C--N 1.373 1.839 0 CA-C-N 112.685 -1.577 . . . . 0.0 113.15 158.399 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.9 ' HB ' HG23 ' A' ' 26' ' ' THR . 1.8 p -122.95 161.51 24.31 Favored 'Isoleucine or valine' 0 C--N 1.393 2.495 0 CA-C-N 108.696 -3.866 . . . . 0.0 115.916 167.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.508 ' N ' ' CG2' ' A' ' 36' ' ' VAL . 3.2 mttp -126.59 156.25 41.2 Favored 'General case' 0 C--O 1.27 2.167 0 C-N-CA 128.505 2.722 . . . . 0.0 108.861 163.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.544 ' N ' ' HD2' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -158.01 -166.88 2.07 Favored 'General case' 0 CA--C 1.547 0.84 0 O-C-N 116.517 -3.865 . . . . 0.0 109.859 173.841 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.587 ' HA2' ' HB3' ' A' ' 5' ' ' ASN . . . 140.44 -156.75 25.36 Favored Glycine 0 C--N 1.364 2.085 0 CA-C-N 110.513 -3.04 . . . . 0.0 110.224 -169.81 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.588 ' HB2' ' HG2' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -82.32 -176.89 6.43 Favored 'General case' 0 N--CA 1.416 -2.13 0 CA-C-N 112.442 -1.879 . . . . 0.0 111.971 176.827 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -166.92 -172.43 2.07 Favored 'General case' 0 C--N 1.408 3.111 1 CA-C-N 106.462 -4.881 . . . . 0.0 110.922 -159.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 26.1 t0 -175.86 -74.7 0.01 OUTLIER 'General case' 0 C--N 1.366 1.311 1 O-C-N 116.002 -4.186 . . . . 0.0 111.341 -162.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -81.65 -68.55 0.68 Allowed 'General case' 0 CA--C 1.562 1.425 0 C-N-CA 124.26 1.024 . . . . 0.0 109.332 170.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.2 m 138.27 54.83 0.0 OUTLIER Pre-proline 0 N--CA 1.426 -1.649 0 CA-C-N 111.904 -2.407 . . . . 0.0 110.686 -171.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.665 ' HB2' ' CG ' ' A' ' 53' ' ' TYR . 0.3 OUTLIER 20.75 171.99 0.0 OUTLIER 'Trans proline' 0 CA--C 1.474 -2.492 0 N-CA-C 119.51 2.85 . . . . 0.0 119.51 -173.267 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.476 ' O ' ' C ' ' A' ' 47' ' ' ASN . 0.0 OUTLIER -99.97 87.14 3.42 Favored 'General case' 0 N--CA 1.423 -1.776 0 O-C-N 118.017 -2.927 . . . . 0.0 109.834 165.263 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.584 ' OD1' ' HB2' ' A' ' 53' ' ' TYR . 0.5 OUTLIER -37.67 134.12 0.73 Allowed 'General case' 0 CA--C 1.547 0.84 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 174.53 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 25.0 t -81.04 -151.75 0.08 Allowed 'General case' 0 CA--C 1.488 -1.437 0 N-CA-C 116.769 2.136 . . . . 0.0 116.769 -168.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.538 ' O ' ' HB2' ' A' ' 50' ' ' LEU . . . -84.69 -2.44 57.56 Favored 'General case' 0 N--CA 1.451 -0.389 0 O-C-N 119.763 -1.836 . . . . 0.0 110.654 -169.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.538 ' HB2' ' O ' ' A' ' 49' ' ' ALA . 17.8 tp -165.76 35.92 0.05 Allowed 'General case' 0 C--N 1.392 2.416 0 CA-C-N 109.151 -3.659 . . . . 0.0 112.965 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.81 ' CD2' ' HB1' ' A' ' 25' ' ' ALA . 0.3 OUTLIER -133.7 -166.76 1.83 Allowed 'General case' 0 N--CA 1.431 -1.395 0 O-C-N 118.948 -2.345 . . . . 0.0 113.239 -172.31 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.412 ' H ' ' CG ' ' A' ' 51' ' ' LEU . 1.5 tttp -158.82 109.17 2.03 Favored 'General case' 0 C--N 1.379 1.888 1 CA-C-N 107.828 -4.26 . . . . 0.0 106.632 177.705 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.847 ' CD2' ' HB2' ' A' ' 25' ' ' ALA . 12.4 m-85 -97.19 132.17 43.22 Favored 'General case' 0 N--CA 1.43 -1.463 0 CA-C-O 122.692 1.234 . . . . 0.0 113.525 166.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 1.5 m -130.45 130.2 65.04 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.547 0 CA-C-N 114.539 -1.21 . . . . 0.0 111.366 170.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.567 ' SG ' HD23 ' A' ' 21' ' ' LEU . 4.4 p -132.9 111.16 10.83 Favored 'General case' 0 C--O 1.283 2.863 0 CA-C-O 116.332 -1.794 . . . . 0.0 109.87 179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.522 ' O ' ' HG ' ' A' ' 21' ' ' LEU 0.423 1.6 p -108.63 176.81 4.98 Favored 'General case' 0 C--N 1.374 1.638 1 O-C-N 114.589 -5.069 . . . . 0.0 112.966 174.623 . . . . . . . . 4 3 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -78.55 -41.26 32.54 Favored 'General case' 0 N--CA 1.423 -1.803 0 CA-C-N 114.375 -1.284 . . . . 0.0 110.365 -171.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.498 ' O ' ' HB2' ' A' ' 61' ' ' CYS . 0.1 OUTLIER -75.55 144.22 42.02 Favored 'General case' 0 C--O 1.283 2.828 0 CA-C-N 111.045 -2.798 . . . . 0.0 109.164 -159.624 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.615 ' N ' HD21 ' A' ' 1' ' ' LEU . 0.6 OUTLIER -53.58 140.93 27.18 Favored 'General case' 0 C--N 1.394 2.537 1 O-C-N 112.07 -6.644 . . . . 0.0 109.158 -175.88 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 64.53 10.71 6.05 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 122.62 1.2 . . . . 0.0 111.296 178.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.498 ' HB2' ' O ' ' A' ' 58' ' ' THR . 0.5 OUTLIER -55.33 -38.59 68.93 Favored 'General case' 0 N--CA 1.42 -1.938 0 N-CA-C 114.682 1.364 . . . . 0.0 114.682 -179.728 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.565 ' HB2' ' C ' ' A' ' 23' ' ' PHE . 39.3 p30 . . . . . 0 C--O 1.203 -1.375 0 CA-C-O 126.978 3.275 . . . . 0.0 110.12 -168.902 . . . . . . . . 1 1 . 1 stop_ save_