data_2kd3_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 2kd3 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . 0.406 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 30.4 m170 . . . . . 0 N--CA 1.461 0.112 0 N-CA-C 111.854 0.316 . . . . 20.0 111.854 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.583 ' CZ ' HG13 ' A' ' 79' ' ' VAL . 0.8 OUTLIER -126.15 166.28 17.34 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.125 -0.488 . . . . 20.0 111.143 179.793 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.95 79.67 1.54 Allowed 'General case' 0 C--O 1.231 0.121 0 CA-C-O 120.999 0.428 . . . . 20.0 111.716 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.483 ' NE ' ' OE2' ' A' ' 77' ' ' GLU . 53.0 mtm180 -124.7 124.29 41.86 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.154 -1.054 . . . . 20.0 108.154 177.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.581 ' CD1' ' O ' ' A' ' 73' ' ' LYS . 0.1 OUTLIER -109.53 -79.08 0.58 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 113.007 0.743 . . . . 20.0 113.007 -177.368 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.603 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -170.72 136.74 1.23 Allowed 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.277 -0.569 . . . . 20.0 112.435 -178.128 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.525 ' CG2' ' HG3' ' A' ' 70' ' ' ARG . 16.8 p -132.96 132.06 41.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.06 -0.518 . . . . 20.0 110.295 178.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.523 ' O ' ' C ' ' A' ' 67' ' ' GLY . 91.7 m-20 -140.27 -163.68 1.57 Allowed 'General case' 0 C--O 1.237 0.44 0 N-CA-C 110.074 -0.343 . . . . 20.0 110.074 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.837 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -29.86 146.2 0.01 OUTLIER Glycine 0 C--N 1.345 1.036 0 CA-C-O 118.597 -1.113 . . . . 20.0 110.622 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.492 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 39.6 Cg_exo -15.11 56.23 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 125.292 3.995 . . . . 20.0 115.183 -178.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.837 ' N ' ' O ' ' A' ' 67' ' ' GLY . 39.8 m -163.84 163.68 23.76 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 108.453 -0.943 . . . . 20.0 108.453 178.661 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.525 ' HG3' ' CG2' ' A' ' 65' ' ' THR . 58.0 ttp180 -154.64 145.88 22.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.112 0.482 . . . . 20.0 111.84 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.603 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -89.27 160.54 16.86 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.751 -0.659 . . . . 20.0 110.465 179.075 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.451 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . . . -147.66 28.36 0.96 Allowed 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.177 0.806 . . . . 20.0 113.177 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.581 ' O ' ' CD1' ' A' ' 63' ' ' PHE . 1.5 tttt -79.33 143.2 59.71 Favored Pre-proline 0 C--N 1.326 -0.436 0 N-CA-C 110.017 -0.364 . . . . 20.0 110.017 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.448 ' HD2' ' HG3' ' A' ' 73' ' ' LYS . 76.9 Cg_exo -51.28 122.29 9.85 Favored 'Trans proline' 0 C--O 1.232 0.225 0 C-N-CA 122.758 2.306 . . . . 20.0 113.024 -178.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.502 HG21 ' CD1' ' A' ' 63' ' ' PHE . 20.0 m -136.72 145.5 30.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 115.791 -0.641 . . . . 20.0 110.97 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 41.7 m -119.14 128.52 54.35 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.919 0.39 . . . . 20.0 110.307 178.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.483 ' OE2' ' NE ' ' A' ' 62' ' ' ARG . 20.3 pt-20 -143.32 150.32 39.02 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.894 -0.594 . . . . 20.0 110.252 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.503 HD11 ' N ' ' A' ' 78' ' ' LEU . 6.0 mp -100.91 140.99 34.42 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 121.174 0.511 . . . . 20.0 111.076 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.583 HG13 ' CZ ' ' A' ' 60' ' ' TYR . 10.7 m . . . . . 0 N--CA 1.441 -0.91 0 CA-C-N 115.423 -0.808 . . . . 20.0 109.842 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 93.3 m-20 . . . . . 0 C--O 1.231 0.115 0 N-CA-C 112.018 0.377 . . . . 20.0 112.018 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . 0.412 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 25.3 ttm180 -121.2 147.84 45.06 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.354 -0.384 . . . . 20.0 110.832 -179.434 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.522 ' HB2' ' HB3' ' A' ' 135' ' ' ARG . 1.0 OUTLIER -119.65 160.8 21.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.174 0.511 . . . . 20.0 111.441 -179.114 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.409 ' HB2' ' HB3' ' A' ' 138' ' ' ALA . 50.9 ttm-85 -96.93 147.18 24.24 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.882 -0.784 . . . . 20.0 108.882 178.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . 0.417 ' O ' ' NE2' ' A' ' 117' ' ' GLN . . . -82.91 134.24 35.08 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.076 0.465 . . . . 20.0 111.938 -178.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.422 ' HG3' HD23 ' A' ' 136' ' ' LEU . 75.6 mm-40 -133.94 120.53 20.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.54 -0.755 . . . . 20.0 110.032 179.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 71.9 ttp85 -118.04 98.61 6.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.924 0.392 . . . . 20.0 110.663 179.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.54 ' CG1' ' HB2' ' A' ' 73' ' ' LYS . 92.2 t -131.14 145.06 35.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.902 -0.59 . . . . 20.0 111.3 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.536 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 24.4 mp0 -91.53 140.92 29.28 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.751 0.31 . . . . 20.0 110.518 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.543 ' HA ' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -79.4 129.72 34.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.196 0.522 . . . . 20.0 110.801 -179.835 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.527 ' CD1' ' HA ' ' A' ' 71' ' ' SER . 1.5 mp -95.12 138.46 32.8 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.551 -0.75 . . . . 20.0 111.524 -179.048 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . 0.492 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER . . . . . 0 C--N 1.323 -0.585 0 CA-C-N 115.403 -0.817 . . . . 20.0 109.877 179.462 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.115 0 N-CA-C 112.271 0.471 . . . . 20.0 112.271 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -123.19 56.03 8.72 Favored Pre-proline 0 C--N 1.33 -0.242 0 N-CA-C 112.219 0.451 . . . . 20.0 112.219 -179.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.68 143.81 47.43 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.639 2.226 . . . . 20.0 112.081 179.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.536 ' O ' ' HA ' ' A' ' 120' ' ' GLN . 67.5 mtt85 -132.02 153.38 50.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.379 -0.373 . . . . 20.0 110.623 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.433 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 43.9 t -98.84 133.72 42.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.801 0.334 . . . . 20.0 111.128 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . 0.412 ' HB3' HD11 ' A' ' 64' ' ' LEU . 74.5 ttt-85 -139.1 142.99 38.08 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.188 0.518 . . . . 20.0 111.761 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 3.6 pttm -96.09 146.07 24.96 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.445 -0.798 . . . . 20.0 110.259 179.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . 0.516 ' CG2' HD22 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -145.16 121.59 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 CA-C-O 121.287 0.565 . . . . 20.0 111.794 -179.415 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . 0.522 ' HB3' ' HB2' ' A' ' 114' ' ' TYR . 86.1 mtt-85 -92.1 118.6 30.97 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.349 -0.842 . . . . 20.0 110.09 178.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.579 ' N ' ' CD2' ' A' ' 136' ' ' LEU . 1.0 OUTLIER -114.35 120.2 39.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.01 0.433 . . . . 20.0 112.087 -179.252 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.475 HG11 ' CE2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -51.28 84.54 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.269 -0.423 . . . . 20.0 111.455 179.811 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.519 ' N ' ' O ' ' A' ' 136' ' ' LEU . . . -75.5 -6.44 50.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.009 0.433 . . . . 20.0 110.193 179.101 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 17.3 t . . . . . 0 C--N 1.332 -0.162 0 CA-C-N 115.82 -0.627 . . . . 20.0 110.517 179.245 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 7.5 m170 . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.911 0.386 . . . . 20.0 111.243 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.589 ' CE1' HG11 ' A' ' 79' ' ' VAL . 12.7 m-85 -129.25 148.63 51.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.083 -0.508 . . . . 20.0 111.639 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.418 ' OG1' ' CZ ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -103.86 87.15 2.73 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.038 0.447 . . . . 20.0 111.091 -179.819 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.506 ' CB ' ' OE1' ' A' ' 77' ' ' GLU . 60.7 ttm-85 -122.37 124.96 44.89 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.572 -0.899 . . . . 20.0 108.572 178.544 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.58 ' CD1' HG22 ' A' ' 75' ' ' VAL . 0.1 OUTLIER -111.18 -83.39 0.57 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.98 0.733 . . . . 20.0 112.98 -177.606 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.599 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -169.17 141.77 2.64 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 120.575 -0.45 . . . . 20.0 112.04 -178.405 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.471 ' O ' ' OD1' ' A' ' 66' ' ' ASP . 31.0 p -136.4 131.62 34.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.101 -0.5 . . . . 20.0 110.806 178.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.546 ' O ' ' C ' ' A' ' 67' ' ' GLY . 93.4 m-20 -140.72 -162.13 1.31 Allowed 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.547 -0.538 . . . . 20.0 109.547 179.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.814 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -29.65 144.34 0.01 OUTLIER Glycine 0 C--N 1.347 1.183 0 CA-C-O 118.494 -1.17 . . . . 20.0 110.277 179.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.515 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 56.9 Cg_exo -16.57 58.53 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 125.071 3.848 . . . . 20.0 114.864 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.814 ' N ' ' O ' ' A' ' 67' ' ' GLY . 20.7 m -162.58 159.12 24.29 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 108.956 -0.757 . . . . 20.0 108.956 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -149.97 141.29 23.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.218 0.532 . . . . 20.0 112.068 179.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.599 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -84.54 162.69 19.75 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.446 -0.797 . . . . 20.0 110.393 179.004 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -147.34 28.3 0.99 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.415 0.894 . . . . 20.0 113.415 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.534 ' CG ' HG22 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -75.76 141.97 72.85 Favored Pre-proline 0 C--N 1.327 -0.379 0 C-N-CA 120.54 -0.464 . . . . 20.0 110.27 179.249 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -50.63 122.51 9.76 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.706 2.27 . . . . 20.0 112.619 -179.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.58 HG22 ' CD1' ' A' ' 63' ' ' PHE . 17.3 m -137.27 151.08 26.38 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 CA-C-N 116.202 -0.454 . . . . 20.0 111.891 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 88.1 m -111.73 124.24 51.92 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.069 -0.715 . . . . 20.0 109.069 177.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.53 ' O ' ' N ' ' A' ' 60' ' ' TYR . 84.8 tt0 -125.31 133.1 52.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.192 0.52 . . . . 20.0 112.085 -179.061 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.556 ' CD1' ' N ' ' A' ' 78' ' ' LEU . 3.8 mp -108.06 138.29 44.58 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.534 -0.757 . . . . 20.0 109.405 178.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.589 HG11 ' CE1' ' A' ' 60' ' ' TYR . 35.0 m . . . . . 0 C--N 1.317 -0.805 0 CA-C-O 121.481 0.657 . . . . 20.0 111.184 -178.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 . . . . . 0 CA--C 1.529 0.152 0 N-CA-C 112.989 0.737 . . . . 20.0 112.989 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . 0.495 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 41.0 ttm180 -119.82 149.05 42.69 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.245 0.461 . . . . 20.0 112.245 -178.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.59 ' HB3' ' N ' ' A' ' 136' ' ' LEU . 1.3 m-85 -124.01 159.01 30.79 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.551 -0.75 . . . . 20.0 111.602 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.504 ' HD2' ' NE2' ' A' ' 117' ' ' GLN . 43.9 ttm-85 -95.43 148.31 22.61 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.467 -0.938 . . . . 20.0 108.467 177.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -83.33 137.94 33.75 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.137 0.494 . . . . 20.0 111.421 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.504 ' NE2' ' HD2' ' A' ' 115' ' ' ARG . 95.6 mm-40 -137.18 109.81 7.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.811 -0.632 . . . . 20.0 110.867 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . 0.47 ' HA ' ' O ' ' A' ' 132' ' ' ARG . 93.8 mtt180 -125.42 98.25 5.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.059 -0.519 . . . . 20.0 110.739 179.394 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.534 HG22 ' CG ' ' A' ' 73' ' ' LYS . 14.7 p -133.72 152.12 34.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.877 -0.601 . . . . 20.0 110.857 -179.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.506 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 27.1 mp0 -77.92 135.73 37.9 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.932 0.396 . . . . 20.0 111.493 -179.234 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.573 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.2 OUTLIER -79.22 127.71 32.39 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.345 -0.613 . . . . 20.0 109.345 179.103 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 71' ' ' SER . 0.4 OUTLIER -84.62 131.86 34.56 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.861 -0.608 . . . . 20.0 111.446 -178.715 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . 0.515 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.5 OUTLIER . . . . . 0 C--N 1.323 -0.547 0 CA-C-N 115.438 -0.801 . . . . 20.0 109.881 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.186 0 N-CA-C 112.384 0.512 . . . . 20.0 112.384 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -129.63 56.26 23.21 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 112.388 0.514 . . . . 20.0 112.388 -179.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . 0.494 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 62.3 Cg_endo -73.74 136.32 23.02 Favored 'Trans proline' 0 CA--C 1.528 0.182 0 C-N-CA 122.529 2.153 . . . . 20.0 112.055 179.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.506 ' O ' ' HA ' ' A' ' 120' ' ' GLN . 89.1 mtt180 -140.27 133.94 30.32 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.62 0.248 . . . . 20.0 111.271 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 23.3 t -85.51 136.71 33.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.952 0.406 . . . . 20.0 111.657 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . 0.47 ' O ' ' HA ' ' A' ' 118' ' ' ARG . 56.6 ttt-85 -140.52 143.54 35.46 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.803 -0.635 . . . . 20.0 111.26 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.435 ' HA ' ' O ' ' A' ' 117' ' ' GLN . 19.7 pttp -100.93 144.61 29.66 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.09 -0.504 . . . . 20.0 110.66 179.473 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . 0.485 HG21 HD22 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -147.99 123.17 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 120.946 0.403 . . . . 20.0 111.721 -179.618 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . 0.476 ' HB3' ' HB2' ' A' ' 114' ' ' TYR . 90.5 mtm-85 -90.85 110.89 22.11 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.855 -0.612 . . . . 20.0 110.213 178.423 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.59 ' N ' ' HB3' ' A' ' 114' ' ' TYR . 5.0 mt -114.04 126.85 55.58 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.255 0.55 . . . . 20.0 112.047 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.539 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.2 OUTLIER -57.83 83.22 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.569 -0.741 . . . . 20.0 111.405 -179.704 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.433 ' HA ' HD13 ' A' ' 78' ' ' LEU . . . -72.95 -6.98 48.94 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.053 0.454 . . . . 20.0 110.428 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 47.2 t . . . . . 0 C--N 1.331 -0.209 0 CA-C-N 115.787 -0.642 . . . . 20.0 110.169 179.171 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . 0.43 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 25.8 m170 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.895 0.379 . . . . 20.0 110.792 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.612 ' CD1' ' CG1' ' A' ' 79' ' ' VAL . 14.9 m-85 -128.16 156.14 43.35 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.027 -0.533 . . . . 20.0 111.589 -179.124 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 40.1 p -111.05 88.41 2.78 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 112.325 0.491 . . . . 20.0 112.325 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.498 ' NE ' ' OE2' ' A' ' 77' ' ' GLU . 51.4 mtm180 -117.33 123.36 46.32 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.291 -1.003 . . . . 20.0 108.291 177.151 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.615 ' CD1' ' O ' ' A' ' 73' ' ' LYS . 1.7 m-85 -103.21 -79.29 0.54 Allowed 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 112.34 0.496 . . . . 20.0 112.34 -177.448 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.625 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -177.46 142.16 0.32 Allowed 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.581 -0.448 . . . . 20.0 111.44 -178.76 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.432 HG23 ' C ' ' A' ' 64' ' ' LEU . 30.0 p -138.9 132.71 30.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.058 -0.519 . . . . 20.0 110.081 178.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.558 ' O ' ' C ' ' A' ' 67' ' ' GLY . 5.1 t0 -150.29 -155.71 0.65 Allowed 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.701 -0.227 . . . . 20.0 110.397 -179.417 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.789 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -26.38 137.77 0.01 OUTLIER Glycine 0 C--N 1.347 1.171 0 N-CA-C 110.26 -1.136 . . . . 20.0 110.26 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.565 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 36.7 Cg_exo -17.09 59.74 0.0 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.97 0 C-N-CA 125.136 3.891 . . . . 20.0 115.387 -177.85 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.789 ' N ' ' O ' ' A' ' 67' ' ' GLY . 74.1 m -165.33 162.87 19.91 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 108.7 -0.852 . . . . 20.0 108.7 178.051 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.509 ' O ' ' N ' ' A' ' 122' ' ' LEU . 54.9 ttt180 -147.09 140.82 25.73 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 112.555 0.576 . . . . 20.0 112.555 -179.321 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.655 ' CA ' ' HA ' ' A' ' 121' ' ' LEU . 1.4 t -87.98 158.36 18.67 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-N 115.896 -0.593 . . . . 20.0 110.253 178.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.93 27.37 1.07 Allowed 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 114.427 1.269 . . . . 20.0 114.427 -179.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.615 ' O ' ' CD1' ' A' ' 63' ' ' PHE . 19.5 tttt -76.62 136.57 67.48 Favored Pre-proline 0 C--N 1.327 -0.411 0 C-N-CA 120.054 -0.658 . . . . 20.0 109.493 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -51.35 129.03 27.54 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.926 2.417 . . . . 20.0 113.172 -178.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.463 HG22 ' O ' ' A' ' 62' ' ' ARG . 17.4 m -142.3 147.79 20.91 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 CA-C-N 115.886 -0.597 . . . . 20.0 111.472 179.638 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 18.9 m -116.83 126.15 52.62 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.526 -0.546 . . . . 20.0 109.526 178.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.527 ' OE1' ' CD1' ' A' ' 136' ' ' LEU . 15.9 pt-20 -143.09 155.49 44.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.971 0.415 . . . . 20.0 111.554 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.461 HD11 ' HA ' ' A' ' 138' ' ' ALA . 6.3 mp -105.39 143.59 33.34 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.757 -0.656 . . . . 20.0 110.272 178.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.612 ' CG1' ' CD1' ' A' ' 60' ' ' TYR . 32.8 m . . . . . 0 C--N 1.323 -0.576 0 CA-C-O 121.037 0.446 . . . . 20.0 110.632 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 46.6 t0 . . . . . 0 N--CA 1.455 -0.181 0 CA-C-O 120.739 0.304 . . . . 20.0 111.538 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . 0.45 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 53.2 ttt85 -126.38 143.59 51.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.286 -0.415 . . . . 20.0 111.519 -179.678 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.577 ' CD1' HG12 ' A' ' 137' ' ' VAL . 2.3 m-85 -118.66 157.39 27.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.908 -0.587 . . . . 20.0 110.6 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.431 ' HB2' ' HB1' ' A' ' 138' ' ' ALA . 55.5 ttm-85 -93.74 139.84 30.36 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 108.602 -0.888 . . . . 20.0 108.602 178.024 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -77.01 131.68 38.58 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 120.302 -0.559 . . . . 20.0 110.684 -178.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.466 ' HB2' ' HB ' ' A' ' 134' ' ' VAL . 49.6 mt-30 -133.46 101.87 5.31 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.961 -0.563 . . . . 20.0 110.57 -179.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 43.2 ttt85 -109.21 99.54 8.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.967 0.413 . . . . 20.0 110.28 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.548 ' O ' ' CD1' ' A' ' 64' ' ' LEU . 45.3 t -129.33 148.92 33.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 115.895 -0.593 . . . . 20.0 110.976 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.545 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 13.1 pt20 -92.21 134.82 34.52 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.391 -0.368 . . . . 20.0 110.223 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.655 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.2 OUTLIER -74.48 120.85 20.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.137 0.494 . . . . 20.0 111.134 -179.27 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.509 ' N ' ' O ' ' A' ' 70' ' ' ARG . 0.2 OUTLIER -89.69 138.77 31.19 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.469 -0.787 . . . . 20.0 111.114 -179.242 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . 0.565 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.482 0 CA-C-N 116.06 -0.518 . . . . 20.0 111.02 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.487 ' C ' ' CD ' ' A' ' 129' ' ' PRO . . . . . . . . 0 N--CA 1.455 -0.185 0 N-CA-C 112.057 0.391 . . . . 20.0 112.057 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.447 ' N ' ' CD ' ' A' ' 129' ' ' PRO . . . -113.44 53.89 0.56 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.125 0.488 . . . . 20.0 110.648 179.314 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . 0.506 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 36.9 Cg_endo -65.86 151.58 83.83 Favored 'Trans proline' 0 N--CA 1.464 -0.251 0 C-N-CA 122.977 2.451 . . . . 20.0 112.767 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.545 ' O ' ' HA ' ' A' ' 120' ' ' GLN . 80.8 mtt85 -134.98 155.76 50.19 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 116.004 -0.544 . . . . 20.0 110.634 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.429 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 13.2 p -103.52 133.46 48.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.86 0.362 . . . . 20.0 111.23 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 60.6 ttt85 -140.37 143.57 35.79 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.094 -0.503 . . . . 20.0 111.593 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.474 ' O ' HG23 ' A' ' 134' ' ' VAL . 17.5 pttp -97.02 149.31 22.06 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 115.884 -0.598 . . . . 20.0 110.44 179.442 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . 0.515 ' CG2' HD21 ' A' ' 64' ' ' LEU . 3.2 t -147.68 123.92 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-O 121.118 0.485 . . . . 20.0 111.768 -179.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . 0.493 ' HB3' ' HB2' ' A' ' 114' ' ' TYR . 93.9 mtt-85 -100.45 109.73 21.89 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.516 -0.765 . . . . 20.0 109.526 178.351 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.572 ' N ' ' CD2' ' A' ' 136' ' ' LEU . 1.1 mm? -111.57 125.69 54.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.1 0.476 . . . . 20.0 112.224 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.577 HG12 ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -52.83 83.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.1 -0.5 . . . . 20.0 111.393 179.853 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.511 ' N ' ' O ' ' A' ' 136' ' ' LEU . . . -74.36 -8.83 57.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.082 0.468 . . . . 20.0 110.039 178.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.7 p . . . . . 0 C--N 1.332 -0.189 0 CA-C-N 115.653 -0.703 . . . . 20.0 109.68 179.11 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.455 -0.218 0 CA-C-O 120.902 0.382 . . . . 20.0 111.439 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.556 ' CD2' HG11 ' A' ' 79' ' ' VAL . 20.6 m-30 -110.67 150.06 29.57 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.698 0.629 . . . . 20.0 112.698 -179.018 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 24.0 p -118.88 84.99 2.28 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 115.051 -0.977 . . . . 20.0 110.293 178.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.448 ' O ' HG22 ' A' ' 75' ' ' VAL . 57.1 ttt85 -112.43 125.64 54.44 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 108.473 -0.936 . . . . 20.0 108.473 178.44 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.58 ' CD1' ' O ' ' A' ' 73' ' ' LYS . 0.1 OUTLIER -110.01 -84.75 0.55 Allowed 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.555 0.576 . . . . 20.0 112.555 -177.935 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.554 ' CD1' ' HB3' ' A' ' 71' ' ' SER . 0.0 OUTLIER -164.5 132.55 3.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.888 0.375 . . . . 20.0 111.448 -178.68 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.523 HG23 ' CD ' ' A' ' 70' ' ' ARG . 44.2 p -131.44 132.92 44.69 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.95 -0.568 . . . . 20.0 110.603 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.524 ' O ' ' O ' ' A' ' 67' ' ' GLY . 20.1 p-10 -145.01 -161.36 1.28 Allowed 'General case' 0 C--O 1.237 0.426 0 N-CA-C 110.355 -0.239 . . . . 20.0 110.355 179.377 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.837 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -30.51 149.09 0.01 OUTLIER Glycine 0 C--N 1.342 0.902 0 CA-C-O 118.784 -1.009 . . . . 20.0 110.688 179.183 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.502 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 57.0 Cg_exo -16.67 53.42 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.657 1 C-N-CA 125.852 4.368 . . . . 20.0 115.613 -178.476 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.837 ' N ' ' O ' ' A' ' 67' ' ' GLY . 18.3 m -164.56 160.28 20.1 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 108.344 -0.984 . . . . 20.0 108.344 178.412 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.523 ' CD ' HG23 ' A' ' 65' ' ' THR . 71.5 ttt180 -153.58 140.46 19.16 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.865 0.364 . . . . 20.0 111.414 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.566 ' CB ' ' HA ' ' A' ' 121' ' ' LEU . 0.0 OUTLIER -81.15 165.19 21.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.923 -0.581 . . . . 20.0 110.324 179.279 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -148.26 24.03 1.03 Allowed 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.672 0.619 . . . . 20.0 112.672 178.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.58 ' O ' ' CD1' ' A' ' 63' ' ' PHE . 1.8 mmpt? -67.3 128.97 93.84 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 109.786 -0.45 . . . . 20.0 109.786 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -46.69 117.72 2.24 Favored 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 122.411 2.074 . . . . 20.0 112.693 -179.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.545 HG22 ' CD1' ' A' ' 63' ' ' PHE . 28.8 m -133.24 155.69 41.09 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.244 0 CA-C-N 116.14 -0.482 . . . . 20.0 110.893 179.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.43 HG21 HD11 ' A' ' 78' ' ' LEU . 14.3 m -116.54 121.24 41.21 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.786 -0.45 . . . . 20.0 109.786 177.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.452 ' N ' ' O ' ' A' ' 60' ' ' TYR . 78.6 tt0 -120.53 124.07 44.45 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.945 -0.57 . . . . 20.0 110.414 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.503 ' CD1' ' N ' ' A' ' 78' ' ' LEU . 3.9 mp -111.47 120.59 42.67 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 121.646 0.736 . . . . 20.0 111.61 -179.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.606 ' CG2' ' O ' ' A' ' 79' ' ' VAL . 3.9 m . . . . . 0 C--N 1.311 -1.068 0 CA-C-N 114.544 -1.207 . . . . 20.0 109.509 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 . . . . . 0 CA--C 1.533 0.312 0 N-CA-C 112.508 0.558 . . . . 20.0 112.508 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . 0.541 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 57.5 ttt180 -117.63 154.15 32.07 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.542 0.211 . . . . 20.0 111.444 -179.159 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.569 ' CD2' ' N ' ' A' ' 137' ' ' VAL . 2.3 m-85 -127.81 155.3 44.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.488 0.661 . . . . 20.0 111.82 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.452 ' O ' ' HA ' ' A' ' 135' ' ' ARG . 27.3 ttm-85 -94.29 146.27 24.15 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.968 -1.014 . . . . 20.0 108.959 178.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -94.74 116.39 28.68 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.29 0.567 . . . . 20.0 110.65 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -130.63 111.62 12.38 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.531 -0.759 . . . . 20.0 109.684 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 59.9 ttp180 -110.49 101.3 10.0 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.877 -0.601 . . . . 20.0 110.356 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.537 ' CG2' HD21 ' A' ' 64' ' ' LEU . 35.4 m -125.42 162.95 27.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 120.872 0.368 . . . . 20.0 111.264 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.555 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 14.4 pt20 -95.99 137.84 34.48 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-O 121.53 0.681 . . . . 20.0 112.17 -178.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.566 ' HA ' ' CB ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -74.79 133.9 41.88 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 115.218 -0.901 . . . . 20.0 109.557 179.094 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.482 ' CD1' ' HA ' ' A' ' 71' ' ' SER . 2.3 mp -94.72 140.34 30.02 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.404 0.621 . . . . 20.0 111.638 -178.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . 0.477 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.3 OUTLIER . . . . . 0 C--N 1.321 -0.639 0 CA-C-N 115.27 -0.877 . . . . 20.0 109.455 178.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 -0.101 0 N-CA-C 112.519 0.563 . . . . 20.0 112.519 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -125.28 58.3 19.73 Favored Pre-proline 0 C--N 1.325 -0.484 0 C-N-CA 120.886 -0.326 . . . . 20.0 111.819 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -48.87 150.15 6.92 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.477 2.118 . . . . 20.0 111.295 178.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.555 ' O ' ' HA ' ' A' ' 120' ' ' GLN . 98.3 mtt180 -123.75 148.43 46.63 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 121.054 -0.258 . . . . 20.0 110.86 -179.609 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.531 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 22.9 t -100.46 134.61 43.16 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.004 0.431 . . . . 20.0 111.705 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . 0.536 ' HD3' ' CB ' ' A' ' 64' ' ' LEU . 47.4 ttt85 -141.2 141.77 34.04 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.854 -0.612 . . . . 20.0 111.194 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.408 ' O ' HG23 ' A' ' 134' ' ' VAL . 16.7 pttm -92.91 145.2 24.56 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.783 0.325 . . . . 20.0 111.067 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . 0.529 HG21 ' O ' ' A' ' 63' ' ' PHE . 41.2 t -147.66 130.62 8.0 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.799 0 CA-C-O 121.529 0.681 . . . . 20.0 112.295 -179.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . 0.452 ' HA ' ' O ' ' A' ' 115' ' ' ARG . 36.5 ptt-85 -113.52 111.85 22.59 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.868 -1.06 . . . . 20.0 109.652 178.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 8.7 mt -119.05 143.05 47.32 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.372 0.508 . . . . 20.0 112.372 -179.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.569 ' N ' ' CD2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -63.32 83.76 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.989 -0.551 . . . . 20.0 111.028 179.192 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -65.98 -19.82 65.99 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.881 0.372 . . . . 20.0 110.672 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 38.6 t . . . . . 0 N--CA 1.465 0.304 0 CA-C-N 116.06 -0.518 . . . . 20.0 110.372 -179.882 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . 0.484 ' CG ' HG22 ' A' ' 76' ' ' THR . 48.2 m170 . . . . . 0 N--CA 1.453 -0.278 0 CA-C-O 120.573 0.225 . . . . 20.0 111.486 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.585 ' CD1' HG13 ' A' ' 79' ' ' VAL . 0.2 OUTLIER -147.9 161.8 40.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.988 0.423 . . . . 20.0 111.28 179.483 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.594 HG21 ' CE1' ' A' ' 63' ' ' PHE . 52.8 m -76.11 136.22 39.85 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.609 0.719 . . . . 20.0 112.128 -178.67 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.466 ' O ' HG21 ' A' ' 75' ' ' VAL . 47.4 tpt85 174.86 109.61 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.59 -1.186 . . . . 20.0 108.799 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.594 ' CE1' HG21 ' A' ' 61' ' ' THR . 0.0 OUTLIER -116.41 -80.95 0.61 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.551 0.575 . . . . 20.0 112.551 -178.343 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.635 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -164.57 132.45 3.32 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 112.109 0.411 . . . . 20.0 112.109 -178.786 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.491 ' O ' ' NH1' ' A' ' 132' ' ' ARG . 72.6 p -129.12 136.62 50.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.067 -0.515 . . . . 20.0 110.232 178.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.516 ' O ' ' C ' ' A' ' 67' ' ' GLY . 31.4 p-10 -145.34 -164.33 1.92 Allowed 'General case' 0 C--O 1.237 0.426 0 CA-C-N 116.454 -0.339 . . . . 20.0 110.361 -179.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.845 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -31.72 147.99 0.01 OUTLIER Glycine 0 C--N 1.345 1.028 0 CA-C-O 118.453 -1.193 . . . . 20.0 110.152 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.547 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 56.3 Cg_exo -16.99 56.07 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.689 0 C-N-CA 125.167 3.911 . . . . 20.0 115.103 -178.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.845 ' N ' ' O ' ' A' ' 67' ' ' GLY . 34.4 m -163.22 157.68 20.69 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 108.272 -1.01 . . . . 20.0 108.272 178.603 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.517 ' O ' ' N ' ' A' ' 122' ' ' LEU . 80.6 mtt180 -149.26 143.95 26.2 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.679 0.622 . . . . 20.0 112.679 -179.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.635 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -89.02 159.01 17.8 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.478 -0.783 . . . . 20.0 109.521 177.938 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.571 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . . . -145.85 22.7 1.41 Allowed 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 113.68 0.992 . . . . 20.0 113.68 -179.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.528 ' CB ' HG13 ' A' ' 119' ' ' VAL . 0.1 OUTLIER -67.11 139.74 95.41 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 109.433 -0.58 . . . . 20.0 109.433 178.999 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.468 ' HD2' ' HG3' ' A' ' 73' ' ' LYS . 54.1 Cg_exo -51.87 125.94 18.53 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.353 2.035 . . . . 20.0 112.333 -179.127 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.466 HG21 ' O ' ' A' ' 62' ' ' ARG . 19.0 m -131.41 161.07 41.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.001 0.429 . . . . 20.0 111.248 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.484 HG22 ' CG ' ' A' ' 59' ' ' HIS . 0.0 OUTLIER -134.97 97.08 3.65 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.849 -0.614 . . . . 20.0 109.983 178.749 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.512 ' HG2' ' HB3' ' A' ' 136' ' ' LEU . 67.8 mt-10 -110.99 161.27 16.03 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.738 -0.664 . . . . 20.0 110.23 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.47 HD11 ' C ' ' A' ' 77' ' ' GLU . 8.7 mp -111.02 132.98 53.76 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.404 0.621 . . . . 20.0 111.494 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.585 HG13 ' CD1' ' A' ' 60' ' ' TYR . 23.4 m . . . . . 0 N--CA 1.447 -0.587 0 CA-C-N 115.023 -0.989 . . . . 20.0 110.073 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 50.3 t0 . . . . . 0 CA--C 1.529 0.147 0 N-CA-C 112.539 0.57 . . . . 20.0 112.539 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . 0.517 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 56.9 ttm-85 -111.98 156.66 21.78 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.104 0.409 . . . . 20.0 112.104 -178.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.637 ' HB3' ' N ' ' A' ' 136' ' ' LEU . 4.4 m-85 -134.51 165.49 25.08 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.681 -0.69 . . . . 20.0 112.188 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.514 ' N ' ' O ' ' A' ' 136' ' ' LEU . 14.2 ttm180 -103.3 151.31 22.86 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.611 -1.177 . . . . 20.0 108.358 177.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -90.52 124.84 35.33 Favored 'General case' 0 C--N 1.319 -0.761 0 C-N-CA 120.482 -0.487 . . . . 20.0 111.597 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.45 ' NE2' ' HG2' ' A' ' 115' ' ' ARG . 83.1 mm-40 -131.44 131.3 43.44 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.889 -0.596 . . . . 20.0 110.71 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . 0.403 ' HA ' ' O ' ' A' ' 132' ' ' ARG . 50.9 mtm180 -127.35 95.68 4.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.203 -0.453 . . . . 20.0 110.156 178.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.528 HG13 ' CB ' ' A' ' 73' ' ' LYS . 41.5 t -119.22 145.44 25.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.813 -0.631 . . . . 20.0 111.2 -179.45 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.51 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 20.4 pt20 -79.27 131.23 36.09 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.174 -0.467 . . . . 20.0 109.803 179.53 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.567 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -78.46 125.49 29.44 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.088 0.471 . . . . 20.0 109.785 179.91 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.517 ' N ' ' O ' ' A' ' 70' ' ' ARG . 0.3 OUTLIER -85.77 131.96 34.22 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.435 -0.802 . . . . 20.0 111.665 -178.35 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . 0.547 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.5 OUTLIER . . . . . 0 C--N 1.323 -0.572 0 CA-C-N 115.16 -0.927 . . . . 20.0 109.035 179.028 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.159 0 N-CA-C 112.333 0.494 . . . . 20.0 112.333 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.407 ' N ' ' CD ' ' A' ' 129' ' ' PRO . . . -133.12 51.02 6.25 Favored Pre-proline 0 C--N 1.331 -0.23 0 N-CA-C 112.727 0.64 . . . . 20.0 112.727 -179.413 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . 0.436 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 45.6 Cg_endo -68.97 140.16 44.9 Favored 'Trans proline' 0 CA--C 1.528 0.177 0 C-N-CA 122.421 2.081 . . . . 20.0 112.528 179.277 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.539 ' HB2' ' CD1' ' A' ' 121' ' ' LEU . 70.1 mtp85 -142.11 134.22 27.54 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.406 -0.361 . . . . 20.0 110.659 179.34 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 22.3 t -85.02 135.46 34.01 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.791 0.329 . . . . 20.0 110.701 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . 0.491 ' NH1' ' O ' ' A' ' 65' ' ' THR . 66.8 ttt180 -143.53 140.9 30.49 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.158 0.429 . . . . 20.0 112.158 -179.082 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.403 ' HA ' ' O ' ' A' ' 117' ' ' GLN . 2.5 pttp -98.41 139.13 34.62 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.473 -0.566 . . . . 20.0 109.473 178.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . 0.469 HG21 HD21 ' A' ' 64' ' ' LEU . 13.1 m -145.33 128.57 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 CA-C-O 121.401 0.619 . . . . 20.0 111.364 -179.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . 0.499 ' HB3' ' HB2' ' A' ' 114' ' ' TYR . 55.9 mtm180 -81.59 122.15 27.23 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.939 -1.028 . . . . 20.0 110.007 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.637 ' N ' ' HB3' ' A' ' 114' ' ' TYR . 9.2 mt -117.5 126.19 52.17 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.878 0.37 . . . . 20.0 111.998 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.566 HG11 ' CZ ' ' A' ' 114' ' ' TYR . 0.2 OUTLIER -71.33 89.48 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.403 -0.362 . . . . 20.0 111.909 179.692 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -78.44 -9.38 59.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.176 0.512 . . . . 20.0 109.809 178.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.3 p . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 115.575 -0.739 . . . . 20.0 110.353 179.28 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . 0.605 ' CD2' ' HG ' ' A' ' 78' ' ' LEU . 56.1 m80 . . . . . 0 N--CA 1.455 -0.215 0 CA-C-O 120.868 0.366 . . . . 20.0 111.631 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.564 ' CE2' ' HB ' ' A' ' 79' ' ' VAL . 13.3 m-30 -120.22 154.92 34.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.193 0.52 . . . . 20.0 111.519 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.406 ' O ' ' OG1' ' A' ' 61' ' ' THR . 0.2 OUTLIER -100.81 86.43 3.09 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.511 -0.768 . . . . 20.0 111.435 -179.298 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.534 ' O ' ' CG2' ' A' ' 75' ' ' VAL . 37.4 ttp180 -117.66 119.73 35.85 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.606 -0.887 . . . . 20.0 108.606 178.373 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.593 ' CD1' ' O ' ' A' ' 73' ' ' LYS . 0.1 OUTLIER -106.75 -80.03 0.57 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.851 0.685 . . . . 20.0 112.851 -177.755 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.599 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -174.37 146.21 1.05 Allowed 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 120.692 -0.403 . . . . 20.0 112.035 -178.479 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 71.0 p -137.97 148.57 45.34 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.084 -0.507 . . . . 20.0 111.379 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.518 ' O ' ' C ' ' A' ' 67' ' ' GLY . 7.9 t0 -154.13 -167.5 2.66 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.108 -0.496 . . . . 20.0 109.835 179.051 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.835 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -32.56 149.17 0.01 OUTLIER Glycine 0 C--N 1.345 1.036 0 CA-C-O 118.171 -1.349 . . . . 20.0 110.197 179.093 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.503 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 77.6 Cg_exo -18.27 57.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 124.742 3.628 . . . . 20.0 114.949 -178.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.835 ' N ' ' O ' ' A' ' 67' ' ' GLY . 55.7 m -163.82 154.24 15.43 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 108.164 -1.05 . . . . 20.0 108.164 178.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.499 ' N ' ' O ' ' A' ' 122' ' ' LEU . 74.1 mtt85 -151.84 144.3 24.14 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.61 0.596 . . . . 20.0 112.61 -179.409 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.609 ' CA ' ' HA ' ' A' ' 121' ' ' LEU . 0.3 OUTLIER -83.17 164.39 20.22 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.318 -0.856 . . . . 20.0 110.14 178.659 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -152.16 34.52 0.52 Allowed 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.309 0.855 . . . . 20.0 113.309 -179.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.593 ' O ' ' CD1' ' A' ' 63' ' ' PHE . 21.8 mttm -82.35 148.55 59.52 Favored Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 109.193 -0.669 . . . . 20.0 109.193 178.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_endo -58.42 120.11 7.78 Favored 'Trans proline' 0 CA--C 1.525 0.072 0 C-N-CA 122.314 2.009 . . . . 20.0 112.871 -178.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.557 HG21 ' CD1' ' A' ' 63' ' ' PHE . 16.4 m -133.99 143.74 37.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.672 -0.695 . . . . 20.0 110.813 179.531 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 73.4 m -125.29 129.56 50.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.955 0.407 . . . . 20.0 111.55 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.52 ' O ' ' HA ' ' A' ' 59' ' ' HIS . 15.0 pt-20 -144.23 154.92 43.6 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.91 -0.586 . . . . 20.0 109.633 178.466 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.605 ' HG ' ' CD2' ' A' ' 59' ' ' HIS . 6.4 mp -88.18 148.38 24.43 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.377 0.608 . . . . 20.0 112.095 -179.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.668 ' CG2' ' O ' ' A' ' 79' ' ' VAL . 0.8 OUTLIER . . . . . 0 N--CA 1.444 -0.762 0 CA-C-N 114.909 -1.041 . . . . 20.0 109.119 179.082 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 48.8 t0 . . . . . 0 N--CA 1.457 -0.111 0 CA-C-O 120.676 0.274 . . . . 20.0 111.468 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . 0.485 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 57.9 ttp180 -127.22 146.12 50.53 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.881 0.372 . . . . 20.0 111.393 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.645 ' CE2' ' CG1' ' A' ' 137' ' ' VAL . 2.9 m-85 -120.89 154.68 35.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.842 -0.617 . . . . 20.0 111.562 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.468 ' HG2' ' NE2' ' A' ' 117' ' ' GLN . 58.9 ttm-85 -92.13 147.44 22.93 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 108.646 -0.872 . . . . 20.0 108.646 178.338 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -82.41 123.0 28.73 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 120.814 -0.355 . . . . 20.0 111.206 -179.132 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.468 ' NE2' ' HG2' ' A' ' 115' ' ' ARG . 82.9 mm-40 -126.4 125.44 42.19 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 116.308 -0.405 . . . . 20.0 110.352 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 67.2 ttp85 -124.34 100.17 6.56 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.248 0.547 . . . . 20.0 110.553 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.553 ' O ' ' CD1' ' A' ' 64' ' ' LEU . 86.2 t -125.1 147.66 29.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.372 -0.831 . . . . 20.0 111.093 -179.481 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.559 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 10.8 pt20 -92.12 133.87 35.37 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.858 -0.423 . . . . 20.0 109.858 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.609 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -78.24 135.16 37.52 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.25 0.547 . . . . 20.0 111.759 -178.82 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.499 ' O ' ' N ' ' A' ' 70' ' ' ARG . 0.3 OUTLIER -82.39 146.84 29.12 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.248 -0.887 . . . . 20.0 110.282 179.801 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . 0.426 ' SG ' ' O ' ' A' ' 128' ' ' ALA . 3.5 m . . . . . 0 N--CA 1.45 -0.428 0 CA-C-O 120.975 0.417 . . . . 20.0 110.768 -178.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.186 0 N-CA-C 111.872 0.323 . . . . 20.0 111.872 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . 0.426 ' O ' ' SG ' ' A' ' 123' ' ' CYS . . . -120.85 63.89 11.54 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 121.117 0.484 . . . . 20.0 110.624 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -57.93 151.01 60.13 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.98 2.453 . . . . 20.0 112.015 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.562 ' O ' ' N ' ' A' ' 121' ' ' LEU . 73.8 mtp85 -124.12 154.75 39.55 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 116.3 -0.409 . . . . 20.0 110.915 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.414 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 47.0 t -106.2 133.12 51.4 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.786 0.327 . . . . 20.0 111.789 -179.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 58.0 ttt85 -147.8 138.3 23.08 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 112.223 0.453 . . . . 20.0 112.223 179.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.463 ' O ' HG21 ' A' ' 134' ' ' VAL . 12.5 pttp -94.45 146.84 23.8 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.08 -0.509 . . . . 20.0 109.706 178.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . 0.543 ' CG2' HD21 ' A' ' 64' ' ' LEU . 4.9 t -147.28 127.84 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.71 0 CA-C-O 121.485 0.659 . . . . 20.0 111.95 -179.206 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . 0.521 ' HB2' ' HB2' ' A' ' 114' ' ' TYR . 31.4 ptt180 -93.13 121.2 34.24 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.87 -1.059 . . . . 20.0 109.966 179.193 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.6 ' N ' ' CD2' ' A' ' 136' ' ' LEU . 0.7 OUTLIER -114.45 126.55 55.09 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.395 0.517 . . . . 20.0 112.395 -178.497 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.645 ' CG1' ' CE2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -53.43 84.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.551 -0.295 . . . . 20.0 111.713 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.493 ' N ' ' O ' ' A' ' 136' ' ' LEU . . . -64.72 -20.32 66.26 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.303 0.573 . . . . 20.0 110.152 179.28 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 36.1 t . . . . . 0 C--N 1.327 -0.377 0 CA-C-N 115.404 -0.816 . . . . 20.0 110.483 179.508 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 1.4 m170 . . . . . 0 N--CA 1.451 -0.385 0 N-CA-C 109.014 -0.736 . . . . 20.0 109.014 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.566 ' CE1' HG13 ' A' ' 79' ' ' VAL . 5.7 p90 -126.64 157.69 38.31 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.948 0.404 . . . . 20.0 111.711 -177.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.421 HG21 ' O ' ' A' ' 75' ' ' VAL . 3.0 p -105.1 95.11 5.62 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.941 -0.572 . . . . 20.0 111.981 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.447 ' O ' HG21 ' A' ' 75' ' ' VAL . 55.0 ttm-85 -116.98 125.11 50.9 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.263 -1.014 . . . . 20.0 108.263 177.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.511 ' CD2' ' O ' ' A' ' 73' ' ' LYS . 0.0 OUTLIER -116.9 -79.81 0.59 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 113.442 0.904 . . . . 20.0 113.442 -177.13 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.626 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -171.21 141.15 1.57 Allowed 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.443 -0.503 . . . . 20.0 112.293 -177.269 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 30.6 p -134.42 133.59 40.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.483 . . . . 20.0 110.395 178.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.507 ' O ' ' C ' ' A' ' 67' ' ' GLY . 15.0 t0 -148.86 -162.31 1.53 Allowed 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.365 -0.379 . . . . 20.0 110.056 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.841 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -31.2 148.25 0.01 OUTLIER Glycine 0 C--N 1.344 1.015 0 CA-C-O 118.343 -1.254 . . . . 20.0 110.485 179.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.488 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 19.5 Cg_exo -16.51 60.21 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 124.75 3.633 . . . . 20.0 113.993 -178.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.841 ' N ' ' O ' ' A' ' 67' ' ' GLY . 59.9 m -163.14 150.77 13.25 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 114.923 -1.035 . . . . 20.0 109.251 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.4 ' O ' HD13 ' A' ' 122' ' ' LEU . 57.3 ttt180 -145.68 124.55 12.69 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.84 0.352 . . . . 20.0 110.672 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.626 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -74.71 156.59 36.47 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 116.109 -0.496 . . . . 20.0 110.324 179.669 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.467 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -150.45 31.94 0.65 Allowed 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 113.305 0.854 . . . . 20.0 113.305 -179.47 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.511 ' O ' ' CD2' ' A' ' 63' ' ' PHE . 6.8 ttmt -75.24 144.97 79.46 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.985 -0.376 . . . . 20.0 109.985 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.449 ' HD2' ' CG ' ' A' ' 73' ' ' LYS . 50.2 Cg_exo -53.11 113.1 1.12 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.169 1.913 . . . . 20.0 112.002 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.447 HG21 ' O ' ' A' ' 62' ' ' ARG . 24.1 m -132.13 149.4 32.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.971 -0.559 . . . . 20.0 111.567 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 6.1 m -115.01 118.13 32.55 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.568 -0.53 . . . . 20.0 109.568 178.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.482 ' OE1' ' CB ' ' A' ' 136' ' ' LEU . 44.1 mm-40 -125.04 151.12 46.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.521 -0.308 . . . . 20.0 110.769 -179.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.53 ' N ' HD12 ' A' ' 78' ' ' LEU . 6.0 mp -119.34 125.55 49.3 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 113.054 0.761 . . . . 20.0 113.054 -179.014 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.566 HG13 ' CE1' ' A' ' 60' ' ' TYR . 2.5 m . . . . . 0 N--CA 1.448 -0.547 0 CA-C-N 114.473 -1.24 . . . . 20.0 109.698 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 21.0 t70 . . . . . 0 CA--C 1.532 0.26 0 N-CA-C 112.69 0.626 . . . . 20.0 112.69 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . 0.482 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 39.2 ttm180 -119.31 151.0 39.18 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.732 0.301 . . . . 20.0 111.72 -178.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.502 ' HA ' ' HA ' ' A' ' 137' ' ' VAL . 4.4 m-85 -122.71 141.99 51.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.942 -0.572 . . . . 20.0 111.539 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.51 ' NE ' ' HB1' ' A' ' 138' ' ' ALA . 30.7 ttp180 -93.15 143.85 25.85 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 115.757 -0.656 . . . . 20.0 109.402 178.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -76.13 132.88 40.29 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.012 0.434 . . . . 20.0 111.198 -178.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.434 ' N ' ' O ' ' A' ' 134' ' ' VAL . 95.1 mm-40 -125.31 137.39 54.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.829 -0.623 . . . . 20.0 110.723 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . 0.425 ' C ' HG23 ' A' ' 119' ' ' VAL . 70.6 ttt-85 -130.2 106.9 8.9 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.11 -0.495 . . . . 20.0 110.863 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.535 ' O ' ' CD1' ' A' ' 64' ' ' LEU . 21.5 t -135.03 152.16 32.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.062 -0.517 . . . . 20.0 111.358 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.533 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 11.1 pt20 -92.24 130.27 37.98 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.512 -0.313 . . . . 20.0 110.406 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.607 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.2 OUTLIER -77.0 126.61 31.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.005 0.431 . . . . 20.0 110.8 -179.982 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.467 HD11 ' N ' ' A' ' 72' ' ' ALA . 0.3 OUTLIER -90.64 134.83 34.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.93 -0.577 . . . . 20.0 111.419 -179.388 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . 0.41 ' HB3' ' O ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.849 -0.614 . . . . 20.0 109.981 179.367 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.171 0 N-CA-C 111.896 0.332 . . . . 20.0 111.896 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -116.61 62.48 2.62 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 112.232 0.456 . . . . 20.0 112.232 -179.02 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -49.91 146.7 16.01 Favored 'Trans proline' 0 N--CA 1.463 -0.295 0 C-N-CA 122.511 2.14 . . . . 20.0 110.898 178.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.533 ' O ' ' HA ' ' A' ' 120' ' ' GLN . 14.6 mtp-105 -127.84 154.3 45.62 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 121.01 -0.276 . . . . 20.0 111.467 -179.056 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 99.7 p -105.18 139.85 39.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.326 -0.397 . . . . 20.0 111.303 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 53.9 ttt85 -145.51 138.9 26.41 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.085 0.469 . . . . 20.0 112.045 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.452 ' O ' HG21 ' A' ' 134' ' ' VAL . 0.5 OUTLIER -91.38 141.93 28.23 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.696 -0.684 . . . . 20.0 109.404 178.459 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . 0.456 HG23 HD21 ' A' ' 64' ' ' LEU . 2.8 t -145.47 125.72 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 CA-C-O 121.318 0.58 . . . . 20.0 111.812 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . 0.432 ' O ' ' HG3' ' A' ' 135' ' ' ARG . 49.5 ptt85 -99.21 113.82 26.29 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.155 -0.929 . . . . 20.0 110.175 179.015 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.482 ' CB ' ' OE1' ' A' ' 77' ' ' GLU . 32.5 mt -127.61 148.99 50.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.067 0.46 . . . . 20.0 111.311 -179.801 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.502 ' HA ' ' HA ' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -57.55 92.75 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.728 -0.669 . . . . 20.0 112.397 -179.451 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.51 ' HB1' ' NE ' ' A' ' 115' ' ' ARG . . . -73.94 -13.06 60.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.142 0.496 . . . . 20.0 109.825 178.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 96.3 p . . . . . 0 C--N 1.333 -0.139 0 CA-C-N 115.697 -0.683 . . . . 20.0 110.089 179.108 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 4.2 m170 . . . . . 0 N--CA 1.466 0.33 0 CA-C-O 120.851 0.357 . . . . 20.0 110.991 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.529 ' CE1' HG23 ' A' ' 79' ' ' VAL . 79.5 m-85 -119.83 159.32 24.82 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 112.432 0.53 . . . . 20.0 112.432 -178.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 42.5 p -123.62 83.85 2.19 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-N 115.705 -0.679 . . . . 20.0 110.442 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 63.9 mtm180 -118.55 123.84 46.05 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 107.857 -1.164 . . . . 20.0 107.857 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.544 ' CD2' ' O ' ' A' ' 73' ' ' LYS . 0.0 OUTLIER -108.07 -78.71 0.58 Allowed 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.609 0.596 . . . . 20.0 112.609 -177.189 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.548 ' CD1' ' HB3' ' A' ' 71' ' ' SER . 0.0 OUTLIER -169.09 138.43 2.12 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.539 -0.464 . . . . 20.0 112.133 -178.246 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.6 p -129.26 143.57 50.9 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.514 -0.55 . . . . 20.0 109.514 177.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.552 ' O ' ' C ' ' A' ' 67' ' ' GLY . 5.9 t0 -153.0 -162.69 1.54 Allowed 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.94 -0.393 . . . . 20.0 109.94 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.872 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -29.05 141.64 0.01 OUTLIER Glycine 0 C--N 1.345 1.039 0 CA-C-O 118.424 -1.209 . . . . 20.0 110.301 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.513 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 56.2 Cg_exo -15.77 55.02 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 125.287 3.991 . . . . 20.0 114.514 -178.414 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.872 ' N ' ' O ' ' A' ' 67' ' ' GLY . 19.6 m -162.81 167.34 23.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.005 -0.998 . . . . 20.0 108.537 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 65.0 ttt180 -161.35 143.86 12.2 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.965 -0.294 . . . . 20.0 111.523 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.621 ' CA ' ' HA ' ' A' ' 121' ' ' LEU . 0.9 OUTLIER -83.86 171.17 13.34 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 116.442 -0.345 . . . . 20.0 110.253 178.996 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -152.29 25.54 0.61 Allowed 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 113.44 0.904 . . . . 20.0 113.44 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.544 ' O ' ' CD2' ' A' ' 63' ' ' PHE . 0.2 OUTLIER -68.49 144.19 96.13 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 109.165 -0.679 . . . . 20.0 109.165 178.901 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.92 114.64 1.99 Allowed 'Trans proline' 0 CA--C 1.527 0.17 0 C-N-CA 122.411 2.074 . . . . 20.0 112.329 -179.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.511 HG13 ' O ' ' A' ' 73' ' ' LYS . 16.1 m -130.85 155.36 41.84 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.167 0 CA-C-O 120.955 0.407 . . . . 20.0 111.518 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 70.4 m -116.36 123.93 48.82 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.99 -0.55 . . . . 20.0 110.601 179.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.476 ' OE1' ' HB3' ' A' ' 136' ' ' LEU . 52.6 tp10 -121.73 127.51 50.77 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.193 -0.458 . . . . 20.0 110.4 179.255 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.533 ' CD1' ' N ' ' A' ' 78' ' ' LEU . 1.7 mp -112.91 122.89 48.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.413 0.625 . . . . 20.0 111.551 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.638 ' CG2' ' O ' ' A' ' 79' ' ' VAL . 1.5 m . . . . . 0 C--N 1.322 -0.605 0 CA-C-O 122.065 0.936 . . . . 20.0 108.891 178.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 . . . . . 0 CA--C 1.53 0.194 0 N-CA-C 111.957 0.354 . . . . 20.0 111.957 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . 0.541 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 40.9 ttm180 -124.61 151.8 44.37 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.968 0.358 . . . . 20.0 111.968 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.621 ' CD2' ' N ' ' A' ' 137' ' ' VAL . 0.9 OUTLIER -130.11 152.92 49.03 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.609 -0.723 . . . . 20.0 111.724 -179.693 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.571 ' O ' ' HA ' ' A' ' 135' ' ' ARG . 18.3 ttm-85 -93.98 137.61 33.0 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 115.868 -0.605 . . . . 20.0 109.7 178.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -82.1 120.86 25.84 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.756 0.312 . . . . 20.0 110.847 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.491 ' CG ' ' O ' ' A' ' 134' ' ' VAL . 9.2 pt20 -133.55 139.55 46.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.98 0.419 . . . . 20.0 111.269 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 71.7 mtp85 -123.14 108.81 13.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.926 -0.579 . . . . 20.0 110.841 179.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.531 ' O ' ' CD1' ' A' ' 64' ' ' LEU . 74.8 t -120.36 145.06 27.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.786 -0.643 . . . . 20.0 110.773 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.527 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 26.9 mp0 -88.0 127.82 35.39 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.208 -0.451 . . . . 20.0 110.445 -179.748 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.621 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.2 OUTLIER -76.68 126.99 31.94 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.393 0.616 . . . . 20.0 111.589 -178.61 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.489 ' CD1' ' HA ' ' A' ' 71' ' ' SER . 3.1 mp -89.38 141.99 28.06 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.083 -0.962 . . . . 20.0 111.713 -179.149 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . 0.513 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.2 OUTLIER . . . . . 0 C--N 1.322 -0.626 0 CA-C-N 115.563 -0.744 . . . . 20.0 109.248 178.271 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.111 0 CA-C-O 120.559 0.219 . . . . 20.0 111.567 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -121.52 60.77 10.88 Favored Pre-proline 0 C--N 1.332 -0.18 0 CA-C-O 120.944 0.402 . . . . 20.0 111.895 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -48.57 152.6 3.98 Favored 'Trans proline' 0 CA--C 1.528 0.213 0 C-N-CA 123.48 2.787 . . . . 20.0 112.483 179.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.527 ' O ' ' HA ' ' A' ' 120' ' ' GLN . 80.5 mtt-85 -125.43 158.58 34.03 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.352 -0.385 . . . . 20.0 111.088 -179.249 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 9.7 t -114.66 136.67 52.79 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.511 -0.313 . . . . 20.0 110.742 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . 0.406 ' HD3' ' CB ' ' A' ' 64' ' ' LEU . 52.9 ttt85 -148.74 136.05 20.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.848 0.356 . . . . 20.0 111.793 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.401 ' O ' HG23 ' A' ' 134' ' ' VAL . 25.1 pttm -96.45 140.53 30.96 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.69 -0.485 . . . . 20.0 109.69 178.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . 0.537 HG11 HD22 ' A' ' 136' ' ' LEU . 7.8 t -145.44 125.96 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 CA-C-O 121.198 0.523 . . . . 20.0 111.779 -178.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . 0.571 ' HA ' ' O ' ' A' ' 115' ' ' ARG . 39.1 ttt180 -99.03 111.9 24.17 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.561 -0.745 . . . . 20.0 109.43 178.325 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.537 HD22 HG11 ' A' ' 134' ' ' VAL . 22.0 mt -113.31 140.04 48.34 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.749 0.648 . . . . 20.0 112.749 -178.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.621 ' N ' ' CD2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -58.93 84.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 CA-C-N 116.219 -0.446 . . . . 20.0 111.455 179.43 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -74.14 -12.06 60.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.94 0.4 . . . . 20.0 110.43 179.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.5 t . . . . . 0 C--N 1.332 -0.189 0 CA-C-N 115.89 -0.595 . . . . 20.0 110.358 179.231 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 5.9 m170 . . . . . 0 N--CA 1.453 -0.296 0 CA-C-O 120.829 0.347 . . . . 20.0 110.576 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.578 ' CD1' HG11 ' A' ' 79' ' ' VAL . 0.5 OUTLIER -143.5 163.07 34.17 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.212 -0.449 . . . . 20.0 110.362 -179.858 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 30.1 p -106.99 93.32 4.49 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 112.862 0.69 . . . . 20.0 112.862 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.49 ' O ' ' CG2' ' A' ' 75' ' ' VAL . 23.1 mtt-85 -127.26 127.71 44.83 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 108.043 -1.095 . . . . 20.0 108.043 176.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.517 ' CD2' ' O ' ' A' ' 73' ' ' LYS . 0.0 OUTLIER -118.47 -79.51 0.6 Allowed 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 113.053 0.76 . . . . 20.0 113.053 -177.0 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.619 ' CD2' ' CG2' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -166.43 136.96 3.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.014 0.435 . . . . 20.0 111.984 -178.314 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.488 HG23 ' HD3' ' A' ' 70' ' ' ARG . 59.9 p -129.88 140.01 51.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.719 -0.673 . . . . 20.0 110.356 178.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.535 ' O ' ' C ' ' A' ' 67' ' ' GLY . 11.7 t0 -147.86 -164.32 1.98 Allowed 'General case' 0 C--O 1.236 0.353 0 N-CA-C 109.968 -0.382 . . . . 20.0 109.968 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.866 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -30.67 146.04 0.01 OUTLIER Glycine 0 C--N 1.343 0.963 0 N-CA-C 110.2 -1.16 . . . . 20.0 110.2 179.48 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.493 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 59.4 Cg_exo -16.43 55.19 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 125.256 3.971 . . . . 20.0 115.037 -178.365 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.866 ' N ' ' O ' ' A' ' 67' ' ' GLY . 33.4 m -163.89 163.8 23.59 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.476 -0.935 . . . . 20.0 108.476 178.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.488 ' HD3' HG23 ' A' ' 65' ' ' THR . 82.1 mtt85 -157.71 148.02 20.68 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.342 0.591 . . . . 20.0 112.357 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.618 ' CA ' ' HA ' ' A' ' 121' ' ' LEU . 0.0 OUTLIER -88.26 164.06 15.79 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 115.302 -0.863 . . . . 20.0 109.952 178.568 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -149.73 26.77 0.82 Allowed 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 119.957 -0.697 . . . . 20.0 112.734 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.517 ' O ' ' CD2' ' A' ' 63' ' ' PHE . 1.3 mptp? -73.58 145.7 85.1 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-O 120.888 0.375 . . . . 20.0 110.277 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -49.84 123.03 9.98 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.797 2.331 . . . . 20.0 112.79 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.515 HG22 ' CD2' ' A' ' 63' ' ' PHE . 23.9 m -137.73 145.53 28.9 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.162 0 CA-C-N 116.053 -0.521 . . . . 20.0 111.503 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 21.3 m -123.18 115.27 21.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.915 -0.584 . . . . 20.0 109.625 178.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.512 ' HB2' ' CZ ' ' A' ' 60' ' ' TYR . 48.1 mt-10 -130.26 163.43 26.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.629 0.252 . . . . 20.0 110.818 -179.527 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.523 ' CD1' ' O ' ' A' ' 137' ' ' VAL . 6.0 mp -118.11 136.69 53.43 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 121.139 0.495 . . . . 20.0 111.578 179.098 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.578 HG11 ' CD1' ' A' ' 60' ' ' TYR . 19.7 m . . . . . 0 C--N 1.325 -0.479 0 CA-C-N 115.677 -0.692 . . . . 20.0 110.287 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 . . . . . 0 CA--C 1.531 0.224 0 N-CA-C 111.922 0.342 . . . . 20.0 111.922 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . 0.547 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 24.9 ttm105 -125.93 145.18 50.38 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.525 0.202 . . . . 20.0 111.224 -179.582 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.58 ' CD1' HG12 ' A' ' 137' ' ' VAL . 0.8 OUTLIER -118.57 159.82 22.88 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 121.448 0.642 . . . . 20.0 111.941 -179.513 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.513 ' HG2' ' NE2' ' A' ' 117' ' ' GLN . 38.5 ttm-85 -100.89 140.45 35.16 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 114.768 -1.105 . . . . 20.0 108.702 178.191 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -80.45 123.32 27.96 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 116.116 -0.493 . . . . 20.0 111.394 -178.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.513 ' NE2' ' HG2' ' A' ' 115' ' ' ARG . 80.1 mm-40 -124.93 124.77 42.74 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.971 -0.559 . . . . 20.0 109.887 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 67.0 ttp85 -130.28 92.43 3.28 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.025 0.441 . . . . 20.0 111.055 -179.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.619 ' CG2' ' CD2' ' A' ' 64' ' ' LEU . 35.1 m -126.3 170.22 16.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.562 -0.745 . . . . 20.0 110.666 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.537 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 13.0 pt20 -110.94 138.58 47.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.998 0.428 . . . . 20.0 110.946 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.618 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -75.82 125.04 28.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.975 -0.557 . . . . 20.0 110.928 -179.608 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.533 ' CD1' ' HA ' ' A' ' 71' ' ' SER . 1.9 mp -91.45 142.96 27.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.478 -0.783 . . . . 20.0 111.742 -178.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . 0.493 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.4 OUTLIER . . . . . 0 C--N 1.323 -0.564 0 CA-C-N 115.372 -0.831 . . . . 20.0 110.538 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.207 0 N-CA-C 112.053 0.39 . . . . 20.0 112.053 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -125.87 56.36 15.25 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 120.905 0.383 . . . . 20.0 111.506 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -52.82 146.92 33.97 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.642 2.228 . . . . 20.0 111.458 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.537 ' O ' ' HA ' ' A' ' 120' ' ' GLN . 79.8 mtt85 -125.69 150.6 47.51 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.16 -0.473 . . . . 20.0 111.112 -179.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.522 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 14.1 p -102.94 133.76 47.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.955 -0.566 . . . . 20.0 110.449 179.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 67.6 ttt180 -144.8 141.48 29.21 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.002 -0.545 . . . . 20.0 111.269 -179.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.43 ' O ' HG13 ' A' ' 134' ' ' VAL . 14.4 pttp -103.3 149.65 24.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 20.0 110.414 179.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . 0.507 ' O ' ' CD2' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -151.88 130.28 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 CA-C-O 121.195 0.521 . . . . 20.0 111.399 -179.279 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 86.1 mtm-85 -91.15 122.6 33.93 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.603 -0.726 . . . . 20.0 109.719 178.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.587 ' N ' ' CD2' ' A' ' 136' ' ' LEU . 0.7 OUTLIER -121.23 127.01 51.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.252 0.549 . . . . 20.0 112.341 -178.655 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.58 HG12 ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -55.49 92.0 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.937 -0.574 . . . . 20.0 111.803 179.639 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.443 ' C ' HD11 ' A' ' 78' ' ' LEU . . . -81.48 -5.72 58.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.196 -0.456 . . . . 20.0 110.616 179.303 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 115.756 -0.656 . . . . 20.0 109.677 179.273 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . 0.407 ' C ' ' CD1' ' A' ' 60' ' ' TYR . 24.0 m170 . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.771 0.32 . . . . 20.0 110.717 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.591 ' CZ ' HG12 ' A' ' 79' ' ' VAL . 2.7 m-85 -132.06 150.08 52.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 20.0 111.381 -179.007 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -97.51 96.99 8.7 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.984 -0.553 . . . . 20.0 111.75 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.495 ' O ' HD12 ' A' ' 136' ' ' LEU . 23.2 tpt180 -126.28 121.6 33.11 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 107.714 -1.217 . . . . 20.0 107.714 177.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.606 ' CD2' ' O ' ' A' ' 73' ' ' LYS . 0.0 OUTLIER -112.48 -81.28 0.59 Allowed 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.003 -0.679 . . . . 20.0 112.702 -177.445 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.637 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -169.06 137.6 2.02 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.214 -0.594 . . . . 20.0 112.203 -178.192 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 51.9 p -129.74 136.42 49.63 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.721 -0.672 . . . . 20.0 109.246 178.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.527 ' O ' ' C ' ' A' ' 67' ' ' GLY . 8.6 t0 -148.82 -158.31 0.9 Allowed 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.606 -0.438 . . . . 20.0 111.008 -179.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.864 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -31.37 141.5 0.04 OUTLIER Glycine 0 C--N 1.346 1.118 0 N-CA-C 109.718 -1.353 . . . . 20.0 109.718 179.518 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.521 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 20.1 Cg_exo -15.54 53.16 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.889 1 C-N-CA 125.409 4.072 . . . . 20.0 115.48 -178.207 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.864 ' N ' ' O ' ' A' ' 67' ' ' GLY . 65.4 m -159.29 162.85 36.1 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 107.885 -1.154 . . . . 20.0 107.885 178.093 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -148.41 137.94 22.1 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.567 0.58 . . . . 20.0 112.567 -179.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.637 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.6 OUTLIER -81.15 162.91 23.46 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 115.931 -0.577 . . . . 20.0 110.278 178.543 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -151.7 27.83 0.63 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.942 0.719 . . . . 20.0 112.942 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.606 ' O ' ' CD2' ' A' ' 63' ' ' PHE . 9.9 tttt -71.17 150.5 94.56 Favored Pre-proline 0 C--N 1.327 -0.379 0 N-CA-C 109.85 -0.426 . . . . 20.0 109.85 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.525 ' HD2' ' CG ' ' A' ' 73' ' ' LYS . 41.9 Cg_exo -59.85 115.07 2.37 Favored 'Trans proline' 0 N--CA 1.464 -0.247 0 C-N-CA 122.175 1.917 . . . . 20.0 112.241 -179.258 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.581 HG23 ' CD2' ' A' ' 63' ' ' PHE . 4.9 m -134.77 155.42 38.43 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.202 0 CA-C-N 115.676 -0.693 . . . . 20.0 111.062 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 18.7 m -126.76 121.76 32.89 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.717 -0.674 . . . . 20.0 109.813 179.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.443 ' OE2' ' HB2' ' A' ' 62' ' ' ARG . 6.1 pt-20 -130.58 150.78 51.62 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.041 0.448 . . . . 20.0 111.404 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.418 ' CD1' ' N ' ' A' ' 78' ' ' LEU . 5.2 mp -102.6 141.09 35.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.884 -0.598 . . . . 20.0 111.104 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.591 HG12 ' CZ ' ' A' ' 60' ' ' TYR . 5.8 m . . . . . 0 N--CA 1.446 -0.641 0 N-CA-C 109.207 -0.664 . . . . 20.0 109.207 178.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 10.5 t70 . . . . . 0 N--CA 1.456 -0.162 0 CA-C-O 120.876 0.37 . . . . 20.0 111.232 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . 0.531 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 21.4 ttm180 -125.92 141.93 51.75 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.088 -0.506 . . . . 20.0 111.008 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.591 ' CE2' HG11 ' A' ' 137' ' ' VAL . 0.8 OUTLIER -116.59 159.39 22.21 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-O 121.677 0.751 . . . . 20.0 112.098 -179.477 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.416 ' HD2' ' NE2' ' A' ' 117' ' ' GLN . 47.2 ttm-85 -97.5 146.49 25.19 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 114.423 -1.262 . . . . 20.0 108.413 177.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . 0.503 ' O ' ' NE2' ' A' ' 117' ' ' GLN . . . -83.31 136.42 34.38 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 120.717 -0.393 . . . . 20.0 111.691 -178.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.511 ' HB2' HG23 ' A' ' 134' ' ' VAL . 91.0 mm-40 -134.47 135.26 42.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.984 -0.553 . . . . 20.0 110.81 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 58.3 ttt-85 -128.38 93.96 3.77 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.359 -0.382 . . . . 20.0 110.298 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.579 ' CG1' ' HB2' ' A' ' 73' ' ' LYS . 25.1 t -129.17 144.69 37.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 N-CA-C 112.501 0.556 . . . . 20.0 112.501 -178.469 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.49 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 19.0 pt20 -88.24 131.15 34.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.169 -0.469 . . . . 20.0 110.711 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.581 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -77.26 116.15 17.63 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.08 -0.509 . . . . 20.0 111.163 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.489 HD11 ' HA ' ' A' ' 71' ' ' SER . 0.2 OUTLIER -80.27 150.67 29.92 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.6 -0.727 . . . . 20.0 111.107 -179.922 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . 0.521 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER . . . . . 0 C--N 1.332 -0.184 0 CA-C-O 120.827 0.346 . . . . 20.0 110.81 179.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.431 ' C ' ' HD3' ' A' ' 129' ' ' PRO . . . . . . . . 0 N--CA 1.462 0.129 0 N-CA-C 112.968 0.729 . . . . 20.0 112.968 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -114.16 60.52 1.0 Allowed Pre-proline 0 C--N 1.327 -0.375 0 CA-C-O 121.093 0.473 . . . . 20.0 110.533 178.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . 0.433 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 41.3 Cg_endo -68.62 146.88 68.79 Favored 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 123.38 2.72 . . . . 20.0 112.71 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.49 ' O ' ' HA ' ' A' ' 120' ' ' GLN . 83.2 mtt85 -134.35 148.36 50.7 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.874 -0.603 . . . . 20.0 110.46 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.478 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 57.8 p -89.8 141.12 28.93 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 121.096 -0.241 . . . . 20.0 110.869 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 53.4 ttt85 -146.86 148.39 31.8 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.135 0.493 . . . . 20.0 112.135 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 1.9 pttt -101.39 145.72 28.55 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 115.382 -0.826 . . . . 20.0 109.884 178.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . 0.511 HG23 ' HB2' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -149.29 126.54 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-O 121.399 0.619 . . . . 20.0 111.448 179.86 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . 0.514 ' HB3' ' HB2' ' A' ' 114' ' ' TYR . 85.1 mtm180 -95.42 112.76 24.42 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.061 -0.972 . . . . 20.0 109.771 179.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.548 ' N ' ' HB3' ' A' ' 114' ' ' TYR . 1.7 mt -113.99 125.35 53.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.524 0.678 . . . . 20.0 112.677 -179.489 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.591 HG11 ' CE2' ' A' ' 114' ' ' TYR . 2.3 m -55.39 90.77 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.088 -0.96 . . . . 20.0 112.835 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -65.53 -25.46 67.46 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.488 -0.93 . . . . 20.0 108.488 177.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 26.3 p . . . . . 0 CA--C 1.531 0.223 0 CA-C-N 114.992 -1.004 . . . . 20.0 110.632 179.146 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . 0.417 ' C ' ' CD1' ' A' ' 60' ' ' TYR . 9.0 m170 . . . . . 0 CA--C 1.52 -0.193 0 CA-C-O 121.052 0.453 . . . . 20.0 111.181 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.598 ' CE1' HG21 ' A' ' 79' ' ' VAL . 10.2 m-85 -133.77 148.74 51.4 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.732 -0.667 . . . . 20.0 111.697 -178.684 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 73.2 p -103.29 82.46 2.06 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.178 -0.465 . . . . 20.0 111.318 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.519 ' CB ' ' OE1' ' A' ' 77' ' ' GLU . 68.0 ttt180 -114.93 123.19 48.5 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 108.405 -0.961 . . . . 20.0 108.405 177.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.538 ' CD1' HG22 ' A' ' 75' ' ' VAL . 0.1 OUTLIER -110.6 -80.24 0.58 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.154 0.427 . . . . 20.0 112.154 -177.859 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.633 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -166.92 133.97 2.43 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.62 -0.432 . . . . 20.0 111.089 -178.887 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 49.4 p -131.04 141.68 50.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.355 -0.384 . . . . 20.0 110.756 179.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.525 ' O ' ' C ' ' A' ' 67' ' ' GLY . 9.3 t0 -152.37 -163.92 1.84 Allowed 'General case' 0 C--O 1.236 0.382 0 N-CA-C 109.785 -0.45 . . . . 20.0 109.785 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.861 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -31.85 148.17 0.01 OUTLIER Glycine 0 C--N 1.345 1.058 0 CA-C-O 118.098 -1.39 . . . . 20.0 110.167 179.135 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.524 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 41.6 Cg_exo -18.14 54.44 0.0 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 124.971 3.78 . . . . 20.0 115.289 -178.255 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.861 ' N ' ' O ' ' A' ' 67' ' ' GLY . 59.1 m -162.66 153.76 17.45 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 115.603 -0.726 . . . . 20.0 109.117 179.118 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.526 ' O ' ' N ' ' A' ' 122' ' ' LEU . 95.5 mtt180 -150.29 150.01 30.92 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.213 0.53 . . . . 20.0 112.335 -179.672 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.633 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -90.21 161.52 15.68 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 115.445 -0.798 . . . . 20.0 110.105 178.496 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.18 35.17 0.99 Allowed 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 114.276 1.213 . . . . 20.0 114.276 -179.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.519 ' HG2' HG11 ' A' ' 119' ' ' VAL . 0.9 OUTLIER -80.19 157.75 72.89 Favored Pre-proline 0 C--N 1.327 -0.387 0 C-N-CA 120.632 -0.427 . . . . 20.0 109.989 178.736 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -61.92 116.27 3.35 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.479 2.12 . . . . 20.0 112.513 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.538 HG22 ' CD1' ' A' ' 63' ' ' PHE . 8.3 m -133.71 154.44 38.51 Favored 'Isoleucine or valine' 0 C--O 1.23 0.037 0 CA-C-O 120.857 0.36 . . . . 20.0 111.675 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 45.4 m -117.93 121.49 40.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.96 -0.563 . . . . 20.0 109.98 178.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.519 ' OE1' ' CB ' ' A' ' 62' ' ' ARG . 81.0 tt0 -123.92 141.52 51.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.962 0.41 . . . . 20.0 111.814 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.567 ' CD1' ' N ' ' A' ' 78' ' ' LEU . 1.5 mp -117.57 125.68 51.23 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.864 -0.607 . . . . 20.0 110.965 179.297 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.598 HG21 ' CE1' ' A' ' 60' ' ' TYR . 18.5 m . . . . . 0 N--CA 1.446 -0.657 0 CA-C-N 115.779 -0.646 . . . . 20.0 110.746 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 . . . . . 0 CA--C 1.528 0.13 0 N-CA-C 112.327 0.491 . . . . 20.0 112.327 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . 0.447 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 42.3 ttm180 -121.69 147.87 45.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.033 0.444 . . . . 20.0 112.002 -178.597 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.597 ' N ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -125.76 158.72 34.19 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.822 -0.626 . . . . 20.0 111.3 179.844 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 62.0 ttm-85 -93.51 142.53 27.24 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.661 -0.866 . . . . 20.0 108.661 178.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -80.78 132.81 35.55 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.138 0.494 . . . . 20.0 111.771 -178.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.482 ' HB2' HG21 ' A' ' 134' ' ' VAL . 92.1 mm-40 -129.62 144.32 51.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.457 -0.792 . . . . 20.0 109.967 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 48.7 ttp180 -139.65 91.08 2.45 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.507 -0.315 . . . . 20.0 110.7 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.519 HG11 ' HG2' ' A' ' 73' ' ' LYS . 0.6 OUTLIER -125.57 164.37 25.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.387 -0.37 . . . . 20.0 110.885 -179.869 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.543 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 14.0 pt20 -106.22 138.37 42.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.155 0.503 . . . . 20.0 111.137 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.613 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -79.43 126.91 31.45 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.573 -0.739 . . . . 20.0 111.443 -179.787 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.526 ' N ' ' O ' ' A' ' 70' ' ' ARG . 0.3 OUTLIER -76.2 144.53 40.41 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.236 -0.893 . . . . 20.0 109.773 179.29 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 3.0 m . . . . . 0 C--N 1.324 -0.505 0 CA-C-N 116.104 -0.498 . . . . 20.0 110.113 -178.977 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.19 0 N-CA-C 112.382 0.512 . . . . 20.0 112.382 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -120.44 66.28 12.38 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-O 121.096 0.474 . . . . 20.0 110.393 179.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_endo -52.05 148.88 22.57 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 123.101 2.534 . . . . 20.0 112.635 -179.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.543 ' O ' ' HA ' ' A' ' 120' ' ' GLN . 56.7 mtp85 -125.75 151.55 46.54 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.039 -0.528 . . . . 20.0 110.496 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.423 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 47.5 t -102.72 135.88 43.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.682 0.277 . . . . 20.0 110.392 179.653 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 25.7 tpt180 -144.72 144.82 31.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.169 0.509 . . . . 20.0 111.745 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 18.2 pttp -99.19 143.7 29.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.473 -0.785 . . . . 20.0 109.664 178.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . 0.498 HG23 ' O ' ' A' ' 63' ' ' PHE . 3.1 m -146.33 130.0 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 CA-C-O 121.349 0.595 . . . . 20.0 111.252 -179.599 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . 0.542 ' HB3' ' HB2' ' A' ' 114' ' ' TYR . 83.2 mtt-85 -92.79 127.79 38.42 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.128 -0.942 . . . . 20.0 110.207 179.424 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.594 ' N ' ' CD2' ' A' ' 136' ' ' LEU . 0.8 OUTLIER -117.6 114.38 23.33 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.005 0.372 . . . . 20.0 112.005 -178.871 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.592 HG12 ' CE2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -59.74 76.51 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.798 0.333 . . . . 20.0 110.349 178.832 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.538 ' N ' ' O ' ' A' ' 136' ' ' LEU . . . -66.47 -10.46 44.55 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.196 -0.456 . . . . 20.0 110.832 -179.64 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 51.6 p . . . . . 0 C--N 1.326 -0.423 0 CA-C-N 115.882 -0.599 . . . . 20.0 110.108 179.28 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.233 0.205 0 CA-C-O 120.785 0.326 . . . . 20.0 110.706 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.587 ' CE1' HG23 ' A' ' 79' ' ' VAL . 12.7 m-85 -127.58 149.02 50.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.201 -0.454 . . . . 20.0 112.002 -179.078 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 57.8 p -107.95 90.46 3.3 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.802 -0.636 . . . . 20.0 111.518 -179.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.532 ' O ' ' CG2' ' A' ' 75' ' ' VAL . 40.7 mmt180 -120.52 125.03 46.83 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.524 -0.917 . . . . 20.0 108.524 178.079 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.575 ' CD1' ' O ' ' A' ' 73' ' ' LYS . 0.0 OUTLIER -112.88 -82.88 0.59 Allowed 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.729 0.64 . . . . 20.0 112.729 -178.185 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.625 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -168.84 141.83 2.84 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.475 -0.49 . . . . 20.0 112.136 -178.201 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.438 ' O ' ' OD1' ' A' ' 66' ' ' ASP . 81.1 p -134.98 134.61 40.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.265 -0.425 . . . . 20.0 110.681 178.515 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.544 ' O ' ' C ' ' A' ' 67' ' ' GLY . 92.1 m-20 -141.32 -165.52 1.99 Allowed 'General case' 0 C--O 1.237 0.426 0 N-CA-C 109.7 -0.481 . . . . 20.0 109.7 179.411 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.786 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -30.32 143.98 0.01 OUTLIER Glycine 0 C--N 1.345 1.055 0 N-CA-C 110.243 -1.143 . . . . 20.0 110.243 179.334 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.505 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 14.1 Cg_exo -16.07 58.73 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 125.193 3.929 . . . . 20.0 115.412 -178.077 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.786 ' N ' ' O ' ' A' ' 67' ' ' GLY . 59.8 m -164.11 158.86 19.74 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 108.168 -1.049 . . . . 20.0 108.168 178.201 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 49.4 ttp180 -150.81 143.16 24.26 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.93 0.715 . . . . 20.0 112.93 -179.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.625 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -84.28 160.77 20.67 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 115.202 -0.908 . . . . 20.0 110.36 178.554 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -147.51 28.05 0.99 Allowed 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 113.47 0.915 . . . . 20.0 113.47 -179.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.575 ' O ' ' CD1' ' A' ' 63' ' ' PHE . 1.0 OUTLIER -72.95 155.8 90.22 Favored Pre-proline 0 C--N 1.324 -0.509 0 C-N-CA 120.548 -0.461 . . . . 20.0 110.09 179.268 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -61.3 119.45 6.6 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.352 2.035 . . . . 20.0 111.97 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.568 HG23 ' CD1' ' A' ' 63' ' ' PHE . 11.1 m -135.71 147.01 28.75 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 CA-C-N 116.422 -0.354 . . . . 20.0 111.191 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 41.2 m -113.79 123.95 51.07 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.021 0.438 . . . . 20.0 110.294 178.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.445 ' OE1' HD21 ' A' ' 136' ' ' LEU . 40.0 tp10 -128.67 138.36 52.12 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.713 -0.676 . . . . 20.0 110.401 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.558 ' CD1' ' N ' ' A' ' 78' ' ' LEU . 1.4 mp -115.39 134.21 55.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.43 -0.35 . . . . 20.0 110.56 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.587 HG23 ' CE1' ' A' ' 60' ' ' TYR . 15.1 m . . . . . 0 N--CA 1.449 -0.52 0 CA-C-O 121.005 0.431 . . . . 20.0 111.335 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 83.4 m-20 . . . . . 0 N--CA 1.455 -0.184 0 CA-C-O 120.633 0.254 . . . . 20.0 111.668 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . 0.539 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 38.9 ttm180 -118.07 151.95 36.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.734 0.302 . . . . 20.0 111.493 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.58 ' CD2' HG13 ' A' ' 137' ' ' VAL . 2.5 m-85 -127.82 164.18 22.76 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.611 0.72 . . . . 20.0 111.699 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.409 ' N ' ' O ' ' A' ' 136' ' ' LEU . 49.0 ttm-85 -99.21 145.27 27.42 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 114.732 -1.122 . . . . 20.0 108.078 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -90.59 115.11 27.47 Favored 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 120.164 -0.614 . . . . 20.0 111.187 -179.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -132.22 137.3 47.51 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.068 -0.514 . . . . 20.0 111.352 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . 0.47 ' HG2' ' HA ' ' A' ' 133' ' ' LYS . 87.6 mtt-85 -127.94 111.9 14.09 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.686 -0.688 . . . . 20.0 109.946 179.455 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.544 ' O ' ' CD1' ' A' ' 64' ' ' LEU . 38.8 t -127.46 146.23 33.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 116.188 -0.46 . . . . 20.0 111.89 -178.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.562 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 28.3 mp0 -78.15 131.34 37.17 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 116.208 -0.451 . . . . 20.0 111.13 -179.799 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.605 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.3 OUTLIER -79.3 122.13 25.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 20.0 109.984 179.569 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.75 136.71 34.06 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.383 0.611 . . . . 20.0 111.851 -178.421 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . 0.505 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.497 0 CA-C-N 115.359 -0.837 . . . . 20.0 109.986 179.289 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.139 0 N-CA-C 112.399 0.518 . . . . 20.0 112.399 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -121.29 57.08 6.42 Favored Pre-proline 0 C--N 1.33 -0.254 0 N-CA-C 112.269 0.47 . . . . 20.0 112.269 -179.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . 0.472 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 37.7 Cg_endo -67.4 141.46 56.24 Favored 'Trans proline' 0 CA--C 1.528 0.221 0 C-N-CA 122.512 2.141 . . . . 20.0 111.722 178.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.562 ' O ' ' HA ' ' A' ' 120' ' ' GLN . 84.5 mtt180 -139.64 136.47 34.36 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 121.019 -0.272 . . . . 20.0 111.511 -179.578 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 28.1 t -88.1 133.75 33.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.85 0.357 . . . . 20.0 111.43 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . 0.464 ' HD3' ' HB2' ' A' ' 64' ' ' LEU . 58.1 ttt85 -139.94 138.08 35.29 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.119 -0.491 . . . . 20.0 111.783 -179.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.47 ' HA ' ' HG2' ' A' ' 118' ' ' ARG . 12.0 pttt -87.08 142.94 27.55 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.103 -0.498 . . . . 20.0 110.122 179.015 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . 0.44 HG12 ' CD2' ' A' ' 136' ' ' LEU . 15.6 t -142.58 126.03 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 CA-C-O 121.284 0.564 . . . . 20.0 111.477 -179.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . 0.48 ' O ' ' CD2' ' A' ' 114' ' ' TYR . 99.7 mtt180 -95.13 99.07 11.11 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.152 -0.931 . . . . 20.0 109.265 178.148 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.579 ' N ' ' HB3' ' A' ' 114' ' ' TYR . 5.3 mt -104.78 133.85 48.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.461 0.648 . . . . 20.0 112.502 -179.335 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.58 HG13 ' CD2' ' A' ' 114' ' ' TYR . 0.3 OUTLIER -68.93 89.34 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.286 -0.87 . . . . 20.0 112.106 -179.587 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -72.32 -12.6 61.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.333 0.587 . . . . 20.0 109.481 178.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 5.6 t . . . . . 0 CA--C 1.529 0.165 0 CA-C-N 115.246 -0.888 . . . . 20.0 110.303 179.048 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . 0.594 ' CE1' HG22 ' A' ' 76' ' ' THR . 30.0 m170 . . . . . 0 C--O 1.232 0.178 0 N-CA-C 112.022 0.379 . . . . 20.0 112.022 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.557 ' CZ ' HG13 ' A' ' 79' ' ' VAL . 0.2 OUTLIER -153.55 168.67 25.38 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.24 -0.436 . . . . 20.0 111.198 179.514 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' THR . . . . . 0.627 ' CG2' ' CZ ' ' A' ' 63' ' ' PHE . 32.3 m -93.8 126.58 39.07 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.87 0.843 . . . . 20.0 112.912 -178.434 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.483 ' CG ' ' O ' ' A' ' 61' ' ' THR . 40.7 mtm180 -169.43 121.01 0.72 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.21 -1.359 . . . . 20.0 108.038 177.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.627 ' CZ ' ' CG2' ' A' ' 61' ' ' THR . 0.0 OUTLIER -120.28 -81.04 0.63 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 113.027 0.751 . . . . 20.0 113.027 -178.047 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.623 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -166.58 139.68 3.85 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.169 0.433 . . . . 20.0 112.169 -177.756 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.466 ' O ' ' OD1' ' A' ' 66' ' ' ASP . 68.9 p -133.42 128.29 35.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.805 -0.634 . . . . 20.0 110.232 178.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.531 ' O ' ' C ' ' A' ' 67' ' ' GLY . 73.6 m-20 -139.42 -165.06 1.79 Allowed 'General case' 0 C--O 1.236 0.346 0 N-CA-C 110.011 -0.366 . . . . 20.0 110.011 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.833 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -29.59 144.61 0.01 OUTLIER Glycine 0 C--N 1.344 0.988 0 CA-C-O 118.798 -1.001 . . . . 20.0 110.733 179.47 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.504 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 39.0 Cg_exo -14.91 54.51 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.723 1 C-N-CA 125.949 4.433 . . . . 20.0 115.106 -178.756 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.833 ' N ' ' O ' ' A' ' 67' ' ' GLY . 17.1 m -163.27 157.67 20.55 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.138 -1.06 . . . . 20.0 108.138 178.677 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -145.98 146.92 31.19 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.091 0.472 . . . . 20.0 112.042 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.623 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -89.23 160.72 16.79 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 115.512 -0.767 . . . . 20.0 109.955 178.861 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -149.87 28.49 0.76 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 114.21 1.189 . . . . 20.0 114.21 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.589 ' O ' ' CD2' ' A' ' 63' ' ' PHE . 17.3 tttt -73.72 140.48 78.18 Favored Pre-proline 0 C--N 1.328 -0.332 0 C-N-CA 120.551 -0.459 . . . . 20.0 110.164 178.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.499 ' HD2' ' HG2' ' A' ' 73' ' ' LYS . 63.9 Cg_exo -51.34 125.87 17.7 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 122.392 2.061 . . . . 20.0 112.419 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.49 HG23 ' CD2' ' A' ' 63' ' ' PHE . 26.3 m -133.63 163.25 37.97 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.159 0 CA-C-O 121.123 0.487 . . . . 20.0 112.033 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.594 HG22 ' CE1' ' A' ' 59' ' ' HIS . 0.2 OUTLIER -136.76 100.37 4.3 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.635 -0.711 . . . . 20.0 109.916 178.944 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.493 ' O ' ' HA ' ' A' ' 59' ' ' HIS . 83.5 mt-10 -114.43 162.98 15.96 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.1 -0.5 . . . . 20.0 111.568 -178.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.488 ' CD1' ' HA ' ' A' ' 138' ' ' ALA . 5.6 mp -111.1 142.35 43.39 Favored 'General case' 0 CA--C 1.512 -0.498 0 CA-C-O 121.355 0.598 . . . . 20.0 111.302 179.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.572 ' CG2' ' O ' ' A' ' 79' ' ' VAL . 7.7 m . . . . . 0 C--N 1.318 -0.796 0 CA-C-N 115.294 -0.866 . . . . 20.0 110.718 -179.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 . . . . . 0 CA--C 1.529 0.156 0 N-CA-C 112.552 0.575 . . . . 20.0 112.552 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . 0.44 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 60.9 ttm-85 -122.99 142.72 50.53 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.436 -0.347 . . . . 20.0 111.376 -179.017 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.503 ' CE2' HG13 ' A' ' 137' ' ' VAL . 0.7 OUTLIER -118.61 158.1 26.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.093 0.473 . . . . 20.0 111.296 -179.61 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.402 ' HB2' ' HB1' ' A' ' 138' ' ' ALA . 55.0 ttm-85 -97.29 141.63 30.16 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.807 -0.812 . . . . 20.0 108.807 178.345 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -77.66 128.15 33.62 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.878 0.37 . . . . 20.0 111.859 -178.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.489 ' HG2' HD22 ' A' ' 136' ' ' LEU . 89.6 mm-40 -126.99 137.15 53.05 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.117 -0.492 . . . . 20.0 111.233 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -133.94 94.23 3.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.971 -0.559 . . . . 20.0 110.451 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.555 ' O ' ' CD1' ' A' ' 64' ' ' LEU . 29.1 t -123.81 147.64 28.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.351 -0.386 . . . . 20.0 110.49 179.622 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.54 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 20.0 pt20 -94.37 133.87 37.47 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.42 -0.512 . . . . 20.0 110.71 -179.594 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.603 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -77.33 118.65 20.02 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.421 0.629 . . . . 20.0 110.851 -179.717 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.16 140.86 37.66 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.002 -0.999 . . . . 20.0 111.124 -179.328 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . 0.504 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.3 OUTLIER . . . . . 0 N--CA 1.446 -0.673 0 CA-C-N 115.619 -0.719 . . . . 20.0 109.578 179.128 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.435 ' O ' ' HD2' ' A' ' 129' ' ' PRO . . . . . . . . 0 N--CA 1.456 -0.165 0 N-CA-C 111.775 0.287 . . . . 20.0 111.775 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -118.06 60.74 3.79 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-O 120.976 0.417 . . . . 20.0 111.892 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . 0.435 ' HD2' ' O ' ' A' ' 127' ' ' ALA . 3.3 Cg_endo -46.37 155.32 0.72 Allowed 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 123.059 2.506 . . . . 20.0 111.458 178.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.54 ' O ' ' HA ' ' A' ' 120' ' ' GLN . 72.4 mtt85 -130.0 154.35 47.48 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.434 -0.348 . . . . 20.0 110.541 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.507 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 29.7 m -107.19 140.81 39.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.719 0.295 . . . . 20.0 110.392 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . 0.486 ' HD3' ' CB ' ' A' ' 64' ' ' LEU . 56.6 ttt85 -141.92 142.64 33.04 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.162 0.506 . . . . 20.0 112.203 -179.353 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.432 ' O ' HG21 ' A' ' 134' ' ' VAL . 7.5 pttt -93.3 143.95 25.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.492 -0.776 . . . . 20.0 109.076 178.159 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . 0.458 HG22 ' O ' ' A' ' 63' ' ' PHE . 3.1 t -143.99 121.15 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 CA-C-O 121.164 0.507 . . . . 20.0 111.805 -178.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . 0.4 ' HB3' ' HB2' ' A' ' 114' ' ' TYR . 87.3 mtm-85 -92.26 112.66 24.69 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.321 -0.854 . . . . 20.0 109.289 178.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.54 ' N ' ' CD2' ' A' ' 136' ' ' LEU . 1.6 mm? -113.98 123.78 50.54 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.337 0.589 . . . . 20.0 112.279 -178.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.503 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -57.5 84.39 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.411 -0.813 . . . . 20.0 111.672 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . 0.488 ' HA ' ' CD1' ' A' ' 78' ' ' LEU . . . -69.83 -16.12 63.22 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.408 -0.517 . . . . 20.0 109.818 178.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 C--O 1.233 0.207 0 CA-C-N 115.748 -0.66 . . . . 20.0 110.511 178.979 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . 0.462 ' CD2' ' HG ' ' A' ' 78' ' ' LEU . 5.0 m170 . . . . . 0 CA--C 1.53 0.179 0 N-CA-C 110.078 -0.342 . . . . 20.0 110.078 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.584 ' CZ ' HG13 ' A' ' 79' ' ' VAL . 17.8 m-30 -119.89 145.84 46.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.938 0.399 . . . . 20.0 111.355 -179.649 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 26.9 p -109.56 88.97 2.87 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.939 -0.573 . . . . 20.0 111.743 -179.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.505 ' O ' ' CG2' ' A' ' 75' ' ' VAL . 64.3 ttt-85 -119.94 122.37 41.07 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.445 -0.946 . . . . 20.0 108.445 177.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.598 ' CD1' ' O ' ' A' ' 73' ' ' LYS . 0.2 OUTLIER -105.22 -81.2 0.54 Allowed 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.779 0.659 . . . . 20.0 112.779 -177.538 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.619 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -170.21 139.9 1.83 Allowed 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.566 -0.454 . . . . 20.0 111.828 -178.617 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.502 ' CG2' ' HG3' ' A' ' 70' ' ' ARG . 29.6 p -134.19 132.22 39.5 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.9 -0.591 . . . . 20.0 110.579 179.062 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.539 ' O ' ' C ' ' A' ' 67' ' ' GLY . 94.0 m-20 -141.98 -163.76 1.65 Allowed 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.946 -0.39 . . . . 20.0 109.946 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.812 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -28.47 144.41 0.01 OUTLIER Glycine 0 C--N 1.346 1.113 0 CA-C-O 118.736 -1.036 . . . . 20.0 110.633 179.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.551 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 50.1 Cg_exo -15.78 57.13 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.78 1 C-N-CA 125.373 4.049 . . . . 20.0 115.271 -178.53 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.812 ' N ' ' O ' ' A' ' 67' ' ' GLY . 81.5 m -164.98 164.16 20.67 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 108.625 -0.88 . . . . 20.0 108.625 178.4 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . 0.502 ' HG3' ' CG2' ' A' ' 65' ' ' THR . 54.6 ttt180 -152.29 143.34 23.11 Favored 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 112.377 0.51 . . . . 20.0 112.377 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.619 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -86.06 161.48 18.91 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 115.718 -0.674 . . . . 20.0 110.844 179.156 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . 0.522 ' HA ' ' CD2' ' A' ' 63' ' ' PHE . . . -140.64 29.29 1.94 Allowed 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 113.0 0.741 . . . . 20.0 113.0 -179.576 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.598 ' O ' ' CD1' ' A' ' 63' ' ' PHE . 4.9 tmtm? -73.4 133.29 80.73 Favored Pre-proline 0 C--N 1.329 -0.316 0 C-N-CA 120.958 -0.297 . . . . 20.0 110.335 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . 0.464 ' HD2' ' HG2' ' A' ' 73' ' ' LYS . 50.7 Cg_exo -54.58 122.39 11.48 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.655 2.237 . . . . 20.0 112.356 -179.643 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.505 ' CG2' ' O ' ' A' ' 62' ' ' ARG . 5.1 m -135.54 159.57 40.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.852 -0.613 . . . . 20.0 111.167 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 38.8 m -118.57 128.78 54.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.083 0.468 . . . . 20.0 110.858 178.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.517 ' HB3' ' HB2' ' A' ' 60' ' ' TYR . 84.8 tt0 -131.54 139.2 49.19 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.642 -0.708 . . . . 20.0 110.031 179.314 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.576 ' CD1' ' N ' ' A' ' 78' ' ' LEU . 1.0 OUTLIER -111.37 144.32 40.75 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.307 0.575 . . . . 20.0 112.127 -179.05 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.599 ' CG2' ' O ' ' A' ' 79' ' ' VAL . 0.7 OUTLIER . . . . . 0 C--N 1.322 -0.601 0 N-CA-C 108.252 -1.018 . . . . 20.0 108.252 178.612 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 . . . . . 0 N--CA 1.456 -0.172 0 CA-C-O 120.803 0.335 . . . . 20.0 111.752 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . 0.46 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 35.1 ttm180 -122.97 147.47 46.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.284 -0.416 . . . . 20.0 110.909 -179.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.585 ' CE2' HG11 ' A' ' 137' ' ' VAL . 0.5 OUTLIER -120.73 155.93 32.89 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.404 0.621 . . . . 20.0 111.558 -179.456 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.423 ' HD2' ' NE2' ' A' ' 117' ' ' GLN . 48.3 ttm-85 -95.11 142.66 27.3 Favored 'General case' 0 N--CA 1.443 -0.785 0 N-CA-C 108.327 -0.99 . . . . 20.0 108.327 177.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . 0.52 ' O ' ' NE2' ' A' ' 117' ' ' GLN . . . -80.51 130.98 35.48 Favored 'General case' 0 C--N 1.315 -0.913 0 C-N-CA 120.662 -0.415 . . . . 20.0 111.365 -178.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.52 ' NE2' ' O ' ' A' ' 116' ' ' ALA . 87.8 mm-40 -131.58 127.64 37.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.054 -0.521 . . . . 20.0 111.122 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 80.1 mtm180 -129.38 96.06 4.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.068 -0.514 . . . . 20.0 110.358 179.079 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.55 ' O ' ' CD1' ' A' ' 64' ' ' LEU . 59.5 t -122.1 144.54 31.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.544 -0.753 . . . . 20.0 110.934 -179.472 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.533 ' N ' HG13 ' A' ' 119' ' ' VAL . 24.2 mp0 -82.13 121.48 26.65 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.812 -0.44 . . . . 20.0 109.812 179.621 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.562 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.2 OUTLIER -66.35 126.33 28.43 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.197 0.523 . . . . 20.0 110.649 -179.093 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.523 ' CD1' ' HA ' ' A' ' 71' ' ' SER . 0.9 OUTLIER -91.52 144.08 25.92 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.397 -0.82 . . . . 20.0 111.312 -178.742 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . 0.551 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER . . . . . 0 C--N 1.322 -0.596 0 CA-C-N 115.688 -0.687 . . . . 20.0 111.382 -179.663 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . 0.45 ' C ' ' CD ' ' A' ' 129' ' ' PRO . . . . . . . . 0 N--CA 1.456 -0.151 0 N-CA-C 111.767 0.284 . . . . 20.0 111.767 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -113.12 56.76 0.59 Allowed Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.968 0.413 . . . . 20.0 110.605 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . 0.476 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 46.8 Cg_endo -68.2 151.18 77.07 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.934 2.423 . . . . 20.0 112.752 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.484 ' O ' ' HA ' ' A' ' 120' ' ' GLN . 99.7 mtt180 -138.71 151.04 46.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.122 -0.49 . . . . 20.0 110.987 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 10.6 t -91.11 139.21 30.97 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.623 0.249 . . . . 20.0 110.954 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . 0.518 ' HD3' ' CB ' ' A' ' 64' ' ' LEU . 54.6 ttt85 -146.23 143.77 29.44 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.082 0.467 . . . . 20.0 112.086 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 117' ' ' GLN . 25.4 pttm -104.42 142.08 35.22 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.589 -0.732 . . . . 20.0 110.006 178.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . 0.481 HG23 HD21 ' A' ' 64' ' ' LEU . 1.8 m -147.58 128.65 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-O 121.276 0.56 . . . . 20.0 110.97 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . 0.516 ' HB3' ' HB2' ' A' ' 114' ' ' TYR . 91.2 mtt-85 -89.62 110.99 21.81 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.282 -0.872 . . . . 20.0 110.315 179.54 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.587 ' N ' ' CD2' ' A' ' 136' ' ' LEU . 0.2 OUTLIER -107.86 127.24 53.55 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.873 0.368 . . . . 20.0 111.067 -179.811 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.585 HG11 ' CE2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -63.05 88.73 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.816 0.341 . . . . 20.0 111.666 -179.941 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.68 -23.88 66.39 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.25 0.548 . . . . 20.0 109.602 179.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 37.0 t . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 115.342 -0.844 . . . . 20.0 111.325 179.483 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . 0.528 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 38.4 m80 . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 120.561 0.22 . . . . 20.0 111.085 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.544 ' HB2' ' CG ' ' A' ' 77' ' ' GLU . 10.2 m-30 -115.51 152.53 32.82 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.974 0.416 . . . . 20.0 111.765 -179.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 58.6 p -102.53 79.68 1.84 Allowed 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.9 -0.591 . . . . 20.0 111.198 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.538 ' O ' ' CG2' ' A' ' 75' ' ' VAL . 16.1 tpt180 -118.32 120.27 37.13 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 108.712 -0.847 . . . . 20.0 108.712 178.197 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.589 ' CD1' HG23 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -109.08 -79.44 0.58 Allowed 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 112.663 0.616 . . . . 20.0 112.663 -177.786 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.551 ' HG ' ' OG ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -168.29 137.75 2.44 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.699 -0.4 . . . . 20.0 111.869 -178.063 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 19.3 p -129.45 149.12 51.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.852 0.358 . . . . 20.0 110.263 178.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.506 ' O ' ' C ' ' A' ' 67' ' ' GLY . 24.7 t0 -154.45 -165.51 2.09 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.396 -0.594 . . . . 20.0 109.396 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.847 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -32.29 147.55 0.01 OUTLIER Glycine 0 C--N 1.345 1.082 0 N-CA-C 109.879 -1.289 . . . . 20.0 109.879 178.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.502 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 25.3 Cg_exo -15.95 55.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 125.138 3.892 . . . . 20.0 115.29 -178.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' CYS . . . . . 0.847 ' N ' ' O ' ' A' ' 67' ' ' GLY . 33.3 m -162.23 162.41 28.21 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 123.492 0.717 . . . . 20.0 109.121 178.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -158.41 144.58 17.11 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.079 0.466 . . . . 20.0 111.988 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' SER . . . . . 0.584 ' CA ' ' HA ' ' A' ' 121' ' ' LEU . 1.0 OUTLIER -83.05 172.37 12.8 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 115.59 -0.732 . . . . 20.0 110.819 179.287 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -152.87 36.51 0.49 Allowed 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.26 -0.576 . . . . 20.0 112.422 178.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . 0.563 ' O ' ' CD1' ' A' ' 63' ' ' PHE . 30.3 mmtt -79.89 163.68 56.88 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.405 -0.361 . . . . 20.0 110.637 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -63.51 116.07 3.42 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.601 2.201 . . . . 20.0 112.505 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' VAL . . . . . 0.589 HG23 ' CD1' ' A' ' 63' ' ' PHE . 4.4 m -140.07 136.52 37.99 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 CA-C-N 116.573 -0.285 . . . . 20.0 111.101 179.332 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 54.6 m -126.49 123.29 37.48 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 120.918 0.389 . . . . 20.0 112.031 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.544 ' CG ' ' HB2' ' A' ' 60' ' ' TYR . 20.0 pt-20 -131.17 148.64 52.74 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.034 -0.53 . . . . 20.0 109.677 178.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LEU . . . . . 0.546 ' N ' HD12 ' A' ' 78' ' ' LEU . 6.5 mp -101.07 158.36 16.07 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 113.575 0.954 . . . . 20.0 113.575 -178.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' VAL . . . . . 0.665 ' CG2' ' O ' ' A' ' 79' ' ' VAL . 1.4 m . . . . . 0 N--CA 1.446 -0.647 0 CA-C-N 113.903 -1.499 . . . . 20.0 109.162 178.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 67.5 t0 . . . . . 0 N--CA 1.457 -0.084 0 CA-C-O 120.768 0.318 . . . . 20.0 111.686 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' ARG . . . . . 0.526 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 48.0 ttt180 -121.38 150.16 41.89 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.298 -0.41 . . . . 20.0 111.072 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' TYR . . . . . 0.592 ' HB3' ' N ' ' A' ' 136' ' ' LEU . 0.5 OUTLIER -125.48 160.77 28.67 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.702 0.763 . . . . 20.0 112.629 -179.289 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.519 ' HD2' ' NE2' ' A' ' 117' ' ' GLN . 42.9 ttm-85 -97.84 140.4 32.26 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 114.539 -1.21 . . . . 20.0 107.907 176.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -80.51 130.66 35.28 Favored 'General case' 0 C--N 1.313 -0.988 0 C-N-CA 120.683 -0.407 . . . . 20.0 111.633 -178.39 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.519 ' NE2' ' HD2' ' A' ' 115' ' ' ARG . 89.1 mm-40 -133.79 136.62 44.62 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.09 -0.504 . . . . 20.0 110.807 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 50.1 ttt180 -134.02 94.71 3.3 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.996 -0.547 . . . . 20.0 110.189 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' VAL . . . . . 0.563 HG13 ' CB ' ' A' ' 73' ' ' LYS . 9.1 m -131.61 162.19 39.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.861 -0.608 . . . . 20.0 110.859 -179.402 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' GLN . . . . . 0.547 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 21.7 pt20 -99.86 143.46 30.05 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.286 -0.415 . . . . 20.0 112.017 -179.121 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.584 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -79.51 131.52 36.06 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.85 -0.614 . . . . 20.0 110.049 179.456 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' LEU . . . . . 0.492 ' N ' HD13 ' A' ' 122' ' ' LEU . 3.5 mp -97.22 140.76 31.23 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.774 -0.648 . . . . 20.0 111.942 -178.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' CYS . . . . . 0.502 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER . . . . . 0 C--N 1.323 -0.578 0 CA-C-N 115.176 -0.92 . . . . 20.0 109.837 179.313 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.206 0 N-CA-C 111.849 0.314 . . . . 20.0 111.849 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -122.2 59.14 10.88 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 120.939 0.4 . . . . 20.0 111.741 -179.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -55.75 149.18 51.4 Favored 'Trans proline' 0 CA--C 1.528 0.203 0 C-N-CA 122.981 2.454 . . . . 20.0 111.945 179.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' ARG . . . . . 0.547 ' O ' ' HA ' ' A' ' 120' ' ' GLN . 95.9 mtt-85 -130.49 155.57 46.24 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.358 -0.383 . . . . 20.0 110.822 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' SER . . . . . 0.541 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 66.6 m -109.04 133.91 52.36 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.898 0.38 . . . . 20.0 111.936 -179.606 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' ARG . . . . . 0.449 ' HD2' ' CB ' ' A' ' 64' ' ' LEU . 15.8 ttm180 -140.96 142.44 34.33 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.045 -0.525 . . . . 20.0 111.879 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' LYS . . . . . 0.446 ' O ' HG12 ' A' ' 134' ' ' VAL . 53.3 pttt -100.15 146.51 26.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.596 -0.729 . . . . 20.0 109.155 178.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' VAL . . . . . 0.457 HG21 HD22 ' A' ' 64' ' ' LEU . 0.4 OUTLIER -153.03 133.3 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-O 121.385 0.612 . . . . 20.0 112.398 -178.576 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' ARG . . . . . 0.462 ' HB3' ' HB2' ' A' ' 114' ' ' TYR . 62.1 mtp85 -91.37 113.06 25.23 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.823 -1.081 . . . . 20.0 109.89 178.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.592 ' N ' ' HB3' ' A' ' 114' ' ' TYR . 7.6 mt -112.38 130.02 56.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.971 0.415 . . . . 20.0 111.927 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' VAL . . . . . 0.526 ' HA ' ' O ' ' A' ' 113' ' ' ARG . 0.2 OUTLIER -64.61 94.58 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 112.401 0.519 . . . . 20.0 112.401 -179.407 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -80.27 -7.07 58.85 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-O 121.158 0.504 . . . . 20.0 109.74 178.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' SER . . . . . 0.42 ' HA ' HD22 ' A' ' 78' ' ' LEU . 20.1 t . . . . . 0 N--CA 1.461 0.117 0 CA-C-N 115.405 -0.816 . . . . 20.0 109.919 179.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.5 mttt . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.762 0.315 . . . . 20.0 111.424 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.477 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 89.6 m-20 -85.07 14.15 5.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.33 -0.395 . . . . 20.0 110.956 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 50.5 t -68.86 -38.86 79.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.125 -0.489 . . . . 20.0 111.732 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 69.8 m -83.87 -1.41 54.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.314 -0.403 . . . . 20.0 111.852 -179.26 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.477 ' HG3' ' HA ' ' A' ' 49' ' ' ASP . 97.3 mt-10 -63.3 -33.7 76.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.73 0.3 . . . . 20.0 110.751 179.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.627 ' CD1' ' CB ' ' A' ' 142' ' ' CYS . 0.0 OUTLIER -110.99 -80.11 0.58 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.171 0.51 . . . . 20.0 110.487 179.463 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.464 ' O ' ' SG ' ' A' ' 55' ' ' CYS . 28.2 t -147.08 -160.39 1.15 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.442 -0.799 . . . . 20.0 109.981 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.464 ' SG ' ' O ' ' A' ' 54' ' ' SER . 3.8 p 41.75 50.3 3.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.279 -0.419 . . . . 20.0 111.31 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.512 ' CZ ' HD11 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -55.36 -168.06 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.307 -0.406 . . . . 20.0 110.555 179.603 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.438 ' N ' ' HG2' ' A' ' 56' ' ' ARG . 97.6 mt-10 -67.07 70.98 0.09 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.586 -0.524 . . . . 20.0 109.586 179.014 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.586 ' CD1' HG22 ' A' ' 79' ' ' VAL . 7.9 tt -96.13 142.2 28.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.595 -0.73 . . . . 20.0 111.726 -178.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.453 ' N ' HD23 ' A' ' 58' ' ' LEU . 30.4 m170 -122.55 140.04 53.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.538 -0.755 . . . . 20.0 111.854 -179.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.583 ' CZ ' HG13 ' A' ' 79' ' ' VAL . 0.8 OUTLIER -126.15 166.28 17.34 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.125 -0.488 . . . . 20.0 111.143 179.793 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.95 79.67 1.54 Allowed 'General case' 0 C--O 1.231 0.121 0 CA-C-O 120.999 0.428 . . . . 20.0 111.716 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.483 ' NE ' ' OE2' ' A' ' 77' ' ' GLU . 53.0 mtm180 -124.7 124.29 41.86 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.154 -1.054 . . . . 20.0 108.154 177.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.581 ' CD1' ' O ' ' A' ' 73' ' ' LYS . 0.1 OUTLIER -109.53 -79.08 0.58 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 113.007 0.743 . . . . 20.0 113.007 -177.368 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.603 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -170.72 136.74 1.23 Allowed 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.277 -0.569 . . . . 20.0 112.435 -178.128 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.525 ' CG2' ' HG3' ' A' ' 70' ' ' ARG . 16.8 p -132.96 132.06 41.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.06 -0.518 . . . . 20.0 110.295 178.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.523 ' O ' ' C ' ' A' ' 67' ' ' GLY . 91.7 m-20 -140.27 -163.68 1.57 Allowed 'General case' 0 C--O 1.237 0.44 0 N-CA-C 110.074 -0.343 . . . . 20.0 110.074 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.837 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -29.86 146.2 0.01 OUTLIER Glycine 0 C--N 1.345 1.036 0 CA-C-O 118.597 -1.113 . . . . 20.0 110.622 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.492 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 39.6 Cg_exo -15.11 56.23 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 125.292 3.995 . . . . 20.0 115.183 -178.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.837 ' N ' ' O ' ' A' ' 67' ' ' GLY . 39.8 m -163.84 163.68 23.76 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 108.453 -0.943 . . . . 20.0 108.453 178.661 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.525 ' HG3' ' CG2' ' A' ' 65' ' ' THR . 58.0 ttp180 -154.64 145.88 22.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.112 0.482 . . . . 20.0 111.84 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.603 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -89.27 160.54 16.86 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.751 -0.659 . . . . 20.0 110.465 179.075 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.451 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . . . -147.66 28.36 0.96 Allowed 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.177 0.806 . . . . 20.0 113.177 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.581 ' O ' ' CD1' ' A' ' 63' ' ' PHE . 1.5 tttt -79.33 143.2 59.71 Favored Pre-proline 0 C--N 1.326 -0.436 0 N-CA-C 110.017 -0.364 . . . . 20.0 110.017 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.448 ' HD2' ' HG3' ' A' ' 73' ' ' LYS . 76.9 Cg_exo -51.28 122.29 9.85 Favored 'Trans proline' 0 C--O 1.232 0.225 0 C-N-CA 122.758 2.306 . . . . 20.0 113.024 -178.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.502 HG21 ' CD1' ' A' ' 63' ' ' PHE . 20.0 m -136.72 145.5 30.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 115.791 -0.641 . . . . 20.0 110.97 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 41.7 m -119.14 128.52 54.35 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.919 0.39 . . . . 20.0 110.307 178.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.483 ' OE2' ' NE ' ' A' ' 62' ' ' ARG . 20.3 pt-20 -143.32 150.32 39.02 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.894 -0.594 . . . . 20.0 110.252 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.503 HD11 ' N ' ' A' ' 78' ' ' LEU . 6.0 mp -100.91 140.99 34.42 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 121.174 0.511 . . . . 20.0 111.076 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.586 HG22 ' CD1' ' A' ' 58' ' ' LEU . 10.7 m -97.92 86.25 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.91 0 CA-C-N 115.423 -0.808 . . . . 20.0 109.842 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.415 ' HA ' ' CB ' ' A' ' 55' ' ' CYS . 0.1 OUTLIER -81.46 90.45 6.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.691 -0.686 . . . . 20.0 110.809 -179.182 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.7 p -150.48 114.74 5.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.597 -0.729 . . . . 20.0 110.385 179.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.526 ' O ' ' HA ' ' A' ' 108' ' ' ARG . . . -162.41 -142.55 3.42 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.863 -0.684 . . . . 20.0 112.058 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 85.2 mt-30 -135.17 138.56 43.8 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 110.238 -0.282 . . . . 20.0 110.238 179.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.429 ' SG ' ' CG ' ' A' ' 53' ' ' TYR . 5.1 m -160.9 24.12 0.14 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.82 0.343 . . . . 20.0 110.905 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . 0.571 ' HA3' ' CD2' ' A' ' 107' ' ' PHE . . . -129.0 162.18 22.51 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.624 -0.798 . . . . 20.0 112.571 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.81 146.34 95.9 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 123.022 2.482 . . . . 20.0 112.601 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -92.62 23.0 4.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.144 -0.48 . . . . 20.0 110.673 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 29.9 tpt180 -69.69 130.48 42.48 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.842 -0.617 . . . . 20.0 111.639 -179.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.452 ' N ' HD21 ' A' ' 89' ' ' LEU . 1.3 mm? -97.2 134.42 40.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.811 -0.631 . . . . 20.0 109.83 179.064 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -109.4 98.34 31.4 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-O 120.749 0.309 . . . . 20.0 111.42 -179.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -70.92 115.34 4.22 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.638 2.225 . . . . 20.0 111.976 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.507 ' O ' ' CZ2' ' A' ' 99' ' ' TRP . 86.6 m-20 -139.78 31.31 2.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 20.0 111.255 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.528 ' HB1' ' CG2' ' A' ' 97' ' ' VAL . . . -65.14 -1.91 2.51 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.352 0.501 . . . . 20.0 112.352 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 92' ' ' ASN . 1.1 mt 33.89 32.49 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 121.313 0.577 . . . . 20.0 111.4 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . 0.509 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 108.52 -42.57 1.91 Allowed Glycine 0 N--CA 1.451 -0.3 0 CA-C-N 115.306 -0.861 . . . . 20.0 112.993 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.521 ' HD3' ' CE ' ' A' ' 98' ' ' LYS . 52.2 ttt180 -122.13 132.01 54.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.801 0.334 . . . . 20.0 110.934 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.599 ' CG1' ' CZ3' ' A' ' 100' ' ' TRP . 0.0 OUTLIER -116.38 113.06 41.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 CA-C-O 121.276 0.56 . . . . 20.0 110.863 -179.739 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.532 ' HG3' ' N ' ' A' ' 99' ' ' TRP . 9.2 ptpt -147.6 -45.76 0.17 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.249 -0.887 . . . . 20.0 110.334 -179.549 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.653 ' CZ3' ' CE3' ' A' ' 100' ' ' TRP . 0.2 OUTLIER -58.76 -84.39 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.26 -1.336 . . . . 20.0 109.783 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' TRP . . . . . 0.653 ' CE3' ' CZ3' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -96.42 -176.46 3.64 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.325 -0.991 . . . . 20.0 108.325 177.698 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.631 ' N ' ' CG ' ' A' ' 100' ' ' TRP . 36.1 mmm-85 -166.35 140.77 3.56 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 120.665 0.269 . . . . 20.0 110.746 178.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 101' ' ' ARG . 32.0 Cg_exo -59.44 47.63 0.06 OUTLIER 'Trans proline' 0 N--CA 1.476 0.487 0 C-N-CA 123.569 2.846 . . . . 20.0 113.954 -179.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . 0.432 ' N ' ' O ' ' A' ' 101' ' ' ARG . 71.2 m-20 -82.38 2.74 30.94 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.83 0.348 . . . . 20.0 110.465 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 108.27 144.91 11.32 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 121.193 -0.527 . . . . 20.0 112.611 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.588 ' HB2' ' CE2' ' A' ' 107' ' ' PHE . 11.7 Cg_exo -69.86 147.05 61.37 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.937 2.425 . . . . 20.0 112.339 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -85.85 102.25 13.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.369 -0.378 . . . . 20.0 110.899 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . 0.588 ' CE2' ' HB2' ' A' ' 105' ' ' PRO . 25.3 m-85 -126.09 149.7 48.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.324 -0.398 . . . . 20.0 110.805 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.526 ' HA ' ' O ' ' A' ' 82' ' ' GLY . 25.5 ptt180 -170.72 179.68 3.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.942 0.401 . . . . 20.0 111.194 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.502 ' HA ' ' HA ' ' A' ' 142' ' ' CYS . 24.6 m -69.6 146.27 51.87 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.036 -0.529 . . . . 20.0 109.657 179.477 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.436 HG12 ' O ' ' A' ' 143' ' ' LYS . 3.2 mm -113.76 121.52 36.95 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-O 120.865 0.364 . . . . 20.0 111.948 -179.439 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.542 ' CB ' ' CG1' ' A' ' 137' ' ' VAL . 36.8 Cg_endo -64.86 134.99 42.54 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.516 2.144 . . . . 20.0 111.427 179.17 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 93.3 m-20 -107.83 -66.83 1.0 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.018 0.377 . . . . 20.0 112.018 -179.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.412 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 25.3 ttm180 -121.2 147.84 45.06 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.354 -0.384 . . . . 20.0 110.832 -179.434 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.522 ' HB2' ' HB3' ' A' ' 135' ' ' ARG . 1.0 OUTLIER -119.65 160.8 21.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.174 0.511 . . . . 20.0 111.441 -179.114 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.409 ' HB2' ' HB3' ' A' ' 138' ' ' ALA . 50.9 ttm-85 -96.93 147.18 24.24 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.882 -0.784 . . . . 20.0 108.882 178.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . 0.417 ' O ' ' NE2' ' A' ' 117' ' ' GLN . . . -82.91 134.24 35.08 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.076 0.465 . . . . 20.0 111.938 -178.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.422 ' HG3' HD23 ' A' ' 136' ' ' LEU . 75.6 mm-40 -133.94 120.53 20.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.54 -0.755 . . . . 20.0 110.032 179.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 71.9 ttp85 -118.04 98.61 6.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.924 0.392 . . . . 20.0 110.663 179.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.54 ' CG1' ' HB2' ' A' ' 73' ' ' LYS . 92.2 t -131.14 145.06 35.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.902 -0.59 . . . . 20.0 111.3 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.536 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 24.4 mp0 -91.53 140.92 29.28 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.751 0.31 . . . . 20.0 110.518 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.543 ' HA ' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -79.4 129.72 34.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.196 0.522 . . . . 20.0 110.801 -179.835 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.527 ' CD1' ' HA ' ' A' ' 71' ' ' SER . 1.5 mp -95.12 138.46 32.8 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.551 -0.75 . . . . 20.0 111.524 -179.048 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . 0.493 ' SG ' ' HD2' ' A' ' 124' ' ' PRO . 0.1 OUTLIER -115.28 156.72 45.28 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.403 -0.817 . . . . 20.0 109.877 179.462 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . 0.493 ' HD2' ' SG ' ' A' ' 123' ' ' CYS . 73.9 Cg_exo -50.28 112.51 0.75 Allowed 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.007 1.804 . . . . 20.0 111.908 -179.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 98.35 -9.36 62.87 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.946 -0.645 . . . . 20.0 112.477 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 56.47 59.45 10.72 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.746 -0.74 . . . . 20.0 112.521 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -118.44 -31.69 4.85 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.271 0.471 . . . . 20.0 112.271 -179.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -123.19 56.03 8.72 Favored Pre-proline 0 C--N 1.33 -0.242 0 N-CA-C 112.219 0.451 . . . . 20.0 112.219 -179.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.68 143.81 47.43 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.639 2.226 . . . . 20.0 112.081 179.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.536 ' O ' ' HA ' ' A' ' 120' ' ' GLN . 67.5 mtt85 -132.02 153.38 50.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.379 -0.373 . . . . 20.0 110.623 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.433 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 43.9 t -98.84 133.72 42.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.801 0.334 . . . . 20.0 111.128 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . 0.412 ' HB3' HD11 ' A' ' 64' ' ' LEU . 74.5 ttt-85 -139.1 142.99 38.08 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.188 0.518 . . . . 20.0 111.761 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 3.6 pttm -96.09 146.07 24.96 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.445 -0.798 . . . . 20.0 110.259 179.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . 0.516 ' CG2' HD22 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -145.16 121.59 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 CA-C-O 121.287 0.565 . . . . 20.0 111.794 -179.415 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.522 ' HB3' ' HB2' ' A' ' 114' ' ' TYR . 86.1 mtt-85 -92.1 118.6 30.97 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.349 -0.842 . . . . 20.0 110.09 178.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.579 ' N ' ' CD2' ' A' ' 136' ' ' LEU . 1.0 OUTLIER -114.35 120.2 39.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.01 0.433 . . . . 20.0 112.087 -179.252 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.542 ' CG1' ' CB ' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -51.28 84.54 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.269 -0.423 . . . . 20.0 111.455 179.811 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.519 ' N ' ' O ' ' A' ' 136' ' ' LEU . . . -75.5 -6.44 50.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.009 0.433 . . . . 20.0 110.193 179.101 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 17.3 t -161.67 120.96 2.46 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.82 -0.627 . . . . 20.0 110.517 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' CYS . . . . . 0.438 ' HB3' ' HA ' ' A' ' 111' ' ' PRO . 11.3 p -141.0 169.81 16.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.533 -0.303 . . . . 20.0 110.904 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -128.82 148.49 50.88 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 116.546 -0.297 . . . . 20.0 110.401 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . 0.627 ' CB ' ' CD1' ' A' ' 53' ' ' TYR . 11.3 t -83.89 99.01 10.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.962 0.411 . . . . 20.0 110.068 179.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.477 ' O ' ' HG2' ' A' ' 144' ' ' ARG . 19.7 mmtm -130.24 145.49 51.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.932 -0.576 . . . . 20.0 111.39 -179.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.477 ' HG2' ' O ' ' A' ' 143' ' ' LYS . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.172 -0.918 . . . . 20.0 111.249 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 37.5 mtmm . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.773 0.32 . . . . 20.0 111.322 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.429 ' HB2' ' CD ' ' A' ' 52' ' ' GLU . 47.4 p30 -89.59 15.34 9.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.232 -0.44 . . . . 20.0 111.821 -179.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 92.0 t -71.86 -29.91 35.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.761 0.315 . . . . 20.0 111.741 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 79.7 p -78.41 -6.75 56.15 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.416 -0.356 . . . . 20.0 111.427 -179.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.429 ' CD ' ' HB2' ' A' ' 49' ' ' ASP . 96.9 mt-10 -64.4 -31.85 73.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.892 0.377 . . . . 20.0 110.796 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.59 ' CD2' ' O ' ' A' ' 53' ' ' TYR . 2.0 p90 -111.49 22.94 14.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.132 -0.486 . . . . 20.0 110.521 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.424 ' OG ' ' HG3' ' A' ' 56' ' ' ARG . 16.3 t -56.71 119.43 6.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.207 0.527 . . . . 20.0 110.846 -179.007 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.449 ' SG ' ' SG ' ' A' ' 80' ' ' CYS . 0.7 OUTLIER -110.24 25.35 11.88 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.415 -0.811 . . . . 20.0 110.618 -179.641 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.556 ' HD3' ' N ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -44.21 167.83 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.958 -0.565 . . . . 20.0 111.102 179.869 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.482 ' O ' ' HG3' ' A' ' 57' ' ' GLU . 22.0 pt-20 -44.05 88.32 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.97 -0.559 . . . . 20.0 111.451 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.53 ' O ' ' CD1' ' A' ' 58' ' ' LEU . 2.3 pp -108.09 132.35 53.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.772 -0.649 . . . . 20.0 110.505 179.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.488 ' CD2' ' O ' ' A' ' 58' ' ' LEU . 7.5 m170 -146.96 131.18 17.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.911 0.386 . . . . 20.0 111.243 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.589 ' CE1' HG11 ' A' ' 79' ' ' VAL . 12.7 m-85 -129.25 148.63 51.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.083 -0.508 . . . . 20.0 111.639 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.418 ' OG1' ' CZ ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -103.86 87.15 2.73 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.038 0.447 . . . . 20.0 111.091 -179.819 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.506 ' CB ' ' OE1' ' A' ' 77' ' ' GLU . 60.7 ttm-85 -122.37 124.96 44.89 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.572 -0.899 . . . . 20.0 108.572 178.544 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.58 ' CD1' HG22 ' A' ' 75' ' ' VAL . 0.1 OUTLIER -111.18 -83.39 0.57 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.98 0.733 . . . . 20.0 112.98 -177.606 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.599 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -169.17 141.77 2.64 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 120.575 -0.45 . . . . 20.0 112.04 -178.405 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.471 ' O ' ' OD1' ' A' ' 66' ' ' ASP . 31.0 p -136.4 131.62 34.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.101 -0.5 . . . . 20.0 110.806 178.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.546 ' O ' ' C ' ' A' ' 67' ' ' GLY . 93.4 m-20 -140.72 -162.13 1.31 Allowed 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.547 -0.538 . . . . 20.0 109.547 179.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.814 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -29.65 144.34 0.01 OUTLIER Glycine 0 C--N 1.347 1.183 0 CA-C-O 118.494 -1.17 . . . . 20.0 110.277 179.441 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.515 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 56.9 Cg_exo -16.57 58.53 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 125.071 3.848 . . . . 20.0 114.864 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.814 ' N ' ' O ' ' A' ' 67' ' ' GLY . 20.7 m -162.58 159.12 24.29 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 108.956 -0.757 . . . . 20.0 108.956 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -149.97 141.29 23.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.218 0.532 . . . . 20.0 112.068 179.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.599 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -84.54 162.69 19.75 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.446 -0.797 . . . . 20.0 110.393 179.004 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -147.34 28.3 0.99 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.415 0.894 . . . . 20.0 113.415 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.534 ' CG ' HG22 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -75.76 141.97 72.85 Favored Pre-proline 0 C--N 1.327 -0.379 0 C-N-CA 120.54 -0.464 . . . . 20.0 110.27 179.249 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -50.63 122.51 9.76 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.706 2.27 . . . . 20.0 112.619 -179.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.58 HG22 ' CD1' ' A' ' 63' ' ' PHE . 17.3 m -137.27 151.08 26.38 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 CA-C-N 116.202 -0.454 . . . . 20.0 111.891 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 88.1 m -111.73 124.24 51.92 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.069 -0.715 . . . . 20.0 109.069 177.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.53 ' O ' ' N ' ' A' ' 60' ' ' TYR . 84.8 tt0 -125.31 133.1 52.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.192 0.52 . . . . 20.0 112.085 -179.061 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.556 ' CD1' ' N ' ' A' ' 78' ' ' LEU . 3.8 mp -108.06 138.29 44.58 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.534 -0.757 . . . . 20.0 109.405 178.36 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.589 HG11 ' CE1' ' A' ' 60' ' ' TYR . 35.0 m -97.41 83.04 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 CA-C-O 121.481 0.657 . . . . 20.0 111.184 -178.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.497 ' O ' ' HD3' ' A' ' 111' ' ' PRO . 0.8 OUTLIER -115.65 107.3 14.92 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 114.875 -1.057 . . . . 20.0 109.97 179.488 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.4 m -151.62 96.16 2.22 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 120.214 -0.594 . . . . 20.0 112.58 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 109' ' ' CYS . . . 171.32 -170.73 43.54 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.547 -0.751 . . . . 20.0 111.503 179.434 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.532 ' O ' ' N ' ' A' ' 108' ' ' ARG . 92.6 mt-30 -137.52 138.27 39.48 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.977 0.417 . . . . 20.0 111.065 178.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.492 ' N ' ' HA ' ' A' ' 144' ' ' ARG . 61.4 m -97.68 133.18 42.57 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.18 -0.464 . . . . 20.0 110.878 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . 0.573 ' HA3' ' CE2' ' A' ' 107' ' ' PHE . . . -145.75 -177.21 20.29 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.685 -0.769 . . . . 20.0 112.365 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -56.76 140.89 92.08 Favored 'Trans proline' 0 N--CA 1.465 -0.18 0 C-N-CA 122.592 2.195 . . . . 20.0 111.963 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.452 ' O ' HD12 ' A' ' 89' ' ' LEU . . . -74.87 -0.41 18.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.23 -0.441 . . . . 20.0 111.23 179.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . 0.408 ' C ' HD12 ' A' ' 89' ' ' LEU . 21.7 tpt180 -73.68 117.19 15.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.334 -0.393 . . . . 20.0 110.57 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.549 ' CB ' ' O ' ' A' ' 102' ' ' PRO . 0.1 OUTLIER -98.5 135.16 40.46 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.045 -0.525 . . . . 20.0 110.834 -179.986 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -118.53 90.78 40.16 Favored Pre-proline 0 C--N 1.329 -0.29 0 N-CA-C 112.086 0.402 . . . . 20.0 112.086 -179.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.595 ' HB2' ' CE2' ' A' ' 100' ' ' TRP . 37.1 Cg_endo -64.94 108.56 1.12 Allowed 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 122.634 2.223 . . . . 20.0 111.0 178.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.616 ' O ' ' CH2' ' A' ' 99' ' ' TRP . 56.8 t-20 -98.93 142.91 29.84 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 111.873 0.323 . . . . 20.0 111.873 -179.01 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.612 ' CB ' ' CG2' ' A' ' 97' ' ' VAL . . . -100.32 -13.33 18.86 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.187 -0.461 . . . . 20.0 112.054 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.537 HD11 ' CH2' ' A' ' 99' ' ' TRP . 0.1 OUTLIER 32.66 31.47 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-O 121.135 0.493 . . . . 20.0 111.836 -179.711 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . 0.542 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 121.25 -44.39 1.37 Allowed Glycine 0 C--N 1.314 -0.655 0 CA-C-N 115.53 -0.759 . . . . 20.0 113.023 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.473 ' N ' ' O ' ' A' ' 93' ' ' ALA . 82.3 mtt180 -109.15 131.64 54.87 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.718 0.259 . . . . 20.0 110.7 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.634 ' CG1' ' CZ3' ' A' ' 100' ' ' TRP . 0.8 OUTLIER -129.89 129.65 66.05 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.651 0 CA-C-O 121.629 0.728 . . . . 20.0 111.584 178.877 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.478 ' HG2' ' C ' ' A' ' 97' ' ' VAL . 1.6 ptpt 164.72 -32.83 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.525 -1.216 . . . . 20.0 108.974 -178.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.616 ' CH2' ' O ' ' A' ' 92' ' ' ASN . 43.8 p-90 -94.7 26.83 3.31 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 113.357 -1.747 . . . . 20.0 110.595 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' TRP . . . . . 0.722 ' HA ' ' CE3' ' A' ' 100' ' ' TRP . 0.0 OUTLIER -30.26 132.01 0.08 Allowed 'General case' 0 CA--C 1.5 -0.961 0 CA-C-O 122.15 0.976 . . . . 20.0 113.232 -177.093 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.424 ' HD2' ' CE3' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -119.47 74.87 16.97 Favored Pre-proline 0 N--CA 1.437 -1.087 0 CA-C-N 113.524 -1.671 . . . . 20.0 110.813 -179.131 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.549 ' O ' ' CB ' ' A' ' 89' ' ' LEU . 55.3 Cg_endo -68.95 -0.17 5.88 Favored 'Trans proline' 0 CA--C 1.527 0.169 0 C-N-CA 123.59 2.86 . . . . 20.0 112.239 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . 0.456 ' O ' ' HG ' ' A' ' 89' ' ' LEU . 57.8 t30 -59.24 -34.64 72.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.384 -0.371 . . . . 20.0 110.737 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.443 ' HA3' HD13 ' A' ' 89' ' ' LEU . . . 76.32 -178.09 50.08 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.646 -0.787 . . . . 20.0 112.45 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.575 ' HB2' ' CZ ' ' A' ' 107' ' ' PHE . 22.6 Cg_exo -63.24 153.85 71.55 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.803 2.335 . . . . 20.0 112.293 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.404 ' OD2' ' NH2' ' A' ' 108' ' ' ARG . 54.3 t0 -79.32 115.53 19.02 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.262 -0.426 . . . . 20.0 110.991 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . 0.575 ' CZ ' ' HB2' ' A' ' 105' ' ' PRO . 63.9 m-85 -117.89 138.28 52.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.049 -0.523 . . . . 20.0 110.783 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.565 ' HB2' ' HA3' ' A' ' 82' ' ' GLY . 0.0 OUTLIER -151.2 -162.73 1.6 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.944 0.402 . . . . 20.0 111.354 179.327 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.591 ' O ' ' N ' ' A' ' 82' ' ' GLY . 1.5 m -82.86 122.6 28.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.957 -0.565 . . . . 20.0 111.603 -179.133 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.512 ' CG2' ' HB2' ' A' ' 143' ' ' LYS . 0.1 OUTLIER -100.56 116.13 64.62 Favored Pre-proline 0 C--N 1.329 -0.3 0 C-N-CA 120.597 -0.441 . . . . 20.0 110.274 178.596 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.497 ' HD3' ' O ' ' A' ' 80' ' ' CYS . 18.6 Cg_endo -60.16 147.07 94.75 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.763 2.309 . . . . 20.0 111.67 -179.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -119.83 -66.59 1.05 Allowed 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 112.989 0.737 . . . . 20.0 112.989 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.495 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 41.0 ttm180 -119.82 149.05 42.69 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.245 0.461 . . . . 20.0 112.245 -178.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.59 ' HB3' ' N ' ' A' ' 136' ' ' LEU . 1.3 m-85 -124.01 159.01 30.79 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.551 -0.75 . . . . 20.0 111.602 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.504 ' HD2' ' NE2' ' A' ' 117' ' ' GLN . 43.9 ttm-85 -95.43 148.31 22.61 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.467 -0.938 . . . . 20.0 108.467 177.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -83.33 137.94 33.75 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.137 0.494 . . . . 20.0 111.421 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.504 ' NE2' ' HD2' ' A' ' 115' ' ' ARG . 95.6 mm-40 -137.18 109.81 7.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.811 -0.632 . . . . 20.0 110.867 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.47 ' HA ' ' O ' ' A' ' 132' ' ' ARG . 93.8 mtt180 -125.42 98.25 5.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.059 -0.519 . . . . 20.0 110.739 179.394 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.534 HG22 ' CG ' ' A' ' 73' ' ' LYS . 14.7 p -133.72 152.12 34.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.877 -0.601 . . . . 20.0 110.857 -179.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.506 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 27.1 mp0 -77.92 135.73 37.9 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.932 0.396 . . . . 20.0 111.493 -179.234 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.573 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.2 OUTLIER -79.22 127.71 32.39 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.345 -0.613 . . . . 20.0 109.345 179.103 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.4 HD13 ' HA ' ' A' ' 71' ' ' SER . 0.4 OUTLIER -84.62 131.86 34.56 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.861 -0.608 . . . . 20.0 111.446 -178.715 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . 0.515 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.5 OUTLIER -112.53 151.89 44.21 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 115.438 -0.801 . . . . 20.0 109.881 179.71 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . 0.488 ' HD2' ' SG ' ' A' ' 123' ' ' CYS . 78.1 Cg_exo -48.27 111.91 0.52 Allowed 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 121.766 1.644 . . . . 20.0 111.351 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 100.86 -9.87 58.53 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.969 -0.634 . . . . 20.0 112.036 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 65.26 27.13 72.05 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 120.767 -0.73 . . . . 20.0 112.389 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -101.79 -7.27 22.7 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.384 0.512 . . . . 20.0 112.384 -178.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -129.63 56.26 23.21 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 112.388 0.514 . . . . 20.0 112.388 -179.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . 0.494 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 62.3 Cg_endo -73.74 136.32 23.02 Favored 'Trans proline' 0 CA--C 1.528 0.182 0 C-N-CA 122.529 2.153 . . . . 20.0 112.055 179.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.506 ' O ' ' HA ' ' A' ' 120' ' ' GLN . 89.1 mtt180 -140.27 133.94 30.32 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.62 0.248 . . . . 20.0 111.271 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.4 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 23.3 t -85.51 136.71 33.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.952 0.406 . . . . 20.0 111.657 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . 0.47 ' O ' ' HA ' ' A' ' 118' ' ' ARG . 56.6 ttt-85 -140.52 143.54 35.46 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.803 -0.635 . . . . 20.0 111.26 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.435 ' HA ' ' O ' ' A' ' 117' ' ' GLN . 19.7 pttp -100.93 144.61 29.66 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.09 -0.504 . . . . 20.0 110.66 179.473 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . 0.485 HG21 HD22 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -147.99 123.17 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 120.946 0.403 . . . . 20.0 111.721 -179.618 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.476 ' HB3' ' HB2' ' A' ' 114' ' ' TYR . 90.5 mtm-85 -90.85 110.89 22.11 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.855 -0.612 . . . . 20.0 110.213 178.423 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.59 ' N ' ' HB3' ' A' ' 114' ' ' TYR . 5.0 mt -114.04 126.85 55.58 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.255 0.55 . . . . 20.0 112.047 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.539 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.2 OUTLIER -57.83 83.22 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.569 -0.741 . . . . 20.0 111.405 -179.704 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.433 ' HA ' HD13 ' A' ' 78' ' ' LEU . . . -72.95 -6.98 48.94 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.053 0.454 . . . . 20.0 110.428 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 47.2 t -163.6 115.14 1.41 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.787 -0.642 . . . . 20.0 110.169 179.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' CYS . . . . . . . . . . . . . 10.0 p -132.09 159.78 37.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.972 0.415 . . . . 20.0 111.037 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -131.21 149.07 52.74 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.909 -0.587 . . . . 20.0 110.596 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . 0.565 ' SG ' ' CE2' ' A' ' 53' ' ' TYR . 0.5 OUTLIER -71.09 98.71 1.71 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.862 0.363 . . . . 20.0 110.481 179.86 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.512 ' HB2' ' CG2' ' A' ' 110' ' ' ILE . 25.1 mmtt -134.1 152.61 51.91 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.976 -0.556 . . . . 20.0 111.183 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.503 ' CD ' ' N ' ' A' ' 144' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.221 -0.895 . . . . 20.0 110.946 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.4 mttt . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.724 0.297 . . . . 20.0 111.149 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.471 ' HA ' ' OE1' ' A' ' 52' ' ' GLU . 85.1 m-20 -86.4 15.91 4.98 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.272 -0.422 . . . . 20.0 111.96 -179.48 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 70.3 t -65.03 -38.11 81.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.541 -0.299 . . . . 20.0 111.522 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.481 ' O ' ' CE1' ' A' ' 53' ' ' TYR . 45.5 m -89.67 -16.48 30.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.511 -0.313 . . . . 20.0 111.703 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.471 ' OE1' ' HA ' ' A' ' 49' ' ' ASP . 56.5 mp0 -90.51 15.44 10.8 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.352 -0.385 . . . . 20.0 111.493 -179.85 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.597 ' N ' ' CD1' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -45.53 -83.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.716 0.293 . . . . 20.0 111.025 -179.286 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.487 ' HB3' ' HB2' ' A' ' 109' ' ' CYS . 7.9 t -142.12 -163.1 1.52 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.975 0.417 . . . . 20.0 110.513 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.477 ' CB ' ' O ' ' A' ' 54' ' ' SER . 2.7 m 82.33 17.03 0.37 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.052 -0.522 . . . . 20.0 110.83 179.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.518 ' HG2' ' N ' ' A' ' 57' ' ' GLU . 0.0 OUTLIER -55.77 -156.65 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.435 -0.348 . . . . 20.0 110.547 179.874 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.518 ' N ' ' HG2' ' A' ' 56' ' ' ARG . 80.1 tt0 -86.22 118.6 25.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.824 0.345 . . . . 20.0 110.9 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.5 ' HB2' HG23 ' A' ' 79' ' ' VAL . 0.1 OUTLIER -150.18 131.8 14.89 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.126 -0.488 . . . . 20.0 111.465 -179.917 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.462 ' CD2' ' O ' ' A' ' 58' ' ' LEU . 25.8 m170 -139.58 122.26 16.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.895 0.379 . . . . 20.0 110.792 178.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.612 ' CD1' ' CG1' ' A' ' 79' ' ' VAL . 14.9 m-85 -128.16 156.14 43.35 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.027 -0.533 . . . . 20.0 111.589 -179.124 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 40.1 p -111.05 88.41 2.78 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 112.325 0.491 . . . . 20.0 112.325 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.498 ' NE ' ' OE2' ' A' ' 77' ' ' GLU . 51.4 mtm180 -117.33 123.36 46.32 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.291 -1.003 . . . . 20.0 108.291 177.151 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.615 ' CD1' ' O ' ' A' ' 73' ' ' LYS . 1.7 m-85 -103.21 -79.29 0.54 Allowed 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 112.34 0.496 . . . . 20.0 112.34 -177.448 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.625 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -177.46 142.16 0.32 Allowed 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.581 -0.448 . . . . 20.0 111.44 -178.76 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.432 HG23 ' C ' ' A' ' 64' ' ' LEU . 30.0 p -138.9 132.71 30.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.058 -0.519 . . . . 20.0 110.081 178.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.558 ' O ' ' C ' ' A' ' 67' ' ' GLY . 5.1 t0 -150.29 -155.71 0.65 Allowed 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.701 -0.227 . . . . 20.0 110.397 -179.417 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.789 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -26.38 137.77 0.01 OUTLIER Glycine 0 C--N 1.347 1.171 0 N-CA-C 110.26 -1.136 . . . . 20.0 110.26 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.565 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 36.7 Cg_exo -17.09 59.74 0.0 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.97 0 C-N-CA 125.136 3.891 . . . . 20.0 115.387 -177.85 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.789 ' N ' ' O ' ' A' ' 67' ' ' GLY . 74.1 m -165.33 162.87 19.91 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 108.7 -0.852 . . . . 20.0 108.7 178.051 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.509 ' O ' ' N ' ' A' ' 122' ' ' LEU . 54.9 ttt180 -147.09 140.82 25.73 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 112.555 0.576 . . . . 20.0 112.555 -179.321 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.655 ' CA ' ' HA ' ' A' ' 121' ' ' LEU . 1.4 t -87.98 158.36 18.67 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-N 115.896 -0.593 . . . . 20.0 110.253 178.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.93 27.37 1.07 Allowed 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 114.427 1.269 . . . . 20.0 114.427 -179.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.615 ' O ' ' CD1' ' A' ' 63' ' ' PHE . 19.5 tttt -76.62 136.57 67.48 Favored Pre-proline 0 C--N 1.327 -0.411 0 C-N-CA 120.054 -0.658 . . . . 20.0 109.493 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -51.35 129.03 27.54 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.926 2.417 . . . . 20.0 113.172 -178.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.463 HG22 ' O ' ' A' ' 62' ' ' ARG . 17.4 m -142.3 147.79 20.91 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 CA-C-N 115.886 -0.597 . . . . 20.0 111.472 179.638 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 18.9 m -116.83 126.15 52.62 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.526 -0.546 . . . . 20.0 109.526 178.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.527 ' OE1' ' CD1' ' A' ' 136' ' ' LEU . 15.9 pt-20 -143.09 155.49 44.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.971 0.415 . . . . 20.0 111.554 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 58' ' ' LEU . 6.3 mp -105.39 143.59 33.34 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.757 -0.656 . . . . 20.0 110.272 178.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.612 ' CG1' ' CD1' ' A' ' 60' ' ' TYR . 32.8 m -99.72 81.94 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.037 0.446 . . . . 20.0 110.632 179.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.424 ' O ' ' SG ' ' A' ' 80' ' ' CYS . 27.2 p -131.51 109.09 10.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.914 -0.585 . . . . 20.0 110.996 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -142.55 104.81 4.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.191 -0.459 . . . . 20.0 110.941 179.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.443 ' HA3' ' HD3' ' A' ' 108' ' ' ARG . . . -162.12 -172.95 30.2 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.632 -0.794 . . . . 20.0 112.317 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -131.29 146.23 52.21 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.624 0.25 . . . . 20.0 110.338 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 107' ' ' PHE . 68.4 m -106.32 146.99 29.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.738 0.304 . . . . 20.0 110.467 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . 0.583 ' O ' ' CE1' ' A' ' 107' ' ' PHE . . . -156.91 173.32 34.56 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.856 -0.688 . . . . 20.0 112.267 -179.665 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -53.31 152.7 19.04 Favored 'Trans proline' 0 C--O 1.231 0.136 0 C-N-CA 122.844 2.362 . . . . 20.0 112.369 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -76.23 -1.17 25.13 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.154 -0.475 . . . . 20.0 111.498 -179.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . 0.426 ' C ' HD11 ' A' ' 89' ' ' LEU . 27.4 tpt180 -71.61 133.83 45.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.944 0.402 . . . . 20.0 110.743 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.542 ' HB3' ' CG2' ' A' ' 97' ' ' VAL . 0.4 OUTLIER -113.01 124.23 52.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.934 -0.576 . . . . 20.0 110.119 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.605 ' O ' ' CH2' ' A' ' 100' ' ' TRP . 0.2 OUTLIER -119.45 85.16 31.08 Favored Pre-proline 0 C--N 1.33 -0.261 0 N-CA-C 111.866 0.321 . . . . 20.0 111.866 -179.485 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.46 ' O ' ' OD1' ' A' ' 92' ' ' ASN . 88.7 Cg_endo -91.39 138.53 2.23 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 123.095 2.53 . . . . 20.0 112.002 179.216 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.46 ' OD1' ' O ' ' A' ' 91' ' ' PRO . 75.7 m-20 -138.87 13.13 2.68 Favored 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 120.825 -0.35 . . . . 20.0 111.387 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.56 ' HB3' ' CH2' ' A' ' 99' ' ' TRP . . . -119.22 -81.74 0.63 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.23 0.538 . . . . 20.0 110.916 179.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 2.8 mp -97.11 -4.92 9.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.369 -0.832 . . . . 20.0 111.105 179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 94.72 -1.48 65.97 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.927 -0.654 . . . . 20.0 111.652 -179.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.544 ' NE ' ' HD2' ' A' ' 98' ' ' LYS . 2.7 ptm180 -116.52 139.02 50.94 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.872 0.368 . . . . 20.0 110.934 -179.783 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.544 ' CG1' ' HD2' ' A' ' 101' ' ' ARG . 0.2 OUTLIER -106.48 110.47 31.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.982 -0.554 . . . . 20.0 109.739 179.702 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.57 ' HG3' ' CD1' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -161.74 20.65 0.11 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.217 -0.901 . . . . 20.0 111.112 -177.123 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.711 ' CZ3' ' CE3' ' A' ' 100' ' ' TRP . 0.0 OUTLIER -148.6 -83.6 0.11 Allowed 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.117 -0.697 . . . . 20.0 109.117 -177.302 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' TRP . . . . . 0.711 ' CE3' ' CZ3' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -90.84 134.58 34.34 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.369 -0.975 . . . . 20.0 108.369 177.67 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.544 ' HD2' ' CG1' ' A' ' 97' ' ' VAL . 0.1 OUTLIER -139.52 97.58 8.3 Favored Pre-proline 0 C--N 1.32 -0.716 0 C-N-CA 120.662 -0.415 . . . . 20.0 110.981 -179.061 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.419 ' HG3' ' NE1' ' A' ' 100' ' ' TRP . 38.5 Cg_exo -58.41 -36.55 97.41 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.709 2.272 . . . . 20.0 112.552 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -94.58 5.65 51.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.252 -0.431 . . . . 20.0 110.748 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.434 ' HA2' ' HD3' ' A' ' 105' ' ' PRO . . . 93.44 145.38 17.19 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.925 -0.655 . . . . 20.0 112.061 -179.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.434 ' HD3' ' HA2' ' A' ' 104' ' ' GLY . 20.5 Cg_exo -65.81 163.85 29.17 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.845 2.363 . . . . 20.0 112.281 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 57.0 p30 -60.85 170.74 1.4 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.224 -0.444 . . . . 20.0 111.255 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . 0.583 ' CE1' ' O ' ' A' ' 85' ' ' GLY . 59.5 m-85 -66.32 140.37 58.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.053 -0.522 . . . . 20.0 110.675 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.476 ' O ' ' HB2' ' A' ' 142' ' ' CYS . 62.2 ttt-85 -143.66 -116.57 0.1 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 120.986 -0.286 . . . . 20.0 111.271 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.487 ' HB2' ' HB3' ' A' ' 54' ' ' SER . 1.3 t -138.4 130.68 28.76 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.995 0.426 . . . . 20.0 111.547 -179.32 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.522 ' CD1' ' O ' ' A' ' 143' ' ' LYS . 2.0 mt -123.69 119.51 26.99 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.939 -0.573 . . . . 20.0 110.259 178.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 110' ' ' ILE . 9.2 Cg_endo -53.07 138.03 62.56 Favored 'Trans proline' 0 N--CA 1.464 -0.256 0 C-N-CA 122.455 2.103 . . . . 20.0 111.549 -179.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 46.6 t0 -120.51 -60.14 1.7 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.511 -0.313 . . . . 20.0 111.538 -179.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.45 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 53.2 ttt85 -126.38 143.59 51.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.286 -0.415 . . . . 20.0 111.519 -179.678 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.577 ' CD1' HG12 ' A' ' 137' ' ' VAL . 2.3 m-85 -118.66 157.39 27.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.908 -0.587 . . . . 20.0 110.6 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.431 ' HB2' ' HB1' ' A' ' 138' ' ' ALA . 55.5 ttm-85 -93.74 139.84 30.36 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 108.602 -0.888 . . . . 20.0 108.602 178.024 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -77.01 131.68 38.58 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 120.302 -0.559 . . . . 20.0 110.684 -178.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.466 ' HB2' ' HB ' ' A' ' 134' ' ' VAL . 49.6 mt-30 -133.46 101.87 5.31 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.961 -0.563 . . . . 20.0 110.57 -179.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 43.2 ttt85 -109.21 99.54 8.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.967 0.413 . . . . 20.0 110.28 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.548 ' O ' ' CD1' ' A' ' 64' ' ' LEU . 45.3 t -129.33 148.92 33.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 115.895 -0.593 . . . . 20.0 110.976 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.545 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 13.1 pt20 -92.21 134.82 34.52 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.391 -0.368 . . . . 20.0 110.223 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.655 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.2 OUTLIER -74.48 120.85 20.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.137 0.494 . . . . 20.0 111.134 -179.27 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.509 ' N ' ' O ' ' A' ' 70' ' ' ARG . 0.2 OUTLIER -89.69 138.77 31.19 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.469 -0.787 . . . . 20.0 111.114 -179.242 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . 0.565 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -106.64 119.39 51.74 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 116.06 -0.518 . . . . 20.0 111.02 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.8 103.11 0.81 Allowed 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.023 1.815 . . . . 20.0 111.147 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 87.28 13.81 65.19 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.635 -0.793 . . . . 20.0 111.503 -179.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . 0.498 ' O ' ' HB3' ' A' ' 123' ' ' CYS . . . -145.4 116.95 0.95 Allowed Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.543 -0.623 . . . . 20.0 111.543 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.487 ' C ' ' CD ' ' A' ' 129' ' ' PRO . . . -83.46 42.95 0.86 Allowed 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 112.057 0.391 . . . . 20.0 112.057 -178.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.447 ' N ' ' CD ' ' A' ' 129' ' ' PRO . . . -113.44 53.89 0.56 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.125 0.488 . . . . 20.0 110.648 179.314 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . 0.506 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 36.9 Cg_endo -65.86 151.58 83.83 Favored 'Trans proline' 0 N--CA 1.464 -0.251 0 C-N-CA 122.977 2.451 . . . . 20.0 112.767 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.545 ' O ' ' HA ' ' A' ' 120' ' ' GLN . 80.8 mtt85 -134.98 155.76 50.19 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 116.004 -0.544 . . . . 20.0 110.634 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.429 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 13.2 p -103.52 133.46 48.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.86 0.362 . . . . 20.0 111.23 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 60.6 ttt85 -140.37 143.57 35.79 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.094 -0.503 . . . . 20.0 111.593 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.474 ' O ' HG23 ' A' ' 134' ' ' VAL . 17.5 pttp -97.02 149.31 22.06 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 115.884 -0.598 . . . . 20.0 110.44 179.442 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . 0.515 ' CG2' HD21 ' A' ' 64' ' ' LEU . 3.2 t -147.68 123.92 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-O 121.118 0.485 . . . . 20.0 111.768 -179.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.493 ' HB3' ' HB2' ' A' ' 114' ' ' TYR . 93.9 mtt-85 -100.45 109.73 21.89 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.516 -0.765 . . . . 20.0 109.526 178.351 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.572 ' N ' ' CD2' ' A' ' 136' ' ' LEU . 1.1 mm? -111.57 125.69 54.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.1 0.476 . . . . 20.0 112.224 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.577 HG12 ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -52.83 83.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.1 -0.5 . . . . 20.0 111.393 179.853 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.511 ' N ' ' O ' ' A' ' 136' ' ' LEU . . . -74.36 -8.83 57.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.082 0.468 . . . . 20.0 110.039 178.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.7 p -163.09 121.33 2.01 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.653 -0.703 . . . . 20.0 109.68 179.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' CYS . . . . . . . . . . . . . 12.5 p -137.01 162.46 33.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.979 0.418 . . . . 20.0 111.631 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 75.6 mttt -143.67 159.68 42.03 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.924 -0.58 . . . . 20.0 111.198 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . 0.543 ' SG ' ' CE2' ' A' ' 53' ' ' TYR . 36.1 t -73.02 109.17 6.35 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.021 0.439 . . . . 20.0 110.208 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.526 ' HD3' ' N ' ' A' ' 144' ' ' ARG . 3.3 tmtm? -113.2 124.7 53.14 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.685 -0.689 . . . . 20.0 110.961 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.526 ' N ' ' HD3' ' A' ' 143' ' ' LYS . 3.4 mpt_? . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.315 -0.85 . . . . 20.0 110.874 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 92.1 mttt . . . . . 0 N--CA 1.485 1.32 0 CA-C-O 120.957 0.408 . . . . 20.0 111.025 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.453 ' HB2' ' CD ' ' A' ' 52' ' ' GLU . 39.8 p30 -84.84 16.22 3.47 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.892 -0.595 . . . . 20.0 111.691 -179.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 71.8 t -66.5 -31.12 52.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 116.229 -0.441 . . . . 20.0 111.344 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.1 p -87.39 -1.54 57.99 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.265 0.469 . . . . 20.0 112.265 -178.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.453 ' CD ' ' HB2' ' A' ' 49' ' ' ASP . 96.8 mt-10 -64.62 -35.5 81.22 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.867 0.365 . . . . 20.0 111.031 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.557 ' CE2' ' O ' ' A' ' 140' ' ' CYS . 40.0 p90 -101.3 -1.36 33.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.325 -0.398 . . . . 20.0 111.221 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 73.9 m -80.42 141.31 35.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.294 0.569 . . . . 20.0 111.46 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.504 ' HB3' ' HA3' ' A' ' 82' ' ' GLY . 0.0 OUTLIER -93.26 -36.85 12.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.149 -0.932 . . . . 20.0 110.977 -179.297 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.512 ' CD ' ' N ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -162.5 164.39 27.01 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.436 -0.347 . . . . 20.0 110.882 -179.875 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -56.22 85.35 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.155 0 N-CA-C 109.588 -0.523 . . . . 20.0 109.588 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.609 ' CD2' ' N ' ' A' ' 59' ' ' HIS . 0.0 OUTLIER -108.43 132.7 53.52 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.671 -0.695 . . . . 20.0 112.813 -178.133 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.609 ' N ' ' CD2' ' A' ' 58' ' ' LEU . 0.4 OUTLIER -169.29 101.39 0.35 Allowed 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 116.021 -0.536 . . . . 20.0 111.439 177.294 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.556 ' CD2' HG11 ' A' ' 79' ' ' VAL . 20.6 m-30 -110.67 150.06 29.57 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.698 0.629 . . . . 20.0 112.698 -179.018 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 24.0 p -118.88 84.99 2.28 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 115.051 -0.977 . . . . 20.0 110.293 178.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.448 ' O ' HG22 ' A' ' 75' ' ' VAL . 57.1 ttt85 -112.43 125.64 54.44 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 108.473 -0.936 . . . . 20.0 108.473 178.44 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.58 ' CD1' ' O ' ' A' ' 73' ' ' LYS . 0.1 OUTLIER -110.01 -84.75 0.55 Allowed 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.555 0.576 . . . . 20.0 112.555 -177.935 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.554 ' CD1' ' HB3' ' A' ' 71' ' ' SER . 0.0 OUTLIER -164.5 132.55 3.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.888 0.375 . . . . 20.0 111.448 -178.68 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.523 HG23 ' CD ' ' A' ' 70' ' ' ARG . 44.2 p -131.44 132.92 44.69 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.95 -0.568 . . . . 20.0 110.603 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.524 ' O ' ' O ' ' A' ' 67' ' ' GLY . 20.1 p-10 -145.01 -161.36 1.28 Allowed 'General case' 0 C--O 1.237 0.426 0 N-CA-C 110.355 -0.239 . . . . 20.0 110.355 179.377 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.837 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -30.51 149.09 0.01 OUTLIER Glycine 0 C--N 1.342 0.902 0 CA-C-O 118.784 -1.009 . . . . 20.0 110.688 179.183 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.502 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 57.0 Cg_exo -16.67 53.42 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.657 1 C-N-CA 125.852 4.368 . . . . 20.0 115.613 -178.476 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.837 ' N ' ' O ' ' A' ' 67' ' ' GLY . 18.3 m -164.56 160.28 20.1 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 108.344 -0.984 . . . . 20.0 108.344 178.412 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.523 ' CD ' HG23 ' A' ' 65' ' ' THR . 71.5 ttt180 -153.58 140.46 19.16 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.865 0.364 . . . . 20.0 111.414 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.566 ' CB ' ' HA ' ' A' ' 121' ' ' LEU . 0.0 OUTLIER -81.15 165.19 21.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.923 -0.581 . . . . 20.0 110.324 179.279 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -148.26 24.03 1.03 Allowed 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.672 0.619 . . . . 20.0 112.672 178.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.58 ' O ' ' CD1' ' A' ' 63' ' ' PHE . 1.8 mmpt? -67.3 128.97 93.84 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 109.786 -0.45 . . . . 20.0 109.786 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -46.69 117.72 2.24 Favored 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 122.411 2.074 . . . . 20.0 112.693 -179.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.545 HG22 ' CD1' ' A' ' 63' ' ' PHE . 28.8 m -133.24 155.69 41.09 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.244 0 CA-C-N 116.14 -0.482 . . . . 20.0 110.893 179.484 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.43 HG21 HD11 ' A' ' 78' ' ' LEU . 14.3 m -116.54 121.24 41.21 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.786 -0.45 . . . . 20.0 109.786 177.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.452 ' N ' ' O ' ' A' ' 60' ' ' TYR . 78.6 tt0 -120.53 124.07 44.45 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.945 -0.57 . . . . 20.0 110.414 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.503 ' CD1' ' N ' ' A' ' 78' ' ' LEU . 3.9 mp -111.47 120.59 42.67 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 121.646 0.736 . . . . 20.0 111.61 -179.694 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.606 ' CG2' ' O ' ' A' ' 79' ' ' VAL . 3.9 m -106.12 79.87 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.068 0 CA-C-N 114.544 -1.207 . . . . 20.0 109.509 178.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.478 ' O ' ' O ' ' A' ' 109' ' ' CYS . 0.8 OUTLIER -82.54 113.49 20.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.939 -0.573 . . . . 20.0 110.85 -179.071 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.494 ' O ' ' NH1' ' A' ' 56' ' ' ARG . 3.1 m -146.56 98.87 3.13 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.048 -0.523 . . . . 20.0 110.833 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.528 ' CA ' ' SG ' ' A' ' 109' ' ' CYS . . . -166.19 -146.53 4.86 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.633 -0.794 . . . . 20.0 112.051 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.454 ' HA ' ' HA ' ' A' ' 108' ' ' ARG . 88.1 mt-30 -126.18 145.98 50.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.709 0.29 . . . . 20.0 110.607 179.377 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.519 ' N ' ' O ' ' A' ' 107' ' ' PHE . 0.0 OUTLIER -131.3 160.6 34.47 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.334 -0.393 . . . . 20.0 111.454 179.498 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -129.12 70.51 0.51 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.578 -0.82 . . . . 20.0 112.408 179.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . 0.517 ' HG2' ' CD2' ' A' ' 107' ' ' PHE . 53.3 Cg_exo -56.21 145.26 77.72 Favored 'Trans proline' 0 N--CA 1.471 0.165 0 C-N-CA 123.42 2.747 . . . . 20.0 112.426 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.475 ' O ' HD22 ' A' ' 89' ' ' LEU . . . -70.39 -8.39 50.36 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.374 -0.376 . . . . 20.0 110.438 179.095 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -85.35 109.54 18.47 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.244 -0.434 . . . . 20.0 110.014 179.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.475 HD22 ' O ' ' A' ' 87' ' ' ALA . 0.4 OUTLIER -102.85 110.12 21.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.141 -0.482 . . . . 20.0 111.179 -179.457 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -125.71 95.69 39.68 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 112.357 0.502 . . . . 20.0 112.357 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.557 ' HB2' ' NE1' ' A' ' 100' ' ' TRP . 69.2 Cg_exo -41.81 112.89 0.25 Allowed 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 122.117 1.878 . . . . 20.0 111.299 178.319 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.492 ' O ' ' CH2' ' A' ' 99' ' ' TRP . 52.9 t-20 -100.43 134.73 42.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.37 0.605 . . . . 20.0 112.244 -179.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.609 ' HA ' ' HZ3' ' A' ' 100' ' ' TRP . . . -68.04 -20.37 64.97 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.998 -1.001 . . . . 20.0 111.735 179.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.48 ' CD1' ' HH2' ' A' ' 99' ' ' TRP . 6.4 mt 29.8 35.0 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-O 121.438 0.637 . . . . 20.0 111.265 -179.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . 0.556 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 111.3 -50.98 0.73 Allowed Glycine 0 CA--C 1.523 0.579 0 CA-C-N 114.998 -1.001 . . . . 20.0 113.611 179.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.501 ' O ' ' CZ2' ' A' ' 99' ' ' TRP . 13.5 tpt180 -126.3 143.69 51.07 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 117.08 0.44 . . . . 20.0 110.352 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.633 HG13 ' CE3' ' A' ' 100' ' ' TRP . 5.8 t -119.94 136.33 57.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 CA-C-O 122.064 0.935 . . . . 20.0 112.805 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.43 ' HG3' ' HD1' ' A' ' 99' ' ' TRP . 0.2 OUTLIER 164.77 -32.9 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 113.672 -1.604 . . . . 20.0 108.791 -179.933 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.501 ' CZ2' ' O ' ' A' ' 96' ' ' ARG . 24.6 p-90 -95.57 39.66 1.12 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 113.336 -1.756 . . . . 20.0 109.732 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' TRP . . . . . 0.729 ' HA ' ' CE3' ' A' ' 100' ' ' TRP . 0.0 OUTLIER -45.85 140.96 3.28 Favored 'General case' 0 CA--C 1.501 -0.907 0 N-CA-C 113.53 0.937 . . . . 20.0 113.53 -177.613 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.88 79.35 24.35 Favored Pre-proline 0 N--CA 1.44 -0.972 0 CA-C-N 113.974 -1.466 . . . . 20.0 110.173 179.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.534 ' HA ' ' HG3' ' A' ' 91' ' ' PRO . 9.5 Cg_endo -52.47 -18.12 7.72 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.774 2.316 . . . . 20.0 111.736 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -83.83 2.34 38.73 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.21 -0.45 . . . . 20.0 111.197 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.468 ' HA3' ' HA ' ' A' ' 89' ' ' LEU . . . 62.33 147.71 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.906 -0.664 . . . . 20.0 112.729 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -83.13 157.02 15.04 Favored 'Trans proline' 0 N--CA 1.458 -0.612 0 C-N-CA 122.994 2.463 . . . . 20.0 112.515 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -74.01 135.93 43.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.239 -0.437 . . . . 20.0 109.938 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . 0.519 ' O ' ' N ' ' A' ' 84' ' ' CYS . 86.8 m-85 -109.24 130.57 55.49 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.904 0.383 . . . . 20.0 111.758 -178.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.526 ' HA ' ' O ' ' A' ' 82' ' ' GLY . 93.6 mtm-85 -69.0 143.91 54.25 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 116.059 -0.519 . . . . 20.0 111.844 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.629 ' HA ' ' HA ' ' A' ' 142' ' ' CYS . 0.6 OUTLIER -80.26 102.15 9.32 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 109.31 -0.626 . . . . 20.0 109.31 178.26 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 1.2 pt -121.62 160.61 45.65 Favored Pre-proline 0 N--CA 1.463 0.211 0 CA-C-O 120.727 0.299 . . . . 20.0 111.784 -178.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.544 ' HB3' ' CG1' ' A' ' 137' ' ' VAL . 14.5 Cg_exo -66.6 157.31 61.43 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.792 2.328 . . . . 20.0 112.112 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -137.2 -57.41 0.71 Allowed 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.508 0.558 . . . . 20.0 112.508 -179.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.541 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 57.5 ttt180 -117.63 154.15 32.07 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.542 0.211 . . . . 20.0 111.444 -179.159 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.569 ' CD2' ' N ' ' A' ' 137' ' ' VAL . 2.3 m-85 -127.81 155.3 44.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.488 0.661 . . . . 20.0 111.82 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.452 ' O ' ' HA ' ' A' ' 135' ' ' ARG . 27.3 ttm-85 -94.29 146.27 24.15 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.968 -1.014 . . . . 20.0 108.959 178.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -94.74 116.39 28.68 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.29 0.567 . . . . 20.0 110.65 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -130.63 111.62 12.38 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.531 -0.759 . . . . 20.0 109.684 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 59.9 ttp180 -110.49 101.3 10.0 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.877 -0.601 . . . . 20.0 110.356 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.537 ' CG2' HD21 ' A' ' 64' ' ' LEU . 35.4 m -125.42 162.95 27.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 120.872 0.368 . . . . 20.0 111.264 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.555 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 14.4 pt20 -95.99 137.84 34.48 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-O 121.53 0.681 . . . . 20.0 112.17 -178.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.566 ' HA ' ' CB ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -74.79 133.9 41.88 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 115.218 -0.901 . . . . 20.0 109.557 179.094 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.482 ' CD1' ' HA ' ' A' ' 71' ' ' SER . 2.3 mp -94.72 140.34 30.02 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.404 0.621 . . . . 20.0 111.638 -178.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . 0.499 ' SG ' ' HD2' ' A' ' 124' ' ' PRO . 0.3 OUTLIER -117.85 154.8 51.3 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 115.27 -0.877 . . . . 20.0 109.455 178.957 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . 0.499 ' HD2' ' SG ' ' A' ' 123' ' ' CYS . 51.3 Cg_exo -53.32 114.1 1.59 Allowed 'Trans proline' 0 N--CA 1.463 -0.283 0 C-N-CA 121.958 1.772 . . . . 20.0 112.083 -179.519 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . 0.423 ' O ' ' C ' ' A' ' 126' ' ' GLY . . . 100.64 2.64 55.35 Favored Glycine 0 N--CA 1.451 -0.349 0 CA-C-N 115.768 -0.651 . . . . 20.0 112.628 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . 0.423 ' C ' ' O ' ' A' ' 125' ' ' GLY . . . 36.38 61.93 0.8 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.667 -0.777 . . . . 20.0 111.811 -179.861 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -103.0 -56.62 2.19 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.519 0.563 . . . . 20.0 112.519 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -125.28 58.3 19.73 Favored Pre-proline 0 C--N 1.325 -0.484 0 C-N-CA 120.886 -0.326 . . . . 20.0 111.819 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -48.87 150.15 6.92 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.477 2.118 . . . . 20.0 111.295 178.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.555 ' O ' ' HA ' ' A' ' 120' ' ' GLN . 98.3 mtt180 -123.75 148.43 46.63 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 121.054 -0.258 . . . . 20.0 110.86 -179.609 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.531 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 22.9 t -100.46 134.61 43.16 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.004 0.431 . . . . 20.0 111.705 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . 0.536 ' HD3' ' CB ' ' A' ' 64' ' ' LEU . 47.4 ttt85 -141.2 141.77 34.04 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.854 -0.612 . . . . 20.0 111.194 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.408 ' O ' HG23 ' A' ' 134' ' ' VAL . 16.7 pttm -92.91 145.2 24.56 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.783 0.325 . . . . 20.0 111.067 179.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . 0.529 HG21 ' O ' ' A' ' 63' ' ' PHE . 41.2 t -147.66 130.62 8.0 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.799 0 CA-C-O 121.529 0.681 . . . . 20.0 112.295 -179.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.452 ' HA ' ' O ' ' A' ' 115' ' ' ARG . 36.5 ptt-85 -113.52 111.85 22.59 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.868 -1.06 . . . . 20.0 109.652 178.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 8.7 mt -119.05 143.05 47.32 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.372 0.508 . . . . 20.0 112.372 -179.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.569 ' N ' ' CD2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -63.32 83.76 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.989 -0.551 . . . . 20.0 111.028 179.192 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -65.98 -19.82 65.99 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.881 0.372 . . . . 20.0 110.672 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 38.6 t -161.82 133.45 5.46 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.06 -0.518 . . . . 20.0 110.372 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' CYS . . . . . 0.557 ' O ' ' CE2' ' A' ' 53' ' ' TYR . 26.6 p -133.81 165.49 24.86 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.211 0.529 . . . . 20.0 112.09 -179.432 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 28.2 mttp -120.81 138.29 54.11 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.357 -0.838 . . . . 20.0 109.226 178.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . 0.629 ' HA ' ' HA ' ' A' ' 109' ' ' CYS . 24.5 p -80.38 92.39 5.81 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.475 -0.49 . . . . 20.0 111.15 -178.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 11.3 tptp -138.38 157.9 45.32 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.116 -0.493 . . . . 20.0 111.069 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 39.0 mtp85 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.352 -0.833 . . . . 20.0 110.717 -179.373 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.8 mttm . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.851 0.357 . . . . 20.0 111.086 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -84.75 14.51 4.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.199 -0.455 . . . . 20.0 111.436 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 70.3 t -66.2 -40.32 86.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.313 -0.403 . . . . 20.0 111.402 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.4 p -82.8 -7.94 59.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.378 -0.374 . . . . 20.0 110.951 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.465 ' HB3' ' HB2' ' A' ' 83' ' ' GLN . 71.9 mm-40 -79.96 4.84 15.61 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.307 -0.406 . . . . 20.0 110.707 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.567 ' CD2' ' SG ' ' A' ' 142' ' ' CYS . 3.3 m-85 -95.5 19.6 10.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.058 -0.519 . . . . 20.0 111.614 -179.445 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.79 107.35 0.39 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.377 0.608 . . . . 20.0 110.225 -179.546 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.482 ' HB3' ' SG ' ' A' ' 80' ' ' CYS . 3.2 m -155.06 22.01 0.43 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.057 -0.974 . . . . 20.0 109.83 -179.669 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.509 ' N ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -48.33 -173.99 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.384 -0.826 . . . . 20.0 111.388 -179.195 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -78.15 91.96 4.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.79 -0.641 . . . . 20.0 110.751 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.577 ' CD2' HG22 ' A' ' 79' ' ' VAL . 0.0 OUTLIER -104.67 140.7 37.67 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.376 -0.829 . . . . 20.0 110.013 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.484 ' CG ' HG22 ' A' ' 76' ' ' THR . 48.2 m170 -125.52 130.75 52.38 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.546 -0.462 . . . . 20.0 111.486 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.585 ' CD1' HG13 ' A' ' 79' ' ' VAL . 0.2 OUTLIER -147.9 161.8 40.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.988 0.423 . . . . 20.0 111.28 179.483 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.594 HG21 ' CE1' ' A' ' 63' ' ' PHE . 52.8 m -76.11 136.22 39.85 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.609 0.719 . . . . 20.0 112.128 -178.67 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.466 ' O ' HG21 ' A' ' 75' ' ' VAL . 47.4 tpt85 174.86 109.61 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.59 -1.186 . . . . 20.0 108.799 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.594 ' CE1' HG21 ' A' ' 61' ' ' THR . 0.0 OUTLIER -116.41 -80.95 0.61 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.551 0.575 . . . . 20.0 112.551 -178.343 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.635 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -164.57 132.45 3.32 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 112.109 0.411 . . . . 20.0 112.109 -178.786 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.491 ' O ' ' NH1' ' A' ' 132' ' ' ARG . 72.6 p -129.12 136.62 50.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.067 -0.515 . . . . 20.0 110.232 178.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.516 ' O ' ' C ' ' A' ' 67' ' ' GLY . 31.4 p-10 -145.34 -164.33 1.92 Allowed 'General case' 0 C--O 1.237 0.426 0 CA-C-N 116.454 -0.339 . . . . 20.0 110.361 -179.789 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.845 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -31.72 147.99 0.01 OUTLIER Glycine 0 C--N 1.345 1.028 0 CA-C-O 118.453 -1.193 . . . . 20.0 110.152 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.547 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 56.3 Cg_exo -16.99 56.07 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.689 0 C-N-CA 125.167 3.911 . . . . 20.0 115.103 -178.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.845 ' N ' ' O ' ' A' ' 67' ' ' GLY . 34.4 m -163.22 157.68 20.69 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 108.272 -1.01 . . . . 20.0 108.272 178.603 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.517 ' O ' ' N ' ' A' ' 122' ' ' LEU . 80.6 mtt180 -149.26 143.95 26.2 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.679 0.622 . . . . 20.0 112.679 -179.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.635 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -89.02 159.01 17.8 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.478 -0.783 . . . . 20.0 109.521 177.938 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.571 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . . . -145.85 22.7 1.41 Allowed 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 113.68 0.992 . . . . 20.0 113.68 -179.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.528 ' CB ' HG13 ' A' ' 119' ' ' VAL . 0.1 OUTLIER -67.11 139.74 95.41 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 109.433 -0.58 . . . . 20.0 109.433 178.999 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.468 ' HD2' ' HG3' ' A' ' 73' ' ' LYS . 54.1 Cg_exo -51.87 125.94 18.53 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.353 2.035 . . . . 20.0 112.333 -179.127 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.466 HG21 ' O ' ' A' ' 62' ' ' ARG . 19.0 m -131.41 161.07 41.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.001 0.429 . . . . 20.0 111.248 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.484 HG22 ' CG ' ' A' ' 59' ' ' HIS . 0.0 OUTLIER -134.97 97.08 3.65 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.849 -0.614 . . . . 20.0 109.983 178.749 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.512 ' HG2' ' HB3' ' A' ' 136' ' ' LEU . 67.8 mt-10 -110.99 161.27 16.03 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.738 -0.664 . . . . 20.0 110.23 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.511 ' HA ' ' O ' ' A' ' 58' ' ' LEU . 8.7 mp -111.02 132.98 53.76 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.404 0.621 . . . . 20.0 111.494 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.585 HG13 ' CD1' ' A' ' 60' ' ' TYR . 23.4 m -87.05 78.16 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 CA-C-N 115.023 -0.989 . . . . 20.0 110.073 -179.446 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.482 ' SG ' ' HB3' ' A' ' 55' ' ' CYS . 0.1 OUTLIER -81.54 102.97 10.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.801 -0.636 . . . . 20.0 110.99 -179.084 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.0 m -146.3 104.91 3.83 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.866 -0.606 . . . . 20.0 111.045 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -161.43 -176.09 33.16 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.513 -0.851 . . . . 20.0 112.7 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.465 ' HB2' ' HB3' ' A' ' 52' ' ' GLU . 93.3 mt-30 -120.27 117.05 26.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.86 0.362 . . . . 20.0 110.299 179.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.498 ' HA ' ' CE1' ' A' ' 53' ' ' TYR . 86.3 m -84.26 -16.06 44.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.969 -0.56 . . . . 20.0 111.444 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . 0.516 ' N ' ' HB2' ' A' ' 107' ' ' PHE . . . -141.96 172.07 24.25 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.622 -0.799 . . . . 20.0 112.651 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -52.66 -166.53 0.01 OUTLIER 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.804 2.336 . . . . 20.0 112.321 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.477 ' O ' HD22 ' A' ' 89' ' ' LEU . . . -86.98 34.11 0.67 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.068 -0.514 . . . . 20.0 111.174 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . 0.548 ' NH2' ' CD1' ' A' ' 100' ' ' TRP . 25.5 tpt180 -56.25 131.91 49.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.085 0.469 . . . . 20.0 111.292 -179.284 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.507 ' N ' HD22 ' A' ' 89' ' ' LEU . 1.1 mm? -97.19 156.08 16.56 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.631 -0.713 . . . . 20.0 111.569 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.483 ' CD1' ' HD2' ' A' ' 91' ' ' PRO . 4.5 mm? -68.23 165.15 36.28 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.934 -0.575 . . . . 20.0 110.636 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.578 ' HA ' ' CZ2' ' A' ' 100' ' ' TRP . 16.2 Cg_endo -57.44 107.93 0.33 Allowed 'Trans proline' 0 CA--C 1.528 0.223 0 C-N-CA 123.014 2.476 . . . . 20.0 113.375 -179.403 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.422 ' N ' ' CZ2' ' A' ' 100' ' ' TRP . 90.5 m-20 -126.04 59.68 1.31 Allowed 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.29 -0.414 . . . . 20.0 111.642 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.604 ' HA ' ' CZ3' ' A' ' 100' ' ' TRP . . . -59.87 -28.48 67.57 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.692 0.627 . . . . 20.0 112.692 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.444 ' C ' ' O ' ' A' ' 93' ' ' ALA . 1.0 OUTLIER 36.7 29.95 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.122 0.487 . . . . 20.0 110.608 -178.74 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . 0.507 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 98.7 -34.34 5.4 Favored Glycine 0 CA--C 1.522 0.484 0 CA-C-N 115.647 -0.706 . . . . 20.0 113.302 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.529 ' N ' ' O ' ' A' ' 93' ' ' ALA . 40.8 ttp180 -112.95 146.82 38.33 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.888 0.375 . . . . 20.0 111.869 -179.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.52 ' CG2' ' HB3' ' A' ' 93' ' ' ALA . 11.3 t -146.59 121.91 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.125 0 CA-C-N 116.078 -0.51 . . . . 20.0 110.477 178.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.674 ' HG3' ' CD1' ' A' ' 99' ' ' TRP . 3.1 ptpt 178.92 33.33 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.445 0.64 . . . . 20.0 110.747 -178.592 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.674 ' CD1' ' HG3' ' A' ' 98' ' ' LYS . 0.0 OUTLIER -151.11 -66.91 0.19 Allowed 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 107.647 -1.242 . . . . 20.0 107.647 -178.0 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' TRP . . . . . 0.639 ' O ' ' CE3' ' A' ' 100' ' ' TRP . 0.0 OUTLIER -99.39 129.06 45.56 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 107.146 -1.427 . . . . 20.0 107.146 176.34 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.657 ' O ' ' N ' ' A' ' 103' ' ' ASN . 0.2 OUTLIER -137.17 127.46 15.89 Favored Pre-proline 0 C--N 1.318 -0.793 0 C-N-CA 119.412 -0.915 . . . . 20.0 111.728 179.963 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.422 ' HD2' ' HA ' ' A' ' 101' ' ' ARG . 84.1 Cg_exo -26.75 61.3 0.0 OUTLIER 'Trans proline' 0 C--N 1.355 0.896 1 C-N-CA 126.092 4.528 . . . . 20.0 116.204 -179.01 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . 0.657 ' N ' ' O ' ' A' ' 101' ' ' ARG . 79.3 m-20 -86.97 7.4 27.68 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.013 0.435 . . . . 20.0 110.254 178.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 129.18 147.48 6.36 Favored Glycine 0 N--CA 1.449 -0.488 0 CA-C-N 115.892 -0.595 . . . . 20.0 112.269 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -65.38 156.85 61.11 Favored 'Trans proline' 0 CA--C 1.528 0.176 0 C-N-CA 122.755 2.303 . . . . 20.0 112.562 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 57.1 p30 -52.88 164.65 0.36 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.052 -0.522 . . . . 20.0 111.015 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . 0.516 ' HB2' ' N ' ' A' ' 85' ' ' GLY . 23.3 m-85 -120.06 148.51 43.49 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.21 -0.45 . . . . 20.0 111.544 -179.275 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.456 ' HA ' ' HA ' ' A' ' 83' ' ' GLN . 36.6 ttm180 -169.02 131.56 1.27 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.943 -0.571 . . . . 20.0 111.026 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.468 ' HB2' ' HB2' ' A' ' 142' ' ' CYS . 23.4 t -61.97 112.66 2.42 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.049 -0.723 . . . . 20.0 109.049 179.376 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.539 ' CG1' ' HD2' ' A' ' 111' ' ' PRO . 10.8 tt -127.3 144.82 52.08 Favored Pre-proline 0 C--N 1.33 -0.273 0 N-CA-C 112.403 0.52 . . . . 20.0 112.403 -178.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.547 ' HB3' ' CG1' ' A' ' 137' ' ' VAL . 47.1 Cg_exo -56.61 154.71 29.55 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 123.126 2.551 . . . . 20.0 111.85 179.609 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -124.67 -60.74 1.36 Allowed 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.539 0.57 . . . . 20.0 112.539 -179.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.517 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 56.9 ttm-85 -111.98 156.66 21.78 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.104 0.409 . . . . 20.0 112.104 -178.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.637 ' HB3' ' N ' ' A' ' 136' ' ' LEU . 4.4 m-85 -134.51 165.49 25.08 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.681 -0.69 . . . . 20.0 112.188 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.514 ' N ' ' O ' ' A' ' 136' ' ' LEU . 14.2 ttm180 -103.3 151.31 22.86 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.611 -1.177 . . . . 20.0 108.358 177.739 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -90.52 124.84 35.33 Favored 'General case' 0 C--N 1.319 -0.761 0 C-N-CA 120.482 -0.487 . . . . 20.0 111.597 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.45 ' NE2' ' HG2' ' A' ' 115' ' ' ARG . 83.1 mm-40 -131.44 131.3 43.44 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.889 -0.596 . . . . 20.0 110.71 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.403 ' HA ' ' O ' ' A' ' 132' ' ' ARG . 50.9 mtm180 -127.35 95.68 4.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.203 -0.453 . . . . 20.0 110.156 178.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.528 HG13 ' CB ' ' A' ' 73' ' ' LYS . 41.5 t -119.22 145.44 25.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.813 -0.631 . . . . 20.0 111.2 -179.45 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.51 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 20.4 pt20 -79.27 131.23 36.09 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.174 -0.467 . . . . 20.0 109.803 179.53 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.567 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -78.46 125.49 29.44 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.088 0.471 . . . . 20.0 109.785 179.91 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.517 ' N ' ' O ' ' A' ' 70' ' ' ARG . 0.3 OUTLIER -85.77 131.96 34.22 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.435 -0.802 . . . . 20.0 111.665 -178.35 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . 0.547 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.5 OUTLIER -108.71 159.96 29.03 Favored Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 115.16 -0.927 . . . . 20.0 109.035 179.028 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . 0.514 ' HD2' ' SG ' ' A' ' 123' ' ' CYS . 73.8 Cg_exo -50.71 111.11 0.48 Allowed 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 121.605 1.537 . . . . 20.0 111.913 -179.144 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 96.41 -11.11 67.14 Favored Glycine 0 N--CA 1.448 -0.501 0 CA-C-N 115.715 -0.675 . . . . 20.0 112.232 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 72.26 23.39 78.03 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 120.751 -0.737 . . . . 20.0 112.298 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -92.9 -5.86 49.92 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.333 0.494 . . . . 20.0 112.333 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.407 ' N ' ' CD ' ' A' ' 129' ' ' PRO . . . -133.12 51.02 6.25 Favored Pre-proline 0 C--N 1.331 -0.23 0 N-CA-C 112.727 0.64 . . . . 20.0 112.727 -179.413 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . 0.436 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 45.6 Cg_endo -68.97 140.16 44.9 Favored 'Trans proline' 0 CA--C 1.528 0.177 0 C-N-CA 122.421 2.081 . . . . 20.0 112.528 179.277 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.539 ' HB2' ' CD1' ' A' ' 121' ' ' LEU . 70.1 mtp85 -142.11 134.22 27.54 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.406 -0.361 . . . . 20.0 110.659 179.34 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 22.3 t -85.02 135.46 34.01 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.791 0.329 . . . . 20.0 110.701 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . 0.491 ' NH1' ' O ' ' A' ' 65' ' ' THR . 66.8 ttt180 -143.53 140.9 30.49 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.158 0.429 . . . . 20.0 112.158 -179.082 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.403 ' HA ' ' O ' ' A' ' 117' ' ' GLN . 2.5 pttp -98.41 139.13 34.62 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.473 -0.566 . . . . 20.0 109.473 178.246 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . 0.469 HG21 HD21 ' A' ' 64' ' ' LEU . 13.1 m -145.33 128.57 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 CA-C-O 121.401 0.619 . . . . 20.0 111.364 -179.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.499 ' HB3' ' HB2' ' A' ' 114' ' ' TYR . 55.9 mtm180 -81.59 122.15 27.23 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.939 -1.028 . . . . 20.0 110.007 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.637 ' N ' ' HB3' ' A' ' 114' ' ' TYR . 9.2 mt -117.5 126.19 52.17 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.878 0.37 . . . . 20.0 111.998 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.566 HG11 ' CZ ' ' A' ' 114' ' ' TYR . 0.2 OUTLIER -71.33 89.48 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.403 -0.362 . . . . 20.0 111.909 179.692 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -78.44 -9.38 59.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.176 0.512 . . . . 20.0 109.809 178.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.3 p -158.35 120.0 3.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.575 -0.739 . . . . 20.0 110.353 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' CYS . . . . . 0.53 ' CB ' ' HA ' ' A' ' 111' ' ' PRO . 4.0 p -134.46 157.54 46.22 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.999 0.428 . . . . 20.0 111.746 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 42.6 mttt -125.43 146.69 49.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.716 -0.675 . . . . 20.0 110.046 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . 0.567 ' SG ' ' CD2' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -75.87 99.64 4.55 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.093 0.473 . . . . 20.0 110.462 179.995 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.52 ' O ' ' HB2' ' A' ' 144' ' ' ARG . 17.8 mmtm -138.04 158.83 43.52 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.68 -0.691 . . . . 20.0 111.027 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.52 ' HB2' ' O ' ' A' ' 143' ' ' LYS . 72.3 mtt180 . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.23 -0.89 . . . . 20.0 110.925 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 72.3 mttt . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.797 0.332 . . . . 20.0 111.301 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -85.9 17.24 3.56 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.371 -0.377 . . . . 20.0 111.258 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 78.1 t -66.09 -30.01 48.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.139 -0.482 . . . . 20.0 111.895 -179.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 37.8 p -82.11 -4.06 56.09 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.609 -0.268 . . . . 20.0 111.558 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -65.73 -37.0 85.17 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 111.728 0.269 . . . . 20.0 111.728 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.59 ' CD1' ' SG ' ' A' ' 142' ' ' CYS . 0.0 OUTLIER -104.27 -68.67 0.84 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.223 0.535 . . . . 20.0 110.826 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.493 ' HB2' ' HA3' ' A' ' 82' ' ' GLY . 0.1 OUTLIER -139.93 -155.91 0.63 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.391 -0.822 . . . . 20.0 110.588 -179.253 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.403 ' SG ' ' C ' ' A' ' 54' ' ' SER . 0.0 OUTLIER 48.57 93.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.22 -0.445 . . . . 20.0 109.831 179.751 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.525 ' HB2' HD21 ' A' ' 58' ' ' LEU . 3.5 mtt180 -120.64 -157.06 0.7 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.272 -0.422 . . . . 20.0 111.463 -178.66 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -89.64 5.23 46.68 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.868 -0.606 . . . . 20.0 111.563 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.547 ' CG ' HG22 ' A' ' 79' ' ' VAL . 0.9 OUTLIER -81.49 123.83 28.95 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.031 0.443 . . . . 20.0 110.34 179.985 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.605 ' CD2' ' HG ' ' A' ' 78' ' ' LEU . 56.1 m80 -117.91 160.12 21.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.064 -0.516 . . . . 20.0 111.631 -178.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.564 ' CE2' ' HB ' ' A' ' 79' ' ' VAL . 13.3 m-30 -120.22 154.92 34.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.193 0.52 . . . . 20.0 111.519 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.406 ' O ' ' OG1' ' A' ' 61' ' ' THR . 0.2 OUTLIER -100.81 86.43 3.09 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.511 -0.768 . . . . 20.0 111.435 -179.298 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.534 ' O ' ' CG2' ' A' ' 75' ' ' VAL . 37.4 ttp180 -117.66 119.73 35.85 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.606 -0.887 . . . . 20.0 108.606 178.373 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.593 ' CD1' ' O ' ' A' ' 73' ' ' LYS . 0.1 OUTLIER -106.75 -80.03 0.57 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.851 0.685 . . . . 20.0 112.851 -177.755 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.599 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -174.37 146.21 1.05 Allowed 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 120.692 -0.403 . . . . 20.0 112.035 -178.479 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 71.0 p -137.97 148.57 45.34 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.084 -0.507 . . . . 20.0 111.379 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.518 ' O ' ' C ' ' A' ' 67' ' ' GLY . 7.9 t0 -154.13 -167.5 2.66 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.108 -0.496 . . . . 20.0 109.835 179.051 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.835 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -32.56 149.17 0.01 OUTLIER Glycine 0 C--N 1.345 1.036 0 CA-C-O 118.171 -1.349 . . . . 20.0 110.197 179.093 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.503 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 77.6 Cg_exo -18.27 57.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 124.742 3.628 . . . . 20.0 114.949 -178.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.835 ' N ' ' O ' ' A' ' 67' ' ' GLY . 55.7 m -163.82 154.24 15.43 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 108.164 -1.05 . . . . 20.0 108.164 178.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.499 ' N ' ' O ' ' A' ' 122' ' ' LEU . 74.1 mtt85 -151.84 144.3 24.14 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.61 0.596 . . . . 20.0 112.61 -179.409 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.609 ' CA ' ' HA ' ' A' ' 121' ' ' LEU . 0.3 OUTLIER -83.17 164.39 20.22 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.318 -0.856 . . . . 20.0 110.14 178.659 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -152.16 34.52 0.52 Allowed 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.309 0.855 . . . . 20.0 113.309 -179.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.593 ' O ' ' CD1' ' A' ' 63' ' ' PHE . 21.8 mttm -82.35 148.55 59.52 Favored Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 109.193 -0.669 . . . . 20.0 109.193 178.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_endo -58.42 120.11 7.78 Favored 'Trans proline' 0 CA--C 1.525 0.072 0 C-N-CA 122.314 2.009 . . . . 20.0 112.871 -178.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.557 HG21 ' CD1' ' A' ' 63' ' ' PHE . 16.4 m -133.99 143.74 37.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.672 -0.695 . . . . 20.0 110.813 179.531 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 73.4 m -125.29 129.56 50.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.955 0.407 . . . . 20.0 111.55 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.52 ' O ' ' HA ' ' A' ' 59' ' ' HIS . 15.0 pt-20 -144.23 154.92 43.6 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.91 -0.586 . . . . 20.0 109.633 178.466 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.605 ' HG ' ' CD2' ' A' ' 59' ' ' HIS . 6.4 mp -88.18 148.38 24.43 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.377 0.608 . . . . 20.0 112.095 -179.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.668 ' CG2' ' O ' ' A' ' 79' ' ' VAL . 0.8 OUTLIER -109.08 84.63 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.762 0 CA-C-N 114.909 -1.041 . . . . 20.0 109.119 179.082 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.438 ' HB3' ' SG ' ' A' ' 109' ' ' CYS . 0.0 OUTLIER -93.92 108.96 20.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.581 -0.736 . . . . 20.0 111.026 -178.729 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.466 ' C ' ' OG ' ' A' ' 54' ' ' SER . 29.2 t -147.45 98.05 2.94 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.917 -0.583 . . . . 20.0 110.695 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.493 ' HA3' ' HB2' ' A' ' 54' ' ' SER . . . -161.02 -153.44 7.0 Favored Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.696 -0.764 . . . . 20.0 112.68 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.514 ' HA ' ' HA ' ' A' ' 108' ' ' ARG . 97.5 mt-30 -122.44 147.22 46.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.892 0.377 . . . . 20.0 111.033 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.452 ' O ' ' HB3' ' A' ' 107' ' ' PHE . 84.6 m -118.63 154.84 32.0 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.149 -0.478 . . . . 20.0 110.704 179.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . 0.441 ' O ' ' O ' ' A' ' 84' ' ' CYS . . . 51.78 173.76 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.366 -0.921 . . . . 20.0 111.554 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -52.99 140.07 59.86 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.194 1.929 . . . . 20.0 111.431 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.493 ' O ' HD11 ' A' ' 89' ' ' LEU . . . -77.53 0.55 22.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.417 -0.356 . . . . 20.0 111.581 -179.492 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 19.7 mmm180 -70.15 138.29 51.74 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.962 0.41 . . . . 20.0 110.26 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.493 HD11 ' O ' ' A' ' 87' ' ' ALA . 0.3 OUTLIER -108.93 119.03 38.36 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.88 -0.6 . . . . 20.0 111.401 -179.177 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 10.8 mt -107.2 121.35 44.88 Favored Pre-proline 0 N--CA 1.462 0.15 0 CA-C-O 120.849 0.357 . . . . 20.0 111.258 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.549 ' HG2' ' NE1' ' A' ' 100' ' ' TRP . 58.0 Cg_endo -70.35 96.39 0.64 Allowed 'Trans proline' 0 CA--C 1.532 0.415 0 C-N-CA 122.784 2.322 . . . . 20.0 111.603 179.218 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -158.6 78.1 0.78 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 120.991 0.424 . . . . 20.0 110.74 -179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.474 ' CB ' ' CZ ' ' A' ' 101' ' ' ARG . . . -66.67 -46.83 74.4 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.901 -0.59 . . . . 20.0 112.515 -179.161 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.466 HD11 ' CZ2' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -138.15 -16.73 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 N-CA-C 113.253 0.834 . . . . 20.0 113.253 -178.452 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 126.58 -30.68 4.17 Favored Glycine 0 N--CA 1.453 -0.191 0 C-N-CA 120.592 -0.813 . . . . 20.0 112.039 -178.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.591 ' O ' ' CZ3' ' A' ' 100' ' ' TRP . 73.0 mtt180 -67.17 -161.59 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.208 -0.664 . . . . 20.0 109.208 178.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 1.005 ' O ' ' CD1' ' A' ' 99' ' ' TRP . 2.1 t -146.52 -138.74 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.198 -1.637 0 CA-C-N 117.73 0.241 . . . . 20.0 111.525 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.569 ' CG ' ' O ' ' A' ' 97' ' ' VAL . 1.4 ptpt 42.51 18.41 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 113.851 1.056 . . . . 20.0 113.851 179.097 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 1.005 ' CD1' ' O ' ' A' ' 97' ' ' VAL . 18.7 p-90 -157.0 14.68 0.27 Allowed 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 109.959 -0.385 . . . . 20.0 109.959 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' TRP . . . . . 0.73 ' HA ' ' CE3' ' A' ' 100' ' ' TRP . 0.0 OUTLIER -33.09 138.79 0.06 Allowed 'General case' 0 CA--C 1.493 -1.222 0 CA-C-O 122.702 1.239 . . . . 20.0 114.038 -177.552 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.474 ' CZ ' ' CB ' ' A' ' 93' ' ' ALA . 1.6 mpp_? -127.45 82.98 67.24 Favored Pre-proline 0 N--CA 1.431 -1.387 0 CA-C-N 112.572 -2.104 . . . . 20.0 109.289 179.222 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -57.08 -10.21 5.62 Favored 'Trans proline' 0 N--CA 1.464 -0.226 0 C-N-CA 123.202 2.601 . . . . 20.0 112.611 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -57.35 -35.74 70.32 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.98 0.419 . . . . 20.0 110.005 179.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.454 ' HA3' ' HB3' ' A' ' 89' ' ' LEU . . . 64.22 173.67 3.23 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.907 -0.664 . . . . 20.0 112.825 179.37 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -73.48 135.74 22.67 Favored 'Trans proline' 0 N--CA 1.464 -0.25 0 C-N-CA 122.794 2.33 . . . . 20.0 111.857 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -80.16 138.52 36.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.833 0.349 . . . . 20.0 111.102 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . 0.452 ' HB3' ' O ' ' A' ' 84' ' ' CYS . 94.2 m-85 -120.83 147.09 45.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 20.0 110.746 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.514 ' HA ' ' HA ' ' A' ' 83' ' ' GLN . 35.2 ptt180 -178.42 163.22 1.56 Allowed 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.266 -0.425 . . . . 20.0 110.981 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.495 ' HA ' ' HA ' ' A' ' 142' ' ' CYS . 42.5 t -80.88 129.41 34.52 Favored 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 109.266 -0.642 . . . . 20.0 109.266 179.174 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.561 ' CG1' ' HD2' ' A' ' 111' ' ' PRO . 5.6 tt -123.09 140.45 33.6 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-O 120.837 0.351 . . . . 20.0 111.54 -179.178 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.561 ' HD2' ' CG1' ' A' ' 110' ' ' ILE . 17.9 Cg_endo -56.2 152.58 37.51 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.394 2.063 . . . . 20.0 110.948 178.772 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 48.8 t0 -120.21 -61.26 1.61 Allowed 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.798 -0.361 . . . . 20.0 111.468 -179.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.485 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 57.9 ttp180 -127.22 146.12 50.53 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.881 0.372 . . . . 20.0 111.393 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.645 ' CE2' ' CG1' ' A' ' 137' ' ' VAL . 2.9 m-85 -120.89 154.68 35.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.842 -0.617 . . . . 20.0 111.562 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.468 ' HG2' ' NE2' ' A' ' 117' ' ' GLN . 58.9 ttm-85 -92.13 147.44 22.93 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 108.646 -0.872 . . . . 20.0 108.646 178.338 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -82.41 123.0 28.73 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 120.814 -0.355 . . . . 20.0 111.206 -179.132 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.468 ' NE2' ' HG2' ' A' ' 115' ' ' ARG . 82.9 mm-40 -126.4 125.44 42.19 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 116.308 -0.405 . . . . 20.0 110.352 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 67.2 ttp85 -124.34 100.17 6.56 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.248 0.547 . . . . 20.0 110.553 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.553 ' O ' ' CD1' ' A' ' 64' ' ' LEU . 86.2 t -125.1 147.66 29.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.372 -0.831 . . . . 20.0 111.093 -179.481 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.559 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 10.8 pt20 -92.12 133.87 35.37 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.858 -0.423 . . . . 20.0 109.858 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.609 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -78.24 135.16 37.52 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.25 0.547 . . . . 20.0 111.759 -178.82 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.499 ' O ' ' N ' ' A' ' 70' ' ' ARG . 0.3 OUTLIER -82.39 146.84 29.12 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.248 -0.887 . . . . 20.0 110.282 179.801 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . 0.522 ' HB2' ' O ' ' A' ' 126' ' ' GLY . 3.5 m -106.64 104.91 53.09 Favored Pre-proline 0 N--CA 1.45 -0.428 0 CA-C-O 120.975 0.417 . . . . 20.0 110.768 -178.483 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . 0.526 ' CD ' ' HA ' ' A' ' 69' ' ' CYS . 23.4 Cg_exo -60.06 104.41 0.24 Allowed 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.45 2.1 . . . . 20.0 111.913 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 84.69 21.08 56.98 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.645 -0.788 . . . . 20.0 111.955 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . 0.522 ' O ' ' HB2' ' A' ' 123' ' ' CYS . . . -159.07 127.85 1.92 Allowed Glycine 0 N--CA 1.442 -0.915 0 N-CA-C 111.051 -0.82 . . . . 20.0 111.051 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -85.9 46.42 1.32 Allowed 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 111.872 0.323 . . . . 20.0 111.872 -178.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . 0.426 ' O ' ' SG ' ' A' ' 123' ' ' CYS . . . -120.85 63.89 11.54 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 121.117 0.484 . . . . 20.0 110.624 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -57.93 151.01 60.13 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.98 2.453 . . . . 20.0 112.015 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.562 ' O ' ' N ' ' A' ' 121' ' ' LEU . 73.8 mtp85 -124.12 154.75 39.55 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 116.3 -0.409 . . . . 20.0 110.915 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.414 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 47.0 t -106.2 133.12 51.4 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.786 0.327 . . . . 20.0 111.789 -179.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 58.0 ttt85 -147.8 138.3 23.08 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 112.223 0.453 . . . . 20.0 112.223 179.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.463 ' O ' HG21 ' A' ' 134' ' ' VAL . 12.5 pttp -94.45 146.84 23.8 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.08 -0.509 . . . . 20.0 109.706 178.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . 0.543 ' CG2' HD21 ' A' ' 64' ' ' LEU . 4.9 t -147.28 127.84 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.71 0 CA-C-O 121.485 0.659 . . . . 20.0 111.95 -179.206 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.521 ' HB2' ' HB2' ' A' ' 114' ' ' TYR . 31.4 ptt180 -93.13 121.2 34.24 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.87 -1.059 . . . . 20.0 109.966 179.193 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.6 ' N ' ' CD2' ' A' ' 136' ' ' LEU . 0.7 OUTLIER -114.45 126.55 55.09 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.395 0.517 . . . . 20.0 112.395 -178.497 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.645 ' CG1' ' CE2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -53.43 84.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.551 -0.295 . . . . 20.0 111.713 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.493 ' N ' ' O ' ' A' ' 136' ' ' LEU . . . -64.72 -20.32 66.26 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.303 0.573 . . . . 20.0 110.152 179.28 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 36.1 t -160.45 127.97 4.45 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.404 -0.816 . . . . 20.0 110.483 179.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' CYS . . . . . 0.485 ' CB ' ' HA ' ' A' ' 111' ' ' PRO . 27.9 p -134.66 156.22 49.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.833 0.349 . . . . 20.0 110.575 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -129.95 154.94 46.85 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.211 -0.449 . . . . 20.0 110.387 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . 0.59 ' SG ' ' CD1' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -83.84 99.69 10.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.254 0.549 . . . . 20.0 111.148 -179.131 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.557 ' O ' ' HB2' ' A' ' 144' ' ' ARG . 8.4 tptt -137.29 145.8 43.91 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.468 -0.787 . . . . 20.0 109.938 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.557 ' HB2' ' O ' ' A' ' 143' ' ' LYS . 83.9 mtt-85 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.311 -0.852 . . . . 20.0 110.88 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.2 mttt . . . . . 0 N--CA 1.485 1.297 0 CA-C-O 120.801 0.334 . . . . 20.0 110.799 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -85.9 17.51 3.43 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.208 -0.451 . . . . 20.0 111.465 -179.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 43.4 t -70.3 -26.69 29.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.265 -0.425 . . . . 20.0 111.022 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 96.8 p -80.7 -8.99 59.82 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.231 -0.44 . . . . 20.0 110.987 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 62.0 mm-40 -64.58 -31.45 72.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.256 -0.429 . . . . 20.0 111.517 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.604 ' CZ ' ' O ' ' A' ' 140' ' ' CYS . 21.1 p90 -108.96 -11.81 14.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.778 0.323 . . . . 20.0 111.174 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 44.7 m -72.97 150.63 42.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.131 0.491 . . . . 20.0 111.338 -179.017 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.458 ' SG ' ' HA3' ' A' ' 82' ' ' GLY . 0.0 OUTLIER -99.94 -29.23 12.68 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.628 -0.715 . . . . 20.0 109.14 179.03 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.527 ' N ' ' HD2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -155.21 160.21 40.69 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.16 -0.927 . . . . 20.0 110.179 179.76 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -70.62 98.02 1.43 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.602 -0.518 . . . . 20.0 109.602 179.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.57 ' CD1' ' HA ' ' A' ' 78' ' ' LEU . 4.6 pp -109.0 127.1 53.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.428 0.632 . . . . 20.0 112.654 -178.721 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.486 ' CD2' ' O ' ' A' ' 58' ' ' LEU . 1.4 m170 -163.58 100.44 0.92 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.89 -1.05 . . . . 20.0 109.014 178.119 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.566 ' CE1' HG13 ' A' ' 79' ' ' VAL . 5.7 p90 -126.64 157.69 38.31 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.948 0.404 . . . . 20.0 111.711 -177.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.421 HG21 ' O ' ' A' ' 75' ' ' VAL . 3.0 p -105.1 95.11 5.62 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.941 -0.572 . . . . 20.0 111.981 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.447 ' O ' HG21 ' A' ' 75' ' ' VAL . 55.0 ttm-85 -116.98 125.11 50.9 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.263 -1.014 . . . . 20.0 108.263 177.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.511 ' CD2' ' O ' ' A' ' 73' ' ' LYS . 0.0 OUTLIER -116.9 -79.81 0.59 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 113.442 0.904 . . . . 20.0 113.442 -177.13 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.626 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -171.21 141.15 1.57 Allowed 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.443 -0.503 . . . . 20.0 112.293 -177.269 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 30.6 p -134.42 133.59 40.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.483 . . . . 20.0 110.395 178.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.507 ' O ' ' C ' ' A' ' 67' ' ' GLY . 15.0 t0 -148.86 -162.31 1.53 Allowed 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.365 -0.379 . . . . 20.0 110.056 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.841 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -31.2 148.25 0.01 OUTLIER Glycine 0 C--N 1.344 1.015 0 CA-C-O 118.343 -1.254 . . . . 20.0 110.485 179.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.488 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 19.5 Cg_exo -16.51 60.21 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 124.75 3.633 . . . . 20.0 113.993 -178.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.841 ' N ' ' O ' ' A' ' 67' ' ' GLY . 59.9 m -163.14 150.77 13.25 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 114.923 -1.035 . . . . 20.0 109.251 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.4 ' O ' HD13 ' A' ' 122' ' ' LEU . 57.3 ttt180 -145.68 124.55 12.69 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.84 0.352 . . . . 20.0 110.672 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.626 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -74.71 156.59 36.47 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 116.109 -0.496 . . . . 20.0 110.324 179.669 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.467 ' N ' HD11 ' A' ' 122' ' ' LEU . . . -150.45 31.94 0.65 Allowed 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 113.305 0.854 . . . . 20.0 113.305 -179.47 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.511 ' O ' ' CD2' ' A' ' 63' ' ' PHE . 6.8 ttmt -75.24 144.97 79.46 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.985 -0.376 . . . . 20.0 109.985 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.449 ' HD2' ' CG ' ' A' ' 73' ' ' LYS . 50.2 Cg_exo -53.11 113.1 1.12 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.169 1.913 . . . . 20.0 112.002 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.447 HG21 ' O ' ' A' ' 62' ' ' ARG . 24.1 m -132.13 149.4 32.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.971 -0.559 . . . . 20.0 111.567 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 6.1 m -115.01 118.13 32.55 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.568 -0.53 . . . . 20.0 109.568 178.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.482 ' OE1' ' CB ' ' A' ' 136' ' ' LEU . 44.1 mm-40 -125.04 151.12 46.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.521 -0.308 . . . . 20.0 110.769 -179.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.57 ' HA ' ' CD1' ' A' ' 58' ' ' LEU . 6.0 mp -119.34 125.55 49.3 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 113.054 0.761 . . . . 20.0 113.054 -179.014 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.566 HG13 ' CE1' ' A' ' 60' ' ' TYR . 2.5 m -109.8 76.61 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-N 114.473 -1.24 . . . . 20.0 109.698 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.427 ' N ' HD22 ' A' ' 58' ' ' LEU . 1.0 OUTLIER -86.52 109.22 18.95 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.96 -0.564 . . . . 20.0 111.923 -178.794 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 30.1 t -148.32 103.62 3.45 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.799 -0.637 . . . . 20.0 110.507 179.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.483 ' O ' ' HB2' ' A' ' 108' ' ' ARG . . . -165.69 -160.87 13.56 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.516 -0.85 . . . . 20.0 112.838 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.505 ' HA ' ' HA ' ' A' ' 108' ' ' ARG . 94.9 mt-30 -114.92 140.34 49.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.693 0.282 . . . . 20.0 110.339 179.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.421 ' HB3' ' HD3' ' A' ' 86' ' ' PRO . 0.9 OUTLIER -109.14 152.61 24.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.393 -0.367 . . . . 20.0 110.455 179.703 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -129.79 61.2 0.66 Allowed Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.302 -0.951 . . . . 20.0 112.998 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . 0.421 ' HD3' ' HB3' ' A' ' 84' ' ' CYS . 21.6 Cg_endo -61.44 149.2 90.63 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.801 2.334 . . . . 20.0 111.988 179.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.448 ' C ' HD21 ' A' ' 89' ' ' LEU . . . -82.0 -3.11 53.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.27 -0.423 . . . . 20.0 111.607 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 54.0 mmm-85 -95.95 86.78 4.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.905 0.383 . . . . 20.0 110.359 179.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.535 ' CB ' ' O ' ' A' ' 102' ' ' PRO . 0.5 OUTLIER -96.87 124.48 40.86 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.014 -0.539 . . . . 20.0 110.407 -179.804 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 3.9 tp -110.96 112.0 55.95 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.269 -0.423 . . . . 20.0 111.705 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.608 ' HG2' ' CD1' ' A' ' 100' ' ' TRP . 3.0 Cg_exo -71.56 124.03 9.96 Favored 'Trans proline' 0 N--CA 1.464 -0.262 0 C-N-CA 122.963 2.442 . . . . 20.0 111.038 178.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.478 ' O ' HD12 ' A' ' 94' ' ' ILE . 83.7 m-20 -103.25 142.06 34.82 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.912 0.386 . . . . 20.0 111.416 -179.846 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.543 ' O ' ' N ' ' A' ' 95' ' ' GLY . . . -83.71 -10.42 58.16 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.552 0.575 . . . . 20.0 112.552 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.478 HD12 ' O ' ' A' ' 92' ' ' ASN . 1.0 OUTLIER 31.8 34.15 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.436 0.636 . . . . 20.0 111.513 179.583 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . 0.543 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 116.23 -52.76 0.65 Allowed Glycine 0 CA--C 1.521 0.424 0 CA-C-N 114.921 -1.036 . . . . 20.0 112.499 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.558 ' O ' ' CZ2' ' A' ' 99' ' ' TRP . 83.6 mtt85 -108.97 169.53 8.62 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.12 -0.326 . . . . 20.0 110.12 179.225 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.866 ' O ' ' CD1' ' A' ' 99' ' ' TRP . 2.3 t -126.46 -134.28 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.199 -1.575 0 N-CA-C 112.818 0.673 . . . . 20.0 112.818 -179.616 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.62 ' CG ' ' O ' ' A' ' 97' ' ' VAL . 0.1 OUTLIER 54.71 -55.45 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 112.84 0.681 . . . . 20.0 112.84 -178.688 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.866 ' CD1' ' O ' ' A' ' 97' ' ' VAL . 24.9 p-90 -75.44 45.69 0.31 Allowed 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 122.812 0.445 . . . . 20.0 110.6 179.014 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' TRP . . . . . 0.701 ' HA ' ' CE3' ' A' ' 100' ' ' TRP . 0.0 OUTLIER -48.53 136.75 12.58 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-O 121.887 0.851 . . . . 20.0 112.943 -177.855 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.455 ' O ' ' HA ' ' A' ' 91' ' ' PRO . 0.0 OUTLIER -113.63 84.06 7.77 Favored Pre-proline 0 N--CA 1.438 -1.064 0 CA-C-N 113.96 -1.473 . . . . 20.0 110.948 -179.653 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.535 ' O ' ' CB ' ' A' ' 89' ' ' LEU . 44.7 Cg_endo -67.98 -1.93 7.85 Favored 'Trans proline' 0 C--N 1.34 0.125 0 C-N-CA 123.28 2.653 . . . . 20.0 112.326 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -59.18 -28.8 66.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.888 0.375 . . . . 20.0 110.727 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 84.19 159.45 29.48 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.701 -0.761 . . . . 20.0 112.677 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -67.78 160.23 49.23 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.937 2.424 . . . . 20.0 112.12 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -67.34 137.42 56.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.229 -0.442 . . . . 20.0 110.81 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . 0.4 ' CE2' ' HG2' ' A' ' 86' ' ' PRO . 97.4 m-85 -120.54 160.82 22.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.127 -0.488 . . . . 20.0 110.942 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.505 ' HA ' ' HA ' ' A' ' 83' ' ' GLN . 39.7 ptt180 -172.56 161.18 4.91 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.013 0.435 . . . . 20.0 111.605 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 142' ' ' CYS . 3.9 m -77.97 120.59 23.03 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.727 -0.669 . . . . 20.0 110.048 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 2.9 tt -137.46 126.57 15.03 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.063 0.459 . . . . 20.0 111.571 -179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.557 ' HB3' ' CG1' ' A' ' 137' ' ' VAL . 51.6 Cg_exo -54.29 157.11 12.04 Favored 'Trans proline' 0 C--O 1.231 0.139 0 C-N-CA 123.079 2.519 . . . . 20.0 111.967 179.624 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -131.02 -63.66 0.85 Allowed 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 112.69 0.626 . . . . 20.0 112.69 -179.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.482 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 39.2 ttm180 -119.31 151.0 39.18 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.732 0.301 . . . . 20.0 111.72 -178.865 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.502 ' HA ' ' HA ' ' A' ' 137' ' ' VAL . 4.4 m-85 -122.71 141.99 51.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.942 -0.572 . . . . 20.0 111.539 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.51 ' NE ' ' HB1' ' A' ' 138' ' ' ALA . 30.7 ttp180 -93.15 143.85 25.85 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 115.757 -0.656 . . . . 20.0 109.402 178.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -76.13 132.88 40.29 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.012 0.434 . . . . 20.0 111.198 -178.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.434 ' N ' ' O ' ' A' ' 134' ' ' VAL . 95.1 mm-40 -125.31 137.39 54.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.829 -0.623 . . . . 20.0 110.723 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.425 ' C ' HG23 ' A' ' 119' ' ' VAL . 70.6 ttt-85 -130.2 106.9 8.9 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.11 -0.495 . . . . 20.0 110.863 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.535 ' O ' ' CD1' ' A' ' 64' ' ' LEU . 21.5 t -135.03 152.16 32.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.062 -0.517 . . . . 20.0 111.358 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.533 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 11.1 pt20 -92.24 130.27 37.98 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.512 -0.313 . . . . 20.0 110.406 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.607 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.2 OUTLIER -77.0 126.61 31.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.005 0.431 . . . . 20.0 110.8 -179.982 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.467 HD11 ' N ' ' A' ' 72' ' ' ALA . 0.3 OUTLIER -90.64 134.83 34.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.93 -0.577 . . . . 20.0 111.419 -179.388 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . 0.458 ' HB3' ' HD2' ' A' ' 124' ' ' PRO . 0.0 OUTLIER -109.87 166.0 11.6 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-N 115.849 -0.614 . . . . 20.0 109.981 179.367 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . 0.458 ' HD2' ' HB3' ' A' ' 123' ' ' CYS . 11.8 Cg_endo -56.3 109.45 0.44 Allowed 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 122.012 1.808 . . . . 20.0 111.674 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 96.95 -9.73 65.83 Favored Glycine 0 CA--C 1.517 0.21 0 C-N-CA 120.914 -0.66 . . . . 20.0 112.512 -179.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 57.23 56.93 22.41 Favored Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.733 -0.746 . . . . 20.0 112.235 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -92.69 -62.47 1.39 Allowed 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 111.896 0.332 . . . . 20.0 111.896 -179.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -116.61 62.48 2.62 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 112.232 0.456 . . . . 20.0 112.232 -179.02 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -49.91 146.7 16.01 Favored 'Trans proline' 0 N--CA 1.463 -0.295 0 C-N-CA 122.511 2.14 . . . . 20.0 110.898 178.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.533 ' O ' ' HA ' ' A' ' 120' ' ' GLN . 14.6 mtp-105 -127.84 154.3 45.62 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 121.01 -0.276 . . . . 20.0 111.467 -179.056 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 99.7 p -105.18 139.85 39.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.326 -0.397 . . . . 20.0 111.303 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 53.9 ttt85 -145.51 138.9 26.41 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.085 0.469 . . . . 20.0 112.045 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.452 ' O ' HG21 ' A' ' 134' ' ' VAL . 0.5 OUTLIER -91.38 141.93 28.23 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.696 -0.684 . . . . 20.0 109.404 178.459 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . 0.456 HG23 HD21 ' A' ' 64' ' ' LEU . 2.8 t -145.47 125.72 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 CA-C-O 121.318 0.58 . . . . 20.0 111.812 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.432 ' O ' ' HG3' ' A' ' 135' ' ' ARG . 49.5 ptt85 -99.21 113.82 26.29 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.155 -0.929 . . . . 20.0 110.175 179.015 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.482 ' CB ' ' OE1' ' A' ' 77' ' ' GLU . 32.5 mt -127.61 148.99 50.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.067 0.46 . . . . 20.0 111.311 -179.801 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.557 ' CG1' ' HB3' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -57.55 92.75 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.728 -0.669 . . . . 20.0 112.397 -179.451 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.51 ' HB1' ' NE ' ' A' ' 115' ' ' ARG . . . -73.94 -13.06 60.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.142 0.496 . . . . 20.0 109.825 178.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 96.3 p -167.92 137.84 2.65 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.697 -0.683 . . . . 20.0 110.089 179.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' CYS . . . . . 0.604 ' O ' ' CZ ' ' A' ' 53' ' ' TYR . 24.4 p -144.18 166.42 25.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.834 0.349 . . . . 20.0 111.214 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 30.7 mttt -129.69 137.2 50.48 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.042 -0.526 . . . . 20.0 109.675 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . 0.506 ' HA ' ' HA ' ' A' ' 109' ' ' CYS . 9.0 t -80.65 94.86 6.41 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.839 0.352 . . . . 20.0 110.233 -179.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.521 ' O ' ' HB2' ' A' ' 144' ' ' ARG . 34.4 tptt -136.48 155.66 49.68 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.988 -0.551 . . . . 20.0 110.656 -179.374 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.521 ' HB2' ' O ' ' A' ' 143' ' ' LYS . 76.6 mtt-85 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.286 -0.864 . . . . 20.0 110.908 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 83.4 mttt . . . . . 0 N--CA 1.483 1.193 0 CA-C-O 121.149 0.499 . . . . 20.0 111.125 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.422 ' HB3' ' HG3' ' A' ' 52' ' ' GLU . 94.1 m-20 -86.6 20.38 2.52 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.636 -0.711 . . . . 20.0 111.587 -179.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 79.0 t -63.64 -29.95 48.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 CA-C-N 116.377 -0.374 . . . . 20.0 111.448 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 82.6 p -83.33 4.03 29.04 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.422 -0.354 . . . . 20.0 111.36 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.422 ' HG3' ' HB3' ' A' ' 49' ' ' ASP . 77.3 mm-40 -75.56 -1.73 25.76 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.029 0.381 . . . . 20.0 112.029 -179.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 -89.06 9.05 26.75 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.94 0.348 . . . . 20.0 111.94 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.8 m -74.77 119.79 19.44 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 110.055 -0.35 . . . . 20.0 110.055 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.5 ' HB2' ' HD2' ' A' ' 56' ' ' ARG . 2.0 m -67.89 -33.62 75.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.227 -0.442 . . . . 20.0 110.075 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.561 ' O ' ' N ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -162.68 171.57 16.65 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.717 -0.674 . . . . 20.0 110.083 179.738 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -53.76 82.59 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.102 0.477 . . . . 20.0 109.759 179.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.588 ' O ' ' CD2' ' A' ' 59' ' ' HIS . 0.1 OUTLIER -115.51 124.94 52.35 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.565 -0.743 . . . . 20.0 112.361 -178.061 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.588 ' CD2' ' O ' ' A' ' 58' ' ' LEU . 4.2 m170 -164.02 115.83 1.36 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.879 -0.601 . . . . 20.0 110.991 178.108 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.529 ' CE1' HG23 ' A' ' 79' ' ' VAL . 79.5 m-85 -119.83 159.32 24.82 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 112.432 0.53 . . . . 20.0 112.432 -178.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 42.5 p -123.62 83.85 2.19 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-N 115.705 -0.679 . . . . 20.0 110.442 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 63.9 mtm180 -118.55 123.84 46.05 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 107.857 -1.164 . . . . 20.0 107.857 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.544 ' CD2' ' O ' ' A' ' 73' ' ' LYS . 0.0 OUTLIER -108.07 -78.71 0.58 Allowed 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.609 0.596 . . . . 20.0 112.609 -177.189 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.548 ' CD1' ' HB3' ' A' ' 71' ' ' SER . 0.0 OUTLIER -169.09 138.43 2.12 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.539 -0.464 . . . . 20.0 112.133 -178.246 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 40.6 p -129.26 143.57 50.9 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.514 -0.55 . . . . 20.0 109.514 177.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.552 ' O ' ' C ' ' A' ' 67' ' ' GLY . 5.9 t0 -153.0 -162.69 1.54 Allowed 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.94 -0.393 . . . . 20.0 109.94 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.872 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -29.05 141.64 0.01 OUTLIER Glycine 0 C--N 1.345 1.039 0 CA-C-O 118.424 -1.209 . . . . 20.0 110.301 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.513 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 56.2 Cg_exo -15.77 55.02 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 125.287 3.991 . . . . 20.0 114.514 -178.414 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.872 ' N ' ' O ' ' A' ' 67' ' ' GLY . 19.6 m -162.81 167.34 23.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.005 -0.998 . . . . 20.0 108.537 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 65.0 ttt180 -161.35 143.86 12.2 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.965 -0.294 . . . . 20.0 111.523 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.621 ' CA ' ' HA ' ' A' ' 121' ' ' LEU . 0.9 OUTLIER -83.86 171.17 13.34 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 116.442 -0.345 . . . . 20.0 110.253 178.996 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -152.29 25.54 0.61 Allowed 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 113.44 0.904 . . . . 20.0 113.44 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.544 ' O ' ' CD2' ' A' ' 63' ' ' PHE . 0.2 OUTLIER -68.49 144.19 96.13 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 109.165 -0.679 . . . . 20.0 109.165 178.901 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.92 114.64 1.99 Allowed 'Trans proline' 0 CA--C 1.527 0.17 0 C-N-CA 122.411 2.074 . . . . 20.0 112.329 -179.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.511 HG13 ' O ' ' A' ' 73' ' ' LYS . 16.1 m -130.85 155.36 41.84 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.167 0 CA-C-O 120.955 0.407 . . . . 20.0 111.518 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 70.4 m -116.36 123.93 48.82 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.99 -0.55 . . . . 20.0 110.601 179.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.476 ' OE1' ' HB3' ' A' ' 136' ' ' LEU . 52.6 tp10 -121.73 127.51 50.77 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.193 -0.458 . . . . 20.0 110.4 179.255 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.533 ' CD1' ' N ' ' A' ' 78' ' ' LEU . 1.7 mp -112.91 122.89 48.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.413 0.625 . . . . 20.0 111.551 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.638 ' CG2' ' O ' ' A' ' 79' ' ' VAL . 1.5 m -108.89 76.81 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 122.065 0.936 . . . . 20.0 108.891 178.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.477 ' O ' ' O ' ' A' ' 109' ' ' CYS . 1.3 p -83.48 112.73 20.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.153 -0.93 . . . . 20.0 111.518 -178.137 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.428 ' HA ' ' O ' ' A' ' 109' ' ' CYS . 65.6 p -146.21 96.85 2.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.764 -0.653 . . . . 20.0 110.479 179.294 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.521 ' CA ' ' SG ' ' A' ' 109' ' ' CYS . . . -158.85 -157.35 8.46 Favored Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 115.752 -0.658 . . . . 20.0 112.171 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.456 ' HA ' ' HA ' ' A' ' 108' ' ' ARG . 91.9 mt-30 -116.15 148.19 40.59 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.59 0.233 . . . . 20.0 110.459 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -128.96 157.88 40.4 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.766 0.317 . . . . 20.0 111.161 -179.772 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -128.99 68.01 0.55 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.654 -0.784 . . . . 20.0 112.679 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . 0.498 ' CG ' ' CD2' ' A' ' 107' ' ' PHE . 25.4 Cg_endo -60.25 148.49 89.73 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.925 2.416 . . . . 20.0 112.356 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.476 ' O ' HD11 ' A' ' 89' ' ' LEU . . . -72.46 -1.93 17.64 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.404 -0.362 . . . . 20.0 111.41 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . 0.413 ' C ' HD11 ' A' ' 89' ' ' LEU . 20.1 tpt180 -73.33 120.88 19.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.882 0.372 . . . . 20.0 110.316 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.476 HD11 ' O ' ' A' ' 87' ' ' ALA . 0.1 OUTLIER -101.99 111.46 23.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.144 -0.48 . . . . 20.0 111.312 -179.414 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -123.85 88.6 52.15 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.013 0.435 . . . . 20.0 110.983 179.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.617 ' HB2' ' CD2' ' A' ' 100' ' ' TRP . 61.0 Cg_endo -71.32 96.87 0.74 Allowed 'Trans proline' 0 CA--C 1.53 0.301 0 C-N-CA 122.708 2.272 . . . . 20.0 111.439 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 33.2 p-10 -147.31 44.16 1.13 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.049 0.452 . . . . 20.0 111.096 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.564 ' HB1' ' CH2' ' A' ' 99' ' ' TRP . . . -60.56 -55.76 29.55 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.895 -0.593 . . . . 20.0 112.481 -179.177 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -122.04 -28.02 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 N-CA-C 112.403 0.52 . . . . 20.0 112.403 -179.054 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 124.67 -43.67 1.36 Allowed Glycine 0 C--N 1.328 0.086 0 C-N-CA 120.696 -0.764 . . . . 20.0 111.796 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.518 ' O ' ' NE1' ' A' ' 99' ' ' TRP . 90.8 mtt180 -66.79 148.63 51.67 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 108.94 -0.763 . . . . 20.0 108.94 178.224 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.593 HG13 ' CE2' ' A' ' 100' ' ' TRP . 1.9 t -122.42 132.41 71.19 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.074 0 CA-C-O 122.279 1.038 . . . . 20.0 112.501 -179.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.433 ' HG2' ' C ' ' A' ' 97' ' ' VAL . 0.8 OUTLIER 165.66 -36.57 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 113.159 -1.837 . . . . 20.0 107.136 -179.306 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.564 ' CH2' ' HB1' ' A' ' 93' ' ' ALA . 60.6 p-90 -98.19 8.45 44.78 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 112.668 -2.06 . . . . 20.0 110.129 178.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' TRP . . . . . 0.709 ' HA ' ' CE3' ' A' ' 100' ' ' TRP . 0.0 OUTLIER -22.97 137.77 0.01 OUTLIER 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 114.753 1.39 . . . . 20.0 114.753 -176.392 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.423 ' HD2' ' CE3' ' A' ' 99' ' ' TRP . 5.6 mtt85 -130.23 86.95 52.45 Favored Pre-proline 0 N--CA 1.444 -0.765 0 CA-C-N 113.354 -1.748 . . . . 20.0 111.552 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -64.57 -0.75 3.26 Favored 'Trans proline' 0 CA--C 1.53 0.293 0 C-N-CA 123.581 2.854 . . . . 20.0 113.681 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 58.3 t-20 -56.35 -32.5 64.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.027 0.442 . . . . 20.0 110.375 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 85.27 161.44 34.35 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.827 -0.702 . . . . 20.0 112.472 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -66.39 167.5 18.52 Favored 'Trans proline' 0 N--CA 1.464 -0.263 0 C-N-CA 122.739 2.293 . . . . 20.0 112.209 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 57.7 t0 -75.09 123.12 24.64 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.985 -0.552 . . . . 20.0 110.262 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . 0.498 ' CD2' ' CG ' ' A' ' 86' ' ' PRO . 96.4 m-85 -107.68 136.29 47.68 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.854 0.359 . . . . 20.0 111.355 -179.122 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.456 ' HA ' ' HA ' ' A' ' 83' ' ' GLN . 78.8 mtp180 -119.03 150.29 40.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.041 -0.527 . . . . 20.0 110.606 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.669 ' HA ' ' HA ' ' A' ' 142' ' ' CYS . 0.9 OUTLIER -90.67 103.27 15.98 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 120.319 -0.552 . . . . 20.0 110.893 179.231 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.471 ' HA ' ' O ' ' A' ' 80' ' ' CYS . 0.9 OUTLIER -126.07 155.74 72.99 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.809 -0.632 . . . . 20.0 110.633 179.419 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.563 ' HA ' ' CB ' ' A' ' 140' ' ' CYS . 19.0 Cg_endo -59.89 147.17 93.67 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.913 2.409 . . . . 20.0 112.438 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -130.75 -46.36 1.05 Allowed 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 111.957 0.354 . . . . 20.0 111.957 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.541 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 40.9 ttm180 -124.61 151.8 44.37 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.968 0.358 . . . . 20.0 111.968 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.621 ' CD2' ' N ' ' A' ' 137' ' ' VAL . 0.9 OUTLIER -130.11 152.92 49.03 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.609 -0.723 . . . . 20.0 111.724 -179.693 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.571 ' O ' ' HA ' ' A' ' 135' ' ' ARG . 18.3 ttm-85 -93.98 137.61 33.0 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 115.868 -0.605 . . . . 20.0 109.7 178.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -82.1 120.86 25.84 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.756 0.312 . . . . 20.0 110.847 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.491 ' CG ' ' O ' ' A' ' 134' ' ' VAL . 9.2 pt20 -133.55 139.55 46.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.98 0.419 . . . . 20.0 111.269 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 71.7 mtp85 -123.14 108.81 13.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.926 -0.579 . . . . 20.0 110.841 179.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.531 ' O ' ' CD1' ' A' ' 64' ' ' LEU . 74.8 t -120.36 145.06 27.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.786 -0.643 . . . . 20.0 110.773 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.527 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 26.9 mp0 -88.0 127.82 35.39 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.208 -0.451 . . . . 20.0 110.445 -179.748 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.621 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.2 OUTLIER -76.68 126.99 31.94 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.393 0.616 . . . . 20.0 111.589 -178.61 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.489 ' CD1' ' HA ' ' A' ' 71' ' ' SER . 3.1 mp -89.38 141.99 28.06 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.083 -0.962 . . . . 20.0 111.713 -179.149 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . 0.513 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.2 OUTLIER -118.06 153.81 51.37 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 115.563 -0.744 . . . . 20.0 109.248 178.271 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . 0.465 ' HD2' ' SG ' ' A' ' 123' ' ' CYS . 88.9 Cg_exo -47.75 112.31 0.54 Allowed 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.046 1.831 . . . . 20.0 111.928 -179.442 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . 0.429 ' O ' ' C ' ' A' ' 126' ' ' GLY . . . 91.85 6.31 65.54 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.552 -0.833 . . . . 20.0 112.268 -179.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . 0.429 ' C ' ' O ' ' A' ' 125' ' ' GLY . . . 34.23 73.13 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 121.041 -0.6 . . . . 20.0 112.858 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -111.2 -51.73 2.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.559 0.219 . . . . 20.0 111.567 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -121.52 60.77 10.88 Favored Pre-proline 0 C--N 1.332 -0.18 0 CA-C-O 120.944 0.402 . . . . 20.0 111.895 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -48.57 152.6 3.98 Favored 'Trans proline' 0 CA--C 1.528 0.213 0 C-N-CA 123.48 2.787 . . . . 20.0 112.483 179.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.527 ' O ' ' HA ' ' A' ' 120' ' ' GLN . 80.5 mtt-85 -125.43 158.58 34.03 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.352 -0.385 . . . . 20.0 111.088 -179.249 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 9.7 t -114.66 136.67 52.79 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.511 -0.313 . . . . 20.0 110.742 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . 0.406 ' HD3' ' CB ' ' A' ' 64' ' ' LEU . 52.9 ttt85 -148.74 136.05 20.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.848 0.356 . . . . 20.0 111.793 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.401 ' O ' HG23 ' A' ' 134' ' ' VAL . 25.1 pttm -96.45 140.53 30.96 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.69 -0.485 . . . . 20.0 109.69 178.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . 0.537 HG11 HD22 ' A' ' 136' ' ' LEU . 7.8 t -145.44 125.96 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 CA-C-O 121.198 0.523 . . . . 20.0 111.779 -178.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.571 ' HA ' ' O ' ' A' ' 115' ' ' ARG . 39.1 ttt180 -99.03 111.9 24.17 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.561 -0.745 . . . . 20.0 109.43 178.325 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.537 HD22 HG11 ' A' ' 134' ' ' VAL . 22.0 mt -113.31 140.04 48.34 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.749 0.648 . . . . 20.0 112.749 -178.426 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.621 ' N ' ' CD2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -58.93 84.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 CA-C-N 116.219 -0.446 . . . . 20.0 111.455 179.43 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -74.14 -12.06 60.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.94 0.4 . . . . 20.0 110.43 179.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.5 t -164.98 124.86 1.88 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.89 -0.595 . . . . 20.0 110.358 179.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' CYS . . . . . 0.563 ' CB ' ' HA ' ' A' ' 111' ' ' PRO . 23.1 p -125.46 159.41 32.01 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 121.103 0.477 . . . . 20.0 112.023 -179.404 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 22.2 mttm -115.58 145.82 42.32 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 115.705 -0.68 . . . . 20.0 109.391 178.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . 0.669 ' HA ' ' HA ' ' A' ' 109' ' ' CYS . 18.4 p -86.57 99.78 11.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.056 0.455 . . . . 20.0 110.773 -179.549 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.549 ' O ' ' HB2' ' A' ' 144' ' ' ARG . 7.8 tptt -146.0 146.75 31.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.856 -0.611 . . . . 20.0 111.043 -179.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.549 ' HB2' ' O ' ' A' ' 143' ' ' LYS . 49.7 mtp85 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.319 -0.848 . . . . 20.0 110.83 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 54.7 mttp . . . . . 0 N--CA 1.489 1.493 0 CA-C-O 121.015 0.436 . . . . 20.0 111.374 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -82.23 14.5 2.88 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.789 -0.641 . . . . 20.0 111.691 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.422 ' O ' HG11 ' A' ' 50' ' ' VAL . 61.8 t -66.16 -34.57 71.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 112.149 0.425 . . . . 20.0 112.149 -179.503 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 53.5 m -82.19 0.23 41.99 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.916 0.339 . . . . 20.0 111.916 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 90.7 mt-10 -67.22 -37.39 83.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.789 0.328 . . . . 20.0 111.045 179.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.556 ' CD1' ' SG ' ' A' ' 142' ' ' CYS . 0.0 OUTLIER -101.66 -72.39 0.68 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.588 -0.523 . . . . 20.0 109.588 178.983 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.526 ' HB2' ' HA3' ' A' ' 82' ' ' GLY . 0.5 OUTLIER -145.24 -159.84 1.06 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.927 -0.579 . . . . 20.0 109.974 178.664 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.458 ' SG ' ' C ' ' A' ' 54' ' ' SER . 0.0 OUTLIER 50.62 54.05 11.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.167 0.508 . . . . 20.0 109.844 -179.941 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.94 -152.85 0.48 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.329 -0.851 . . . . 20.0 110.862 -179.567 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -72.6 58.67 0.43 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.937 0.399 . . . . 20.0 111.09 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.537 HD13 ' HB3' ' A' ' 78' ' ' LEU . 0.3 OUTLIER -96.8 135.82 38.21 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.94 -0.573 . . . . 20.0 111.469 -179.642 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.503 ' CD2' ' O ' ' A' ' 58' ' ' LEU . 5.9 m170 -150.56 131.05 13.84 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.807 -0.633 . . . . 20.0 110.576 178.35 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.578 ' CD1' HG11 ' A' ' 79' ' ' VAL . 0.5 OUTLIER -143.5 163.07 34.17 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.212 -0.449 . . . . 20.0 110.362 -179.858 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 30.1 p -106.99 93.32 4.49 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 112.862 0.69 . . . . 20.0 112.862 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.49 ' O ' ' CG2' ' A' ' 75' ' ' VAL . 23.1 mtt-85 -127.26 127.71 44.83 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 108.043 -1.095 . . . . 20.0 108.043 176.678 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.517 ' CD2' ' O ' ' A' ' 73' ' ' LYS . 0.0 OUTLIER -118.47 -79.51 0.6 Allowed 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 113.053 0.76 . . . . 20.0 113.053 -177.0 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.619 ' CD2' ' CG2' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -166.43 136.96 3.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.014 0.435 . . . . 20.0 111.984 -178.314 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.488 HG23 ' HD3' ' A' ' 70' ' ' ARG . 59.9 p -129.88 140.01 51.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.719 -0.673 . . . . 20.0 110.356 178.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.535 ' O ' ' C ' ' A' ' 67' ' ' GLY . 11.7 t0 -147.86 -164.32 1.98 Allowed 'General case' 0 C--O 1.236 0.353 0 N-CA-C 109.968 -0.382 . . . . 20.0 109.968 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.866 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -30.67 146.04 0.01 OUTLIER Glycine 0 C--N 1.343 0.963 0 N-CA-C 110.2 -1.16 . . . . 20.0 110.2 179.48 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.493 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 59.4 Cg_exo -16.43 55.19 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 125.256 3.971 . . . . 20.0 115.037 -178.365 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.866 ' N ' ' O ' ' A' ' 67' ' ' GLY . 33.4 m -163.89 163.8 23.59 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.476 -0.935 . . . . 20.0 108.476 178.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.488 ' HD3' HG23 ' A' ' 65' ' ' THR . 82.1 mtt85 -157.71 148.02 20.68 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.342 0.591 . . . . 20.0 112.357 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.618 ' CA ' ' HA ' ' A' ' 121' ' ' LEU . 0.0 OUTLIER -88.26 164.06 15.79 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 115.302 -0.863 . . . . 20.0 109.952 178.568 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -149.73 26.77 0.82 Allowed 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 119.957 -0.697 . . . . 20.0 112.734 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.517 ' O ' ' CD2' ' A' ' 63' ' ' PHE . 1.3 mptp? -73.58 145.7 85.1 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-O 120.888 0.375 . . . . 20.0 110.277 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -49.84 123.03 9.98 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.797 2.331 . . . . 20.0 112.79 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.515 HG22 ' CD2' ' A' ' 63' ' ' PHE . 23.9 m -137.73 145.53 28.9 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.162 0 CA-C-N 116.053 -0.521 . . . . 20.0 111.503 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 21.3 m -123.18 115.27 21.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.915 -0.584 . . . . 20.0 109.625 178.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.512 ' HB2' ' CZ ' ' A' ' 60' ' ' TYR . 48.1 mt-10 -130.26 163.43 26.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.629 0.252 . . . . 20.0 110.818 -179.527 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.537 ' HB3' HD13 ' A' ' 58' ' ' LEU . 6.0 mp -118.11 136.69 53.43 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 121.139 0.495 . . . . 20.0 111.578 179.098 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.578 HG11 ' CD1' ' A' ' 60' ' ' TYR . 19.7 m -102.94 81.88 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.677 -0.692 . . . . 20.0 110.287 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.521 ' CB ' ' SG ' ' A' ' 109' ' ' CYS . 0.0 OUTLIER -93.44 108.5 20.17 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.735 -0.666 . . . . 20.0 112.006 -178.974 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.5 m -152.28 99.77 2.54 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.824 -0.625 . . . . 20.0 110.282 179.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.526 ' HA3' ' HB2' ' A' ' 54' ' ' SER . . . -154.97 -151.33 5.81 Favored Glycine 0 C--N 1.331 0.261 0 C-N-CA 120.359 -0.924 . . . . 20.0 112.736 -179.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.508 ' HA ' ' HA ' ' A' ' 108' ' ' ARG . 91.5 mt-30 -124.69 140.61 52.78 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-O 120.858 0.361 . . . . 20.0 110.135 179.693 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.438 ' SG ' ' C ' ' A' ' 142' ' ' CYS . 89.7 m -111.26 151.24 28.53 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.854 0.359 . . . . 20.0 110.638 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -127.85 64.0 0.6 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.594 -0.812 . . . . 20.0 112.166 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . 0.532 ' HD2' ' CD2' ' A' ' 107' ' ' PHE . 24.3 Cg_exo -62.31 143.04 93.34 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 122.145 1.897 . . . . 20.0 111.271 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.425 ' O ' HD23 ' A' ' 89' ' ' LEU . . . -73.69 3.62 6.17 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.799 -0.637 . . . . 20.0 111.221 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -90.95 93.39 9.18 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 120.866 0.365 . . . . 20.0 110.697 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.425 HD23 ' O ' ' A' ' 87' ' ' ALA . 0.7 OUTLIER -100.21 133.16 45.02 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.861 -0.609 . . . . 20.0 110.621 179.934 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.528 ' O ' ' CD1' ' A' ' 100' ' ' TRP . 1.8 mm? -111.24 91.82 14.4 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 120.851 0.358 . . . . 20.0 111.054 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.598 ' HA ' ' CZ2' ' A' ' 100' ' ' TRP . 52.6 Cg_endo -70.16 88.57 0.58 Allowed 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.776 2.317 . . . . 20.0 111.573 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.481 ' O ' ' CH2' ' A' ' 99' ' ' TRP . 80.8 m-20 -139.83 65.92 1.41 Allowed 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 112.27 0.471 . . . . 20.0 112.27 -179.092 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.581 ' N ' ' CH2' ' A' ' 100' ' ' TRP . . . -57.2 -18.9 17.76 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.386 0.143 . . . . 20.0 111.386 179.666 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.459 ' C ' ' O ' ' A' ' 93' ' ' ALA . 3.5 mt 30.35 34.6 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 CA-C-O 121.143 0.497 . . . . 20.0 111.419 179.154 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . 0.556 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 90.17 -42.5 2.94 Favored Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.722 -0.672 . . . . 20.0 111.844 -179.34 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.485 ' N ' ' O ' ' A' ' 93' ' ' ALA . 41.7 ttm180 -106.27 128.86 54.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.857 0.36 . . . . 20.0 110.923 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.612 ' CG1' ' HD3' ' A' ' 101' ' ' ARG . 25.1 t -130.24 136.65 58.18 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.855 0 CA-C-O 121.467 0.651 . . . . 20.0 110.357 179.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt 176.17 -32.33 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.986 -1.006 . . . . 20.0 110.005 -179.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.568 ' CE3' ' HB3' ' A' ' 100' ' ' TRP . 0.1 OUTLIER -77.37 -79.75 0.11 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.742 -1.117 . . . . 20.0 110.713 -179.848 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' TRP . . . . . 0.635 ' CZ2' ' NE ' ' A' ' 101' ' ' ARG . 0.0 OUTLIER -89.59 177.69 6.48 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 120.92 0.391 . . . . 20.0 110.598 179.319 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.635 ' NE ' ' CZ2' ' A' ' 100' ' ' TRP . 0.0 OUTLIER 154.46 158.8 0.0 OUTLIER Pre-proline 0 CA--C 1.519 -0.228 0 CA-C-N 115.383 -0.826 . . . . 20.0 111.339 178.048 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.429 ' HD2' ' NE ' ' A' ' 101' ' ' ARG . 3.7 Cg_exo -40.76 -23.31 0.14 Allowed 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 123.501 2.801 . . . . 20.0 112.311 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . 0.405 ' N ' ' O ' ' A' ' 101' ' ' ARG . 24.8 p-10 -77.4 2.53 15.72 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.851 0.358 . . . . 20.0 110.583 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.461 ' N ' ' O ' ' A' ' 101' ' ' ARG . . . 91.94 138.67 8.3 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.974 -0.631 . . . . 20.0 112.976 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.58 ' HB2' ' CE2' ' A' ' 107' ' ' PHE . 12.0 Cg_exo -72.12 161.88 43.38 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 123.036 2.491 . . . . 20.0 111.518 179.4 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -74.36 98.61 3.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.766 0.317 . . . . 20.0 110.911 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . 0.58 ' CE2' ' HB2' ' A' ' 105' ' ' PRO . 32.9 m-85 -123.55 162.22 23.37 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.457 -0.338 . . . . 20.0 111.566 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.508 ' HA ' ' HA ' ' A' ' 83' ' ' GLN . 35.2 ptt-85 -154.95 156.92 36.91 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.45 -0.341 . . . . 20.0 111.338 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.521 ' SG ' ' CB ' ' A' ' 80' ' ' CYS . 17.2 t -69.74 123.63 21.9 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 121.018 0.437 . . . . 20.0 110.208 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.521 ' CG2' ' HD2' ' A' ' 111' ' ' PRO . 39.3 mm -123.4 143.46 41.39 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 115.765 -0.652 . . . . 20.0 112.047 -178.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.597 ' CB ' ' CG1' ' A' ' 137' ' ' VAL . 14.8 Cg_endo -59.89 154.59 49.19 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 123.437 2.758 . . . . 20.0 112.771 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -124.25 -59.14 1.5 Allowed 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 111.922 0.342 . . . . 20.0 111.922 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.547 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 24.9 ttm105 -125.93 145.18 50.38 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.525 0.202 . . . . 20.0 111.224 -179.582 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.58 ' CD1' HG12 ' A' ' 137' ' ' VAL . 0.8 OUTLIER -118.57 159.82 22.88 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 121.448 0.642 . . . . 20.0 111.941 -179.513 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.513 ' HG2' ' NE2' ' A' ' 117' ' ' GLN . 38.5 ttm-85 -100.89 140.45 35.16 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 114.768 -1.105 . . . . 20.0 108.702 178.191 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -80.45 123.32 27.96 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 116.116 -0.493 . . . . 20.0 111.394 -178.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.513 ' NE2' ' HG2' ' A' ' 115' ' ' ARG . 80.1 mm-40 -124.93 124.77 42.74 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.971 -0.559 . . . . 20.0 109.887 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 67.0 ttp85 -130.28 92.43 3.28 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.025 0.441 . . . . 20.0 111.055 -179.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.619 ' CG2' ' CD2' ' A' ' 64' ' ' LEU . 35.1 m -126.3 170.22 16.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.562 -0.745 . . . . 20.0 110.666 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.537 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 13.0 pt20 -110.94 138.58 47.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.998 0.428 . . . . 20.0 110.946 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.618 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -75.82 125.04 28.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.975 -0.557 . . . . 20.0 110.928 -179.608 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.533 ' CD1' ' HA ' ' A' ' 71' ' ' SER . 1.9 mp -91.45 142.96 27.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.478 -0.783 . . . . 20.0 111.742 -178.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . 0.493 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.4 OUTLIER -119.23 152.3 52.16 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 115.372 -0.831 . . . . 20.0 110.538 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . 0.476 ' HD2' ' SG ' ' A' ' 123' ' ' CYS . 76.4 Cg_exo -49.33 110.86 0.4 Allowed 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.525 2.15 . . . . 20.0 111.85 -179.586 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 91.83 3.9 67.89 Favored Glycine 0 N--CA 1.446 -0.695 0 CA-C-N 115.381 -0.827 . . . . 20.0 111.499 -178.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' A' ' 123' ' ' CYS . . . 38.42 86.07 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.758 -0.734 . . . . 20.0 112.024 -179.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -117.19 -53.36 2.46 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.053 0.39 . . . . 20.0 112.053 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -125.87 56.36 15.25 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 120.905 0.383 . . . . 20.0 111.506 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -52.82 146.92 33.97 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.642 2.228 . . . . 20.0 111.458 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.537 ' O ' ' HA ' ' A' ' 120' ' ' GLN . 79.8 mtt85 -125.69 150.6 47.51 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.16 -0.473 . . . . 20.0 111.112 -179.126 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.522 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 14.1 p -102.94 133.76 47.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.955 -0.566 . . . . 20.0 110.449 179.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 67.6 ttt180 -144.8 141.48 29.21 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.002 -0.545 . . . . 20.0 111.269 -179.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.43 ' O ' HG13 ' A' ' 134' ' ' VAL . 14.4 pttp -103.3 149.65 24.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 20.0 110.414 179.206 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . 0.507 ' O ' ' CD2' ' A' ' 136' ' ' LEU . 0.0 OUTLIER -151.88 130.28 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 CA-C-O 121.195 0.521 . . . . 20.0 111.399 -179.279 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 86.1 mtm-85 -91.15 122.6 33.93 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.603 -0.726 . . . . 20.0 109.719 178.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.587 ' N ' ' CD2' ' A' ' 136' ' ' LEU . 0.7 OUTLIER -121.23 127.01 51.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.252 0.549 . . . . 20.0 112.341 -178.655 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.597 ' CG1' ' CB ' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -55.49 92.0 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.937 -0.574 . . . . 20.0 111.803 179.639 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.443 ' C ' HD11 ' A' ' 78' ' ' LEU . . . -81.48 -5.72 58.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.196 -0.456 . . . . 20.0 110.616 179.303 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.6 t -159.36 115.63 2.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.756 -0.656 . . . . 20.0 109.677 179.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' CYS . . . . . . . . . . . . . 24.6 p -136.12 157.15 47.51 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.12 0.486 . . . . 20.0 112.076 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -131.82 145.82 51.78 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.655 -0.702 . . . . 20.0 110.81 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . 0.556 ' SG ' ' CD1' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -74.22 98.32 3.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.248 0.547 . . . . 20.0 110.158 179.628 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.47 ' O ' ' HB2' ' A' ' 144' ' ' ARG . 27.5 tptt -145.31 154.76 42.68 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.445 -0.798 . . . . 20.0 110.819 179.54 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.47 ' HB2' ' O ' ' A' ' 143' ' ' LYS . 64.9 mtp180 . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.239 -0.886 . . . . 20.0 110.723 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.5 mttp . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.887 0.375 . . . . 20.0 111.19 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.431 ' C ' ' OD1' ' A' ' 49' ' ' ASP . 32.7 p30 -88.95 14.17 11.12 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.169 -0.469 . . . . 20.0 111.627 -179.234 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.42 ' O ' ' O ' ' A' ' 54' ' ' SER . 28.0 m -97.58 -18.26 6.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.096 -0.502 . . . . 20.0 111.074 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.437 ' HA ' ' O ' ' A' ' 54' ' ' SER . 51.4 p -80.59 -9.19 59.79 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.728 -0.669 . . . . 20.0 110.919 -179.551 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -60.99 -33.25 72.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.897 0.38 . . . . 20.0 110.29 179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.619 ' CD2' ' HB2' ' A' ' 54' ' ' SER . 35.0 p90 -107.2 -57.11 2.12 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.237 -0.438 . . . . 20.0 111.77 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.619 ' HB2' ' CD2' ' A' ' 53' ' ' TYR . 0.4 OUTLIER -151.37 -166.57 2.56 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.706 -0.479 . . . . 20.0 109.706 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.9 m 61.52 55.1 2.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.135 0.493 . . . . 20.0 110.161 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.494 ' HD3' ' O ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -126.02 152.76 45.33 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.564 -0.744 . . . . 20.0 111.171 -179.907 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 57' ' ' GLU . 83.2 tt0 28.12 43.66 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.282 0.563 . . . . 20.0 110.61 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.574 ' O ' ' CD2' ' A' ' 59' ' ' HIS . 0.0 OUTLIER -124.18 117.54 24.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.646 -0.706 . . . . 20.0 111.781 -178.861 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.574 ' CD2' ' O ' ' A' ' 58' ' ' LEU . 24.0 m170 -151.16 133.55 15.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.979 -0.555 . . . . 20.0 110.717 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.591 ' CZ ' HG12 ' A' ' 79' ' ' VAL . 2.7 m-85 -132.06 150.08 52.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 20.0 111.381 -179.007 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -97.51 96.99 8.7 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.984 -0.553 . . . . 20.0 111.75 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.495 ' O ' HD12 ' A' ' 136' ' ' LEU . 23.2 tpt180 -126.28 121.6 33.11 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 107.714 -1.217 . . . . 20.0 107.714 177.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.606 ' CD2' ' O ' ' A' ' 73' ' ' LYS . 0.0 OUTLIER -112.48 -81.28 0.59 Allowed 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.003 -0.679 . . . . 20.0 112.702 -177.445 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.637 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -169.06 137.6 2.02 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.214 -0.594 . . . . 20.0 112.203 -178.192 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 51.9 p -129.74 136.42 49.63 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.721 -0.672 . . . . 20.0 109.246 178.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.527 ' O ' ' C ' ' A' ' 67' ' ' GLY . 8.6 t0 -148.82 -158.31 0.9 Allowed 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.606 -0.438 . . . . 20.0 111.008 -179.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.864 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -31.37 141.5 0.04 OUTLIER Glycine 0 C--N 1.346 1.118 0 N-CA-C 109.718 -1.353 . . . . 20.0 109.718 179.518 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.521 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 20.1 Cg_exo -15.54 53.16 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.889 1 C-N-CA 125.409 4.072 . . . . 20.0 115.48 -178.207 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.864 ' N ' ' O ' ' A' ' 67' ' ' GLY . 65.4 m -159.29 162.85 36.1 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 107.885 -1.154 . . . . 20.0 107.885 178.093 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -148.41 137.94 22.1 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.567 0.58 . . . . 20.0 112.567 -179.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.637 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.6 OUTLIER -81.15 162.91 23.46 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 115.931 -0.577 . . . . 20.0 110.278 178.543 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -151.7 27.83 0.63 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.942 0.719 . . . . 20.0 112.942 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.606 ' O ' ' CD2' ' A' ' 63' ' ' PHE . 9.9 tttt -71.17 150.5 94.56 Favored Pre-proline 0 C--N 1.327 -0.379 0 N-CA-C 109.85 -0.426 . . . . 20.0 109.85 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.525 ' HD2' ' CG ' ' A' ' 73' ' ' LYS . 41.9 Cg_exo -59.85 115.07 2.37 Favored 'Trans proline' 0 N--CA 1.464 -0.247 0 C-N-CA 122.175 1.917 . . . . 20.0 112.241 -179.258 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.581 HG23 ' CD2' ' A' ' 63' ' ' PHE . 4.9 m -134.77 155.42 38.43 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.202 0 CA-C-N 115.676 -0.693 . . . . 20.0 111.062 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 18.7 m -126.76 121.76 32.89 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.717 -0.674 . . . . 20.0 109.813 179.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.443 ' OE2' ' HB2' ' A' ' 62' ' ' ARG . 6.1 pt-20 -130.58 150.78 51.62 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.041 0.448 . . . . 20.0 111.404 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.418 ' CD1' ' N ' ' A' ' 78' ' ' LEU . 5.2 mp -102.6 141.09 35.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.884 -0.598 . . . . 20.0 111.104 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.591 HG12 ' CZ ' ' A' ' 60' ' ' TYR . 5.8 m -90.91 87.84 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 N-CA-C 109.207 -0.664 . . . . 20.0 109.207 178.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.534 ' SG ' ' HB3' ' A' ' 109' ' ' CYS . 33.4 m -94.2 116.22 28.59 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.38 -0.827 . . . . 20.0 110.498 -178.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.728 ' O ' ' N ' ' A' ' 109' ' ' CYS . 4.2 m -114.78 154.88 27.75 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-O 121.349 0.595 . . . . 20.0 111.938 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.473 ' O ' ' HA ' ' A' ' 107' ' ' PHE . . . -64.25 113.15 5.61 Favored Glycine 0 CA--C 1.522 0.521 0 C-N-CA 119.098 -1.525 . . . . 20.0 113.356 -178.163 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.567 ' HB2' ' HB3' ' A' ' 107' ' ' PHE . 60.5 tt0 -156.56 152.3 27.1 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.038 0.447 . . . . 20.0 112.009 179.012 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.534 ' HB2' ' O ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER 162.71 40.29 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.687 -0.688 . . . . 20.0 111.165 178.931 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 109.87 -81.54 0.29 Allowed Glycine 0 CA--C 1.521 0.418 0 C-N-CA 120.625 -0.797 . . . . 20.0 113.396 179.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . 0.571 ' O ' ' CZ ' ' A' ' 144' ' ' ARG . 80.7 Cg_exo -38.38 113.19 0.14 Allowed 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 123.612 2.875 . . . . 20.0 113.826 -178.841 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -101.9 26.99 6.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.762 -0.653 . . . . 20.0 111.147 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.99 107.03 0.66 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.961 0.41 . . . . 20.0 110.351 -179.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.416 HD23 ' CA ' ' A' ' 104' ' ' GLY . 31.2 mt -87.28 151.42 23.15 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.87 -0.604 . . . . 20.0 110.396 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.558 HD23 ' N ' ' A' ' 90' ' ' LEU . 0.6 OUTLIER -92.29 115.13 64.18 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.767 0.318 . . . . 20.0 110.421 -179.822 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -61.27 -162.43 0.03 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.759 2.306 . . . . 20.0 112.269 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -74.3 129.33 37.59 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.387 0.613 . . . . 20.0 112.007 -178.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.472 ' C ' HG13 ' A' ' 94' ' ' ILE . . . -94.39 -6.75 43.46 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 114.993 -1.003 . . . . 20.0 112.413 -179.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.472 HG13 ' C ' ' A' ' 93' ' ' ALA . 9.6 mt -155.09 -36.01 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 N-CA-C 113.087 0.773 . . . . 20.0 113.087 -178.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 115.93 -30.19 6.72 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.508 -0.853 . . . . 20.0 111.175 -178.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.415 ' CD ' ' HE3' ' A' ' 98' ' ' LYS . 29.1 ptt180 -105.81 137.81 43.06 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.226 -0.657 . . . . 20.0 109.226 178.519 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.471 ' CG2' ' NE ' ' A' ' 101' ' ' ARG . 3.7 t -109.67 123.48 65.6 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 CA-C-O 122.075 0.94 . . . . 20.0 111.642 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.458 ' CG ' ' HD1' ' A' ' 99' ' ' TRP . 10.9 ptpt -158.99 20.16 0.2 Allowed 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 113.672 -1.604 . . . . 20.0 110.302 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.723 ' CZ2' ' CZ3' ' A' ' 100' ' ' TRP . 0.4 OUTLIER -153.75 -66.29 0.14 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.994 0.426 . . . . 20.0 112.125 -177.757 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' TRP . . . . . 0.723 ' CZ3' ' CZ2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -123.02 -165.7 1.35 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.852 -0.613 . . . . 20.0 110.8 -178.856 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.632 ' N ' ' CG ' ' A' ' 100' ' ' TRP . 0.5 OUTLIER -168.0 143.82 3.2 Favored Pre-proline 0 N--CA 1.453 -0.321 0 CA-C-O 120.974 0.416 . . . . 20.0 111.309 179.769 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.547 ' HA ' ' O ' ' A' ' 90' ' ' LEU . 29.0 Cg_exo -63.09 1.36 1.2 Allowed 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 123.161 2.574 . . . . 20.0 114.068 -178.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -50.93 -28.54 9.95 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.62 -0.511 . . . . 20.0 109.62 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.419 ' HA2' ' HD3' ' A' ' 105' ' ' PRO . . . 124.12 153.69 8.7 Favored Glycine 0 C--N 1.334 0.471 0 C-N-CA 120.905 -0.664 . . . . 20.0 113.756 178.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.592 ' HD2' ' CZ ' ' A' ' 107' ' ' PHE . 2.8 Cg_endo -81.06 171.48 14.02 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.34 2.693 . . . . 20.0 111.139 178.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.484 ' O ' ' HB3' ' A' ' 81' ' ' SER . 54.6 t0 -75.35 122.24 23.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.979 0.419 . . . . 20.0 110.897 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . 0.592 ' CZ ' ' HD2' ' A' ' 105' ' ' PRO . 16.8 m-30 -109.6 131.7 54.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.003 -0.544 . . . . 20.0 110.508 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.561 ' N ' ' HB2' ' A' ' 83' ' ' GLN . 41.6 ttm180 178.86 -46.16 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 113.599 0.963 . . . . 20.0 113.599 179.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.728 ' N ' ' O ' ' A' ' 81' ' ' SER . 1.1 m -167.36 146.2 4.98 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 113.455 0.909 . . . . 20.0 113.455 -178.054 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.565 ' CG2' ' CB ' ' A' ' 143' ' ' LYS . 3.5 tp -105.82 132.66 20.69 Favored Pre-proline 0 N--CA 1.464 0.271 0 O-C-N 121.691 -0.631 . . . . 20.0 110.436 177.405 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.522 ' HA ' ' HB3' ' A' ' 140' ' ' CYS . 9.0 Cg_endo -53.58 139.51 66.45 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.848 2.366 . . . . 20.0 111.913 -179.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -132.49 -68.75 0.6 Allowed 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.666 -0.414 . . . . 20.0 111.232 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.531 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 21.4 ttm180 -125.92 141.93 51.75 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.088 -0.506 . . . . 20.0 111.008 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.591 ' CE2' HG11 ' A' ' 137' ' ' VAL . 0.8 OUTLIER -116.59 159.39 22.21 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-O 121.677 0.751 . . . . 20.0 112.098 -179.477 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.416 ' HD2' ' NE2' ' A' ' 117' ' ' GLN . 47.2 ttm-85 -97.5 146.49 25.19 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 114.423 -1.262 . . . . 20.0 108.413 177.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . 0.503 ' O ' ' NE2' ' A' ' 117' ' ' GLN . . . -83.31 136.42 34.38 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 120.717 -0.393 . . . . 20.0 111.691 -178.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.511 ' HB2' HG23 ' A' ' 134' ' ' VAL . 91.0 mm-40 -134.47 135.26 42.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.984 -0.553 . . . . 20.0 110.81 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 58.3 ttt-85 -128.38 93.96 3.77 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.359 -0.382 . . . . 20.0 110.298 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.579 ' CG1' ' HB2' ' A' ' 73' ' ' LYS . 25.1 t -129.17 144.69 37.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 N-CA-C 112.501 0.556 . . . . 20.0 112.501 -178.469 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.49 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 19.0 pt20 -88.24 131.15 34.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.169 -0.469 . . . . 20.0 110.711 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.581 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -77.26 116.15 17.63 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.08 -0.509 . . . . 20.0 111.163 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.489 HD11 ' HA ' ' A' ' 71' ' ' SER . 0.2 OUTLIER -80.27 150.67 29.92 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.6 -0.727 . . . . 20.0 111.107 -179.922 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . 0.521 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -111.25 112.2 55.04 Favored Pre-proline 0 C--N 1.332 -0.184 0 CA-C-O 120.827 0.346 . . . . 20.0 110.81 179.433 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -54.99 108.13 0.28 Allowed 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 122.502 2.135 . . . . 20.0 111.58 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 74.12 23.77 75.21 Favored Glycine 0 N--CA 1.452 -0.274 0 N-CA-C 110.853 -0.899 . . . . 20.0 110.853 -178.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . 0.459 ' O ' ' HB3' ' A' ' 123' ' ' CYS . . . -150.61 119.37 1.0 Allowed Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 111.412 -0.675 . . . . 20.0 111.412 -179.53 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.431 ' C ' ' HD3' ' A' ' 129' ' ' PRO . . . -85.42 43.33 1.01 Allowed 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 112.968 0.729 . . . . 20.0 112.968 -178.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -114.16 60.52 1.0 Allowed Pre-proline 0 C--N 1.327 -0.375 0 CA-C-O 121.093 0.473 . . . . 20.0 110.533 178.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . 0.433 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 41.3 Cg_endo -68.62 146.88 68.79 Favored 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 123.38 2.72 . . . . 20.0 112.71 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.49 ' O ' ' HA ' ' A' ' 120' ' ' GLN . 83.2 mtt85 -134.35 148.36 50.7 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.874 -0.603 . . . . 20.0 110.46 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.478 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 57.8 p -89.8 141.12 28.93 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 121.096 -0.241 . . . . 20.0 110.869 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 53.4 ttt85 -146.86 148.39 31.8 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.135 0.493 . . . . 20.0 112.135 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 1.9 pttt -101.39 145.72 28.55 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 115.382 -0.826 . . . . 20.0 109.884 178.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . 0.511 HG23 ' HB2' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -149.29 126.54 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-O 121.399 0.619 . . . . 20.0 111.448 179.86 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.514 ' HB3' ' HB2' ' A' ' 114' ' ' TYR . 85.1 mtm180 -95.42 112.76 24.42 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.061 -0.972 . . . . 20.0 109.771 179.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.548 ' N ' ' HB3' ' A' ' 114' ' ' TYR . 1.7 mt -113.99 125.35 53.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.524 0.678 . . . . 20.0 112.677 -179.489 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.591 HG11 ' CE2' ' A' ' 114' ' ' TYR . 2.3 m -55.39 90.77 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.088 -0.96 . . . . 20.0 112.835 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -65.53 -25.46 67.46 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.488 -0.93 . . . . 20.0 108.488 177.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 26.3 p -161.94 129.11 3.88 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 114.992 -1.004 . . . . 20.0 110.632 179.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' CYS . . . . . 0.527 ' CB ' ' O ' ' A' ' 110' ' ' ILE . 0.0 OUTLIER -121.73 -174.93 2.98 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.803 0.335 . . . . 20.0 111.5 179.862 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.539 ' HG2' ' N ' ' A' ' 142' ' ' CYS . 15.5 tttp -118.56 168.55 10.58 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.315 -0.402 . . . . 20.0 111.698 -179.387 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . 0.548 ' HB2' ' CE2' ' A' ' 53' ' ' TYR . 43.4 t -86.74 103.27 15.03 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.232 -0.44 . . . . 20.0 112.022 -179.254 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.565 ' CB ' ' CG2' ' A' ' 110' ' ' ILE . 12.0 tptm -142.94 142.39 31.68 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.078 -0.51 . . . . 20.0 110.247 178.446 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.571 ' CZ ' ' O ' ' A' ' 86' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.311 -0.852 . . . . 20.0 110.414 179.625 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.9 mtmm . . . . . 0 N--CA 1.485 1.279 0 CA-C-O 120.904 0.383 . . . . 20.0 111.183 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -82.11 14.3 2.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.046 -0.525 . . . . 20.0 111.684 -179.214 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.441 HG13 ' HG2' ' A' ' 141' ' ' LYS . 29.2 m -99.42 -17.6 6.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.075 0.464 . . . . 20.0 110.917 179.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 89.8 p -84.81 -1.58 56.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.607 -0.724 . . . . 20.0 111.268 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -61.57 -30.43 70.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.843 0.354 . . . . 20.0 110.444 -179.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.55 ' CD1' ' SG ' ' A' ' 142' ' ' CYS . 0.0 OUTLIER -111.47 -74.27 0.65 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.176 0.512 . . . . 20.0 110.366 179.118 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.557 ' CB ' ' HA3' ' A' ' 82' ' ' GLY . 20.3 t -143.05 -158.55 0.88 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.332 -0.849 . . . . 20.0 110.053 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.476 ' O ' ' O ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER 61.73 35.1 17.03 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.108 -0.496 . . . . 20.0 110.852 179.738 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.481 ' O ' HD11 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -57.45 -146.33 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 20.0 110.209 179.423 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.464 ' N ' ' HG2' ' A' ' 56' ' ' ARG . 93.8 mt-10 -92.46 96.52 10.29 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.93 0.395 . . . . 20.0 110.756 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.54 ' N ' HD12 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -125.4 138.82 54.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.994 -0.548 . . . . 20.0 110.194 179.596 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.417 ' C ' ' CD1' ' A' ' 60' ' ' TYR . 9.0 m170 -139.0 132.6 30.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.052 0.453 . . . . 20.0 111.181 -179.88 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.598 ' CE1' HG21 ' A' ' 79' ' ' VAL . 10.2 m-85 -133.77 148.74 51.4 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.732 -0.667 . . . . 20.0 111.697 -178.684 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 73.2 p -103.29 82.46 2.06 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.178 -0.465 . . . . 20.0 111.318 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.519 ' CB ' ' OE1' ' A' ' 77' ' ' GLU . 68.0 ttt180 -114.93 123.19 48.5 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 108.405 -0.961 . . . . 20.0 108.405 177.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.538 ' CD1' HG22 ' A' ' 75' ' ' VAL . 0.1 OUTLIER -110.6 -80.24 0.58 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.154 0.427 . . . . 20.0 112.154 -177.859 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.633 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -166.92 133.97 2.43 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.62 -0.432 . . . . 20.0 111.089 -178.887 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 49.4 p -131.04 141.68 50.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.355 -0.384 . . . . 20.0 110.756 179.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.525 ' O ' ' C ' ' A' ' 67' ' ' GLY . 9.3 t0 -152.37 -163.92 1.84 Allowed 'General case' 0 C--O 1.236 0.382 0 N-CA-C 109.785 -0.45 . . . . 20.0 109.785 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.861 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -31.85 148.17 0.01 OUTLIER Glycine 0 C--N 1.345 1.058 0 CA-C-O 118.098 -1.39 . . . . 20.0 110.167 179.135 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.524 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 41.6 Cg_exo -18.14 54.44 0.0 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 124.971 3.78 . . . . 20.0 115.289 -178.255 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.861 ' N ' ' O ' ' A' ' 67' ' ' GLY . 59.1 m -162.66 153.76 17.45 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 115.603 -0.726 . . . . 20.0 109.117 179.118 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.526 ' O ' ' N ' ' A' ' 122' ' ' LEU . 95.5 mtt180 -150.29 150.01 30.92 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.213 0.53 . . . . 20.0 112.335 -179.672 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.633 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -90.21 161.52 15.68 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 115.445 -0.798 . . . . 20.0 110.105 178.496 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.18 35.17 0.99 Allowed 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 114.276 1.213 . . . . 20.0 114.276 -179.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.519 ' HG2' HG11 ' A' ' 119' ' ' VAL . 0.9 OUTLIER -80.19 157.75 72.89 Favored Pre-proline 0 C--N 1.327 -0.387 0 C-N-CA 120.632 -0.427 . . . . 20.0 109.989 178.736 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -61.92 116.27 3.35 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.479 2.12 . . . . 20.0 112.513 -179.363 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.538 HG22 ' CD1' ' A' ' 63' ' ' PHE . 8.3 m -133.71 154.44 38.51 Favored 'Isoleucine or valine' 0 C--O 1.23 0.037 0 CA-C-O 120.857 0.36 . . . . 20.0 111.675 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 45.4 m -117.93 121.49 40.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.96 -0.563 . . . . 20.0 109.98 178.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.519 ' OE1' ' CB ' ' A' ' 62' ' ' ARG . 81.0 tt0 -123.92 141.52 51.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.962 0.41 . . . . 20.0 111.814 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.567 ' CD1' ' N ' ' A' ' 78' ' ' LEU . 1.5 mp -117.57 125.68 51.23 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.864 -0.607 . . . . 20.0 110.965 179.297 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.598 HG21 ' CE1' ' A' ' 60' ' ' TYR . 18.5 m -95.13 86.56 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-N 115.779 -0.646 . . . . 20.0 110.746 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.42 ' HB3' ' SG ' ' A' ' 109' ' ' CYS . 0.0 OUTLIER -90.11 101.89 14.61 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.907 0.384 . . . . 20.0 110.698 179.962 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 9.5 t -143.57 106.06 4.44 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.097 -0.502 . . . . 20.0 110.379 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.557 ' HA3' ' CB ' ' A' ' 54' ' ' SER . . . -164.6 -153.67 7.56 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.682 -0.771 . . . . 20.0 112.355 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.447 ' HA ' ' HA ' ' A' ' 108' ' ' ARG . 91.0 mt-30 -129.14 151.51 49.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.819 0.343 . . . . 20.0 110.948 179.659 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.41 ' SG ' ' O ' ' A' ' 142' ' ' CYS . 81.4 m -108.56 159.71 16.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.189 -0.46 . . . . 20.0 110.328 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -121.01 63.91 0.49 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.596 -0.812 . . . . 20.0 112.272 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -70.97 167.69 25.27 Favored 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.731 2.287 . . . . 20.0 111.853 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.446 ' O ' HD22 ' A' ' 89' ' ' LEU . . . -74.89 3.75 7.66 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.295 -0.411 . . . . 20.0 111.179 179.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.5 mmm180 -58.57 135.63 57.38 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.068 0.461 . . . . 20.0 110.677 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.446 HD22 ' O ' ' A' ' 87' ' ' ALA . 1.3 mm? -98.83 135.89 39.64 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.797 -0.638 . . . . 20.0 110.465 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.564 ' CD1' ' HD2' ' A' ' 91' ' ' PRO . 0.2 OUTLIER -97.07 148.96 35.16 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 20.0 111.173 -179.442 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.604 ' HB2' ' CD1' ' A' ' 100' ' ' TRP . 9.3 Cg_endo -51.42 104.61 0.09 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.194 0 C-N-CA 122.764 2.309 . . . . 20.0 111.251 178.994 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.572 ' O ' ' CH2' ' A' ' 99' ' ' TRP . 80.2 m-20 -107.72 139.68 41.93 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.071 0.462 . . . . 20.0 111.943 -179.205 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.605 ' CB ' ' CG2' ' A' ' 97' ' ' VAL . . . -61.81 -29.5 70.2 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.703 -0.681 . . . . 20.0 111.581 179.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.529 ' CG2' ' O ' ' A' ' 94' ' ' ILE . 5.1 mt 31.46 35.45 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.485 0.659 . . . . 20.0 111.497 179.23 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . 0.513 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 108.89 -52.98 0.61 Allowed Glycine 0 CA--C 1.52 0.347 0 CA-C-N 115.122 -0.945 . . . . 20.0 113.111 179.41 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.515 ' O ' ' CZ2' ' A' ' 99' ' ' TRP . 58.1 mtp180 -118.61 143.14 47.0 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 110.422 -0.214 . . . . 20.0 110.422 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.633 ' CG1' ' CZ3' ' A' ' 100' ' ' TRP . 12.8 t -129.16 132.82 66.72 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 CA-C-O 121.974 0.892 . . . . 20.0 112.197 179.219 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.464 ' HG2' ' C ' ' A' ' 97' ' ' VAL . 1.2 ptpt 161.82 -32.77 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 113.944 -1.48 . . . . 20.0 108.468 -179.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.572 ' CH2' ' O ' ' A' ' 92' ' ' ASN . 34.7 p-90 -92.06 24.93 3.05 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 113.146 -1.843 . . . . 20.0 110.396 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' TRP . . . . . 0.662 ' HA ' ' CE3' ' A' ' 100' ' ' TRP . 0.0 OUTLIER -30.3 143.32 0.01 OUTLIER 'General case' 0 CA--C 1.499 -1.007 0 CA-C-O 121.858 0.837 . . . . 20.0 112.925 -177.881 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.456 ' O ' ' HD3' ' A' ' 91' ' ' PRO . 65.1 mtp180 -111.77 74.47 1.29 Allowed Pre-proline 0 N--CA 1.433 -1.285 0 CA-C-N 114.156 -1.384 . . . . 20.0 109.961 179.478 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -64.61 46.44 0.15 Allowed 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 123.436 2.757 . . . . 20.0 113.408 -179.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -52.96 -26.11 14.13 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.919 0.39 . . . . 20.0 110.324 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . 0.551 ' O ' ' CD2' ' A' ' 90' ' ' LEU . . . 130.24 146.56 5.99 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.897 -0.668 . . . . 20.0 112.868 179.257 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.451 ' HA ' HD23 ' A' ' 90' ' ' LEU . 56.6 Cg_endo -81.08 170.3 15.26 Favored 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 123.232 2.622 . . . . 20.0 113.127 -179.631 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -59.84 153.45 20.78 Favored 'General case' 0 C--N 1.334 -0.109 0 CA-C-N 116.094 -0.503 . . . . 20.0 110.569 179.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . 0.461 ' HA ' ' O ' ' A' ' 144' ' ' ARG . 91.5 m-85 -100.56 129.83 46.55 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.029 0.442 . . . . 20.0 111.369 -179.367 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.465 ' O ' ' OXT' ' A' ' 144' ' ' ARG . 88.4 mtt180 -74.97 156.99 35.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.791 -0.64 . . . . 20.0 111.468 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 142' ' ' CYS . 4.7 t -74.35 100.44 3.77 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 109.27 -0.641 . . . . 20.0 109.27 178.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.513 HG23 HD11 ' A' ' 110' ' ' ILE . 25.4 mm -114.58 139.74 24.39 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 121.088 0.471 . . . . 20.0 111.713 -179.052 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.531 ' CB ' ' CG1' ' A' ' 137' ' ' VAL . 12.1 Cg_endo -55.79 143.3 81.4 Favored 'Trans proline' 0 C--O 1.231 0.138 0 C-N-CA 123.131 2.554 . . . . 20.0 112.285 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -107.83 -61.63 1.55 Allowed 'General case' 0 C--N 1.333 -0.144 0 N-CA-C 112.327 0.491 . . . . 20.0 112.327 -179.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.447 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 42.3 ttm180 -121.69 147.87 45.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.033 0.444 . . . . 20.0 112.002 -178.597 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.597 ' N ' ' CD1' ' A' ' 114' ' ' TYR . 0.1 OUTLIER -125.76 158.72 34.19 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.822 -0.626 . . . . 20.0 111.3 179.844 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 62.0 ttm-85 -93.51 142.53 27.24 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.661 -0.866 . . . . 20.0 108.661 178.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -80.78 132.81 35.55 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.138 0.494 . . . . 20.0 111.771 -178.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.482 ' HB2' HG21 ' A' ' 134' ' ' VAL . 92.1 mm-40 -129.62 144.32 51.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.457 -0.792 . . . . 20.0 109.967 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 48.7 ttp180 -139.65 91.08 2.45 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.507 -0.315 . . . . 20.0 110.7 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.519 HG11 ' HG2' ' A' ' 73' ' ' LYS . 0.6 OUTLIER -125.57 164.37 25.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.387 -0.37 . . . . 20.0 110.885 -179.869 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.543 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 14.0 pt20 -106.22 138.37 42.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.155 0.503 . . . . 20.0 111.137 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.613 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -79.43 126.91 31.45 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.573 -0.739 . . . . 20.0 111.443 -179.787 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.526 ' N ' ' O ' ' A' ' 70' ' ' ARG . 0.3 OUTLIER -76.2 144.53 40.41 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.236 -0.893 . . . . 20.0 109.773 179.29 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . 0.526 ' HB2' ' O ' ' A' ' 126' ' ' GLY . 3.0 m -104.96 107.96 60.03 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 116.104 -0.498 . . . . 20.0 110.113 -178.977 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . 0.42 ' HD2' ' HA ' ' A' ' 69' ' ' CYS . 37.7 Cg_endo -66.01 103.06 0.58 Allowed 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 122.08 1.853 . . . . 20.0 111.912 -179.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 87.87 18.15 56.74 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.631 -0.795 . . . . 20.0 111.496 -179.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . 0.526 ' O ' ' HB2' ' A' ' 123' ' ' CYS . . . -152.99 123.63 1.47 Allowed Glycine 0 N--CA 1.442 -0.919 0 N-CA-C 110.407 -1.077 . . . . 20.0 110.407 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -88.26 44.53 1.21 Allowed 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 112.382 0.512 . . . . 20.0 112.382 -178.418 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -120.44 66.28 12.38 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-O 121.096 0.474 . . . . 20.0 110.393 179.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_endo -52.05 148.88 22.57 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 123.101 2.534 . . . . 20.0 112.635 -179.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.543 ' O ' ' HA ' ' A' ' 120' ' ' GLN . 56.7 mtp85 -125.75 151.55 46.54 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.039 -0.528 . . . . 20.0 110.496 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.423 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 47.5 t -102.72 135.88 43.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.682 0.277 . . . . 20.0 110.392 179.653 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 25.7 tpt180 -144.72 144.82 31.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.169 0.509 . . . . 20.0 111.745 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 18.2 pttp -99.19 143.7 29.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.473 -0.785 . . . . 20.0 109.664 178.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . 0.498 HG23 ' O ' ' A' ' 63' ' ' PHE . 3.1 m -146.33 130.0 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 CA-C-O 121.349 0.595 . . . . 20.0 111.252 -179.599 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.542 ' HB3' ' HB2' ' A' ' 114' ' ' TYR . 83.2 mtt-85 -92.79 127.79 38.42 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.128 -0.942 . . . . 20.0 110.207 179.424 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.594 ' N ' ' CD2' ' A' ' 136' ' ' LEU . 0.8 OUTLIER -117.6 114.38 23.33 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.005 0.372 . . . . 20.0 112.005 -178.871 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.592 HG12 ' CE2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -59.74 76.51 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.798 0.333 . . . . 20.0 110.349 178.832 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.538 ' N ' ' O ' ' A' ' 136' ' ' LEU . . . -66.47 -10.46 44.55 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.196 -0.456 . . . . 20.0 110.832 -179.64 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 51.6 p -161.04 120.82 2.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.882 -0.599 . . . . 20.0 110.108 179.28 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' CYS . . . . . 0.481 ' HB2' ' HA ' ' A' ' 111' ' ' PRO . 26.7 p -139.44 155.06 47.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.283 0.563 . . . . 20.0 111.728 -179.688 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.441 ' HG2' HG13 ' A' ' 50' ' ' VAL . 22.1 mttt -125.77 157.12 38.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.091 -0.959 . . . . 20.0 108.778 178.747 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . 0.553 ' O ' ' SG ' ' A' ' 142' ' ' CYS . 0.1 OUTLIER -76.35 101.88 5.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.944 0.878 . . . . 20.0 111.42 -179.099 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.447 ' C ' ' HG2' ' A' ' 144' ' ' ARG . 44.7 mmtm -146.61 149.55 33.75 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.167 -0.924 . . . . 20.0 110.665 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.514 ' HD2' ' N ' ' A' ' 144' ' ' ARG . 14.9 mmm180 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.224 -0.894 . . . . 20.0 111.423 179.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 24.7 mttm . . . . . 0 N--CA 1.489 1.494 0 CA-C-O 120.7 0.286 . . . . 20.0 111.231 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.47 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 51.7 p30 -89.11 16.25 7.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.245 -0.434 . . . . 20.0 111.4 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.464 ' O ' ' CZ ' ' A' ' 53' ' ' TYR . 84.7 t -70.11 -37.83 73.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.339 -0.391 . . . . 20.0 111.639 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 60.4 p -83.88 5.08 26.64 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.274 -0.421 . . . . 20.0 110.972 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.569 ' HG2' ' CD1' ' A' ' 53' ' ' TYR . 15.7 pt-20 -67.65 -25.97 65.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.329 -0.396 . . . . 20.0 112.052 -178.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.582 ' CD2' ' O ' ' A' ' 108' ' ' ARG . 0.1 OUTLIER -97.97 -84.21 0.39 Allowed 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.134 0.492 . . . . 20.0 111.18 179.853 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.528 ' HB3' ' CB ' ' A' ' 109' ' ' CYS . 0.3 OUTLIER -147.14 -165.01 2.13 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.667 -0.697 . . . . 20.0 110.297 -179.962 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 42.2 m 65.18 44.04 3.43 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.081 0.467 . . . . 20.0 110.398 179.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.556 ' N ' HD11 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -137.15 145.58 43.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.548 -0.751 . . . . 20.0 111.051 179.901 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.467 ' C ' ' O ' ' A' ' 56' ' ' ARG . 58.9 mm-40 31.02 36.32 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 121.335 0.588 . . . . 20.0 110.702 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.556 HD11 ' N ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -115.95 122.14 44.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.166 -0.925 . . . . 20.0 110.903 -179.792 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.42 ' CD2' ' O ' ' A' ' 58' ' ' LEU . 0.5 OUTLIER -152.64 127.85 9.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.19 -0.459 . . . . 20.0 110.706 179.838 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.587 ' CE1' HG23 ' A' ' 79' ' ' VAL . 12.7 m-85 -127.58 149.02 50.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.201 -0.454 . . . . 20.0 112.002 -179.078 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 57.8 p -107.95 90.46 3.3 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.802 -0.636 . . . . 20.0 111.518 -179.446 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.532 ' O ' ' CG2' ' A' ' 75' ' ' VAL . 40.7 mmt180 -120.52 125.03 46.83 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.524 -0.917 . . . . 20.0 108.524 178.079 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.575 ' CD1' ' O ' ' A' ' 73' ' ' LYS . 0.0 OUTLIER -112.88 -82.88 0.59 Allowed 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.729 0.64 . . . . 20.0 112.729 -178.185 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.625 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -168.84 141.83 2.84 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.475 -0.49 . . . . 20.0 112.136 -178.201 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.438 ' O ' ' OD1' ' A' ' 66' ' ' ASP . 81.1 p -134.98 134.61 40.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.265 -0.425 . . . . 20.0 110.681 178.515 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.544 ' O ' ' C ' ' A' ' 67' ' ' GLY . 92.1 m-20 -141.32 -165.52 1.99 Allowed 'General case' 0 C--O 1.237 0.426 0 N-CA-C 109.7 -0.481 . . . . 20.0 109.7 179.411 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.786 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -30.32 143.98 0.01 OUTLIER Glycine 0 C--N 1.345 1.055 0 N-CA-C 110.243 -1.143 . . . . 20.0 110.243 179.334 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.505 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 14.1 Cg_exo -16.07 58.73 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 125.193 3.929 . . . . 20.0 115.412 -178.077 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.786 ' N ' ' O ' ' A' ' 67' ' ' GLY . 59.8 m -164.11 158.86 19.74 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 108.168 -1.049 . . . . 20.0 108.168 178.201 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 49.4 ttp180 -150.81 143.16 24.26 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.93 0.715 . . . . 20.0 112.93 -179.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.625 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -84.28 160.77 20.67 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 115.202 -0.908 . . . . 20.0 110.36 178.554 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -147.51 28.05 0.99 Allowed 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 113.47 0.915 . . . . 20.0 113.47 -179.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.575 ' O ' ' CD1' ' A' ' 63' ' ' PHE . 1.0 OUTLIER -72.95 155.8 90.22 Favored Pre-proline 0 C--N 1.324 -0.509 0 C-N-CA 120.548 -0.461 . . . . 20.0 110.09 179.268 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -61.3 119.45 6.6 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.352 2.035 . . . . 20.0 111.97 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.568 HG23 ' CD1' ' A' ' 63' ' ' PHE . 11.1 m -135.71 147.01 28.75 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 CA-C-N 116.422 -0.354 . . . . 20.0 111.191 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 41.2 m -113.79 123.95 51.07 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.021 0.438 . . . . 20.0 110.294 178.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.445 ' OE1' HD21 ' A' ' 136' ' ' LEU . 40.0 tp10 -128.67 138.36 52.12 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.713 -0.676 . . . . 20.0 110.401 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.558 ' CD1' ' N ' ' A' ' 78' ' ' LEU . 1.4 mp -115.39 134.21 55.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.43 -0.35 . . . . 20.0 110.56 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.587 HG23 ' CE1' ' A' ' 60' ' ' TYR . 15.1 m -97.58 86.56 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 CA-C-O 121.005 0.431 . . . . 20.0 111.335 -179.777 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.491 ' O ' ' HD3' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -100.98 111.94 24.26 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.063 -0.517 . . . . 20.0 110.358 179.389 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.1 t -145.17 109.03 4.73 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.102 0.408 . . . . 20.0 112.102 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.497 ' O ' ' HA ' ' A' ' 144' ' ' ARG . . . -174.99 -179.88 45.85 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 120.545 -0.836 . . . . 20.0 113.381 179.129 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.661 ' HA ' ' HA ' ' A' ' 144' ' ' ARG . 59.4 tt0 -109.08 144.79 36.64 Favored 'General case' 0 CA--C 1.528 0.103 0 C-N-CA 123.011 0.524 . . . . 20.0 110.616 179.261 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.482 ' SG ' ' C ' ' A' ' 142' ' ' CYS . 95.4 m -106.39 128.45 54.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.019 0.438 . . . . 20.0 110.133 179.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . 0.632 ' N ' ' CD ' ' A' ' 86' ' ' PRO . . . 69.99 35.32 71.7 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.863 -0.684 . . . . 20.0 112.059 -178.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . 0.632 ' CD ' ' N ' ' A' ' 85' ' ' GLY . 90.9 Cg_endo -76.9 135.33 15.58 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.721 2.281 . . . . 20.0 112.395 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.456 ' O ' HD23 ' A' ' 89' ' ' LEU . . . -109.32 -25.0 10.8 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.202 -0.454 . . . . 20.0 110.644 179.185 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . 0.413 ' C ' HD11 ' A' ' 89' ' ' LEU . 20.4 tpt180 -85.08 97.54 9.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.819 -0.628 . . . . 20.0 110.529 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.557 ' CB ' ' O ' ' A' ' 102' ' ' PRO . 0.3 OUTLIER -96.42 118.14 32.34 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.89 -0.595 . . . . 20.0 110.052 179.888 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 5.4 mt -113.0 117.3 46.25 Favored Pre-proline 0 CA--C 1.533 0.315 0 N-CA-C 112.331 0.493 . . . . 20.0 112.331 -178.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.609 ' CG ' ' CD1' ' A' ' 100' ' ' TRP . 25.7 Cg_endo -62.03 136.63 62.1 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.742 2.295 . . . . 20.0 111.1 178.481 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.599 ' O ' ' CH2' ' A' ' 99' ' ' TRP . 26.3 m120 -100.65 148.23 25.08 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 113.279 0.844 . . . . 20.0 113.279 -178.154 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.672 ' HA ' ' CZ3' ' A' ' 100' ' ' TRP . . . -84.06 -18.39 37.15 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.073 -0.967 . . . . 20.0 112.315 179.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.659 ' CD1' ' CH2' ' A' ' 99' ' ' TRP . 22.4 mt 27.68 35.19 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 121.225 0.536 . . . . 20.0 111.565 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . 0.601 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 96.99 -50.72 1.49 Allowed Glycine 0 CA--C 1.521 0.445 0 CA-C-N 115.714 -0.676 . . . . 20.0 112.829 -179.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.598 ' O ' ' CZ2' ' A' ' 99' ' ' TRP . 42.9 mmt180 -114.13 142.92 45.61 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.6 0.2 . . . . 20.0 110.465 179.558 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.57 HG13 ' CZ3' ' A' ' 100' ' ' TRP . 10.9 t -122.05 134.18 66.12 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.78 0 CA-C-O 121.829 0.823 . . . . 20.0 111.924 179.509 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.44 ' HG2' ' C ' ' A' ' 97' ' ' VAL . 0.4 OUTLIER 162.91 -30.4 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 114.003 -1.453 . . . . 20.0 108.877 -179.481 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.659 ' CH2' ' CD1' ' A' ' 94' ' ' ILE . 25.0 p-90 -96.76 28.8 3.27 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 113.482 -1.69 . . . . 20.0 110.243 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' TRP . . . . . 0.706 ' HA ' ' CE3' ' A' ' 100' ' ' TRP . 0.0 OUTLIER -34.52 136.0 0.16 Allowed 'General case' 0 CA--C 1.501 -0.916 0 CA-C-O 121.978 0.894 . . . . 20.0 112.883 -177.213 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.409 ' O ' ' HA ' ' A' ' 91' ' ' PRO . 0.0 OUTLIER -122.56 82.55 47.59 Favored Pre-proline 0 N--CA 1.437 -1.111 0 CA-C-N 113.871 -1.513 . . . . 20.0 110.616 179.931 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.557 ' O ' ' CB ' ' A' ' 89' ' ' LEU . 24.3 Cg_exo -62.62 -6.56 9.12 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.606 2.204 . . . . 20.0 112.071 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . 0.44 ' C ' ' HB3' ' A' ' 89' ' ' LEU . 21.1 t-20 -59.68 -34.15 72.49 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.888 0.375 . . . . 20.0 110.304 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 102.95 153.18 24.23 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.894 -0.67 . . . . 20.0 112.991 179.543 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -61.92 168.53 8.71 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 123.243 2.628 . . . . 20.0 112.016 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -63.94 97.91 0.19 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.944 0.402 . . . . 20.0 110.918 -179.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . 0.631 ' O ' ' CB ' ' A' ' 108' ' ' ARG . 13.2 m-85 -112.85 138.07 50.25 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.932 -0.576 . . . . 20.0 111.6 -179.788 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.631 ' CB ' ' O ' ' A' ' 107' ' ' PHE . 42.0 ttm180 112.22 67.18 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 O-C-N 124.112 0.882 . . . . 20.0 111.316 179.084 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.528 ' CB ' ' HB3' ' A' ' 54' ' ' SER . 0.5 OUTLIER 170.94 110.51 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.442 -0.344 . . . . 20.0 111.439 179.613 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.523 ' CG2' ' HB2' ' A' ' 143' ' ' LYS . 0.1 OUTLIER -147.83 141.61 15.8 Favored Pre-proline 0 CA--C 1.531 0.237 0 CA-C-O 120.888 0.375 . . . . 20.0 110.686 179.189 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.518 ' CB ' HG12 ' A' ' 137' ' ' VAL . 13.4 Cg_endo -55.44 138.99 81.66 Favored 'Trans proline' 0 N--CA 1.466 -0.137 0 C-N-CA 122.93 2.42 . . . . 20.0 111.896 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.458 ' OD2' ' HB3' ' A' ' 141' ' ' LYS . 83.4 m-20 -125.59 -56.1 1.51 Allowed 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.935 -0.306 . . . . 20.0 111.668 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.539 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 38.9 ttm180 -118.07 151.95 36.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.734 0.302 . . . . 20.0 111.493 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.58 ' CD2' HG13 ' A' ' 137' ' ' VAL . 2.5 m-85 -127.82 164.18 22.76 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.611 0.72 . . . . 20.0 111.699 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.409 ' N ' ' O ' ' A' ' 136' ' ' LEU . 49.0 ttm-85 -99.21 145.27 27.42 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 114.732 -1.122 . . . . 20.0 108.078 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -90.59 115.11 27.47 Favored 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 120.164 -0.614 . . . . 20.0 111.187 -179.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -132.22 137.3 47.51 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.068 -0.514 . . . . 20.0 111.352 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . 0.47 ' HG2' ' HA ' ' A' ' 133' ' ' LYS . 87.6 mtt-85 -127.94 111.9 14.09 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.686 -0.688 . . . . 20.0 109.946 179.455 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.544 ' O ' ' CD1' ' A' ' 64' ' ' LEU . 38.8 t -127.46 146.23 33.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 116.188 -0.46 . . . . 20.0 111.89 -178.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.562 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 28.3 mp0 -78.15 131.34 37.17 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 116.208 -0.451 . . . . 20.0 111.13 -179.799 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.605 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.3 OUTLIER -79.3 122.13 25.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 20.0 109.984 179.569 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.75 136.71 34.06 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.383 0.611 . . . . 20.0 111.851 -178.421 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . 0.505 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -111.39 158.52 35.98 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 115.359 -0.837 . . . . 20.0 109.986 179.289 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . 0.498 ' HD2' ' SG ' ' A' ' 123' ' ' CYS . 51.3 Cg_exo -52.23 110.71 0.48 Allowed 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 121.942 1.761 . . . . 20.0 111.347 -179.641 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 98.7 -13.17 62.66 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.941 -0.647 . . . . 20.0 111.732 -179.003 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 66.03 56.4 14.44 Favored Glycine 0 C--N 1.333 0.397 0 C-N-CA 120.987 -0.625 . . . . 20.0 112.912 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -120.12 -23.47 6.29 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.399 0.518 . . . . 20.0 112.399 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -121.29 57.08 6.42 Favored Pre-proline 0 C--N 1.33 -0.254 0 N-CA-C 112.269 0.47 . . . . 20.0 112.269 -179.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . 0.472 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 37.7 Cg_endo -67.4 141.46 56.24 Favored 'Trans proline' 0 CA--C 1.528 0.221 0 C-N-CA 122.512 2.141 . . . . 20.0 111.722 178.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.562 ' O ' ' HA ' ' A' ' 120' ' ' GLN . 84.5 mtt180 -139.64 136.47 34.36 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 121.019 -0.272 . . . . 20.0 111.511 -179.578 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 28.1 t -88.1 133.75 33.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.85 0.357 . . . . 20.0 111.43 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . 0.464 ' HD3' ' HB2' ' A' ' 64' ' ' LEU . 58.1 ttt85 -139.94 138.08 35.29 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.119 -0.491 . . . . 20.0 111.783 -179.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.47 ' HA ' ' HG2' ' A' ' 118' ' ' ARG . 12.0 pttt -87.08 142.94 27.55 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.103 -0.498 . . . . 20.0 110.122 179.015 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . 0.44 HG12 ' CD2' ' A' ' 136' ' ' LEU . 15.6 t -142.58 126.03 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 CA-C-O 121.284 0.564 . . . . 20.0 111.477 -179.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.48 ' O ' ' CD2' ' A' ' 114' ' ' TYR . 99.7 mtt180 -95.13 99.07 11.11 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.152 -0.931 . . . . 20.0 109.265 178.148 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.579 ' N ' ' HB3' ' A' ' 114' ' ' TYR . 5.3 mt -104.78 133.85 48.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.461 0.648 . . . . 20.0 112.502 -179.335 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.58 HG13 ' CD2' ' A' ' 114' ' ' TYR . 0.3 OUTLIER -68.93 89.34 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.286 -0.87 . . . . 20.0 112.106 -179.587 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -72.32 -12.6 61.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.333 0.587 . . . . 20.0 109.481 178.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 5.6 t -161.31 129.88 4.45 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 115.246 -0.888 . . . . 20.0 110.303 179.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' CYS . . . . . 0.518 ' CB ' ' HA ' ' A' ' 111' ' ' PRO . 26.0 p -126.42 159.99 31.74 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.789 0.328 . . . . 20.0 110.968 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.458 ' HB3' ' OD2' ' A' ' 112' ' ' ASP . 12.4 ttpt -123.55 158.95 30.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.305 -0.407 . . . . 20.0 110.651 -179.582 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . 0.536 ' O ' ' HD3' ' A' ' 143' ' ' LYS . 0.0 OUTLIER -55.78 109.23 0.54 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.981 0.419 . . . . 20.0 110.729 -179.263 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.536 ' HD3' ' O ' ' A' ' 142' ' ' CYS . 25.8 mmtt -139.42 144.64 38.19 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.474 -0.785 . . . . 20.0 110.659 178.363 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.661 ' HA ' ' HA ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.045 -0.979 . . . . 20.0 111.042 -179.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.447 ' HG2' ' O ' ' A' ' 48' ' ' LYS . 81.6 tttt . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.915 0.388 . . . . 20.0 111.025 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 89.7 m-20 -86.74 17.09 4.19 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.033 -0.53 . . . . 20.0 111.831 -179.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 34.7 m -81.1 -13.78 12.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.126 0.488 . . . . 20.0 110.299 178.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 88.2 p -81.92 -8.94 59.71 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.4 -0.818 . . . . 20.0 110.891 179.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.477 ' OE1' ' OE1' ' A' ' 83' ' ' GLN . 78.9 mt-10 -88.1 3.25 49.79 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.259 -0.428 . . . . 20.0 110.934 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.564 ' CD2' ' SG ' ' A' ' 142' ' ' CYS . 3.5 m-85 -85.92 25.73 1.08 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.101 -0.5 . . . . 20.0 111.353 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.434 ' C ' ' SG ' ' A' ' 55' ' ' CYS . 34.7 t -60.27 108.33 0.78 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.103 0.478 . . . . 20.0 111.145 -179.058 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.434 ' SG ' ' C ' ' A' ' 54' ' ' SER . 3.5 m -159.44 26.04 0.19 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.573 -0.74 . . . . 20.0 110.265 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.485 ' O ' ' N ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -57.46 155.18 9.74 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.058 -0.519 . . . . 20.0 111.623 -179.46 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.47 ' HA ' ' CD2' ' A' ' 78' ' ' LEU . 85.4 tt0 -52.04 85.44 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.896 -0.593 . . . . 20.0 111.08 -179.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.604 ' CD1' HG23 ' A' ' 79' ' ' VAL . 8.3 tt -96.42 151.46 19.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.017 -0.538 . . . . 20.0 110.934 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.594 ' CE1' HG22 ' A' ' 76' ' ' THR . 30.0 m170 -128.02 133.24 49.1 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.022 0.379 . . . . 20.0 112.022 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.557 ' CZ ' HG13 ' A' ' 79' ' ' VAL . 0.2 OUTLIER -153.55 168.67 25.38 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.24 -0.436 . . . . 20.0 111.198 179.514 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.627 ' CG2' ' CZ ' ' A' ' 63' ' ' PHE . 32.3 m -93.8 126.58 39.07 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.87 0.843 . . . . 20.0 112.912 -178.434 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.483 ' CG ' ' O ' ' A' ' 61' ' ' THR . 40.7 mtm180 -169.43 121.01 0.72 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.21 -1.359 . . . . 20.0 108.038 177.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.627 ' CZ ' ' CG2' ' A' ' 61' ' ' THR . 0.0 OUTLIER -120.28 -81.04 0.63 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 113.027 0.751 . . . . 20.0 113.027 -178.047 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.623 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -166.58 139.68 3.85 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.169 0.433 . . . . 20.0 112.169 -177.756 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.466 ' O ' ' OD1' ' A' ' 66' ' ' ASP . 68.9 p -133.42 128.29 35.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.805 -0.634 . . . . 20.0 110.232 178.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.531 ' O ' ' C ' ' A' ' 67' ' ' GLY . 73.6 m-20 -139.42 -165.06 1.79 Allowed 'General case' 0 C--O 1.236 0.346 0 N-CA-C 110.011 -0.366 . . . . 20.0 110.011 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.833 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -29.59 144.61 0.01 OUTLIER Glycine 0 C--N 1.344 0.988 0 CA-C-O 118.798 -1.001 . . . . 20.0 110.733 179.47 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.504 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 39.0 Cg_exo -14.91 54.51 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.723 1 C-N-CA 125.949 4.433 . . . . 20.0 115.106 -178.756 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.833 ' N ' ' O ' ' A' ' 67' ' ' GLY . 17.1 m -163.27 157.67 20.55 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.138 -1.06 . . . . 20.0 108.138 178.677 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -145.98 146.92 31.19 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.091 0.472 . . . . 20.0 112.042 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.623 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -89.23 160.72 16.79 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 115.512 -0.767 . . . . 20.0 109.955 178.861 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -149.87 28.49 0.76 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 114.21 1.189 . . . . 20.0 114.21 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.589 ' O ' ' CD2' ' A' ' 63' ' ' PHE . 17.3 tttt -73.72 140.48 78.18 Favored Pre-proline 0 C--N 1.328 -0.332 0 C-N-CA 120.551 -0.459 . . . . 20.0 110.164 178.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.499 ' HD2' ' HG2' ' A' ' 73' ' ' LYS . 63.9 Cg_exo -51.34 125.87 17.7 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 122.392 2.061 . . . . 20.0 112.419 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.49 HG23 ' CD2' ' A' ' 63' ' ' PHE . 26.3 m -133.63 163.25 37.97 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.159 0 CA-C-O 121.123 0.487 . . . . 20.0 112.033 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.594 HG22 ' CE1' ' A' ' 59' ' ' HIS . 0.2 OUTLIER -136.76 100.37 4.3 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.635 -0.711 . . . . 20.0 109.916 178.944 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.493 ' O ' ' HA ' ' A' ' 59' ' ' HIS . 83.5 mt-10 -114.43 162.98 15.96 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.1 -0.5 . . . . 20.0 111.568 -178.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.528 ' HA ' ' O ' ' A' ' 58' ' ' LEU . 5.6 mp -111.1 142.35 43.39 Favored 'General case' 0 CA--C 1.512 -0.498 0 CA-C-O 121.355 0.598 . . . . 20.0 111.302 179.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.604 HG23 ' CD1' ' A' ' 58' ' ' LEU . 7.7 m -103.26 84.81 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 115.294 -0.866 . . . . 20.0 110.718 -179.279 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -86.15 106.97 17.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.944 -0.571 . . . . 20.0 110.801 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 25.6 p -141.08 113.76 8.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.008 -0.542 . . . . 20.0 110.7 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -169.77 -173.92 37.64 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.382 -0.913 . . . . 20.0 112.756 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.496 ' HA ' ' HA ' ' A' ' 108' ' ' ARG . 62.6 tt0 -117.83 139.77 50.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.66 0.267 . . . . 20.0 110.415 179.047 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.495 ' O ' ' O ' ' A' ' 85' ' ' GLY . 38.6 m -120.59 154.38 35.49 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 120.938 0.399 . . . . 20.0 111.732 -179.205 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . 0.495 ' O ' ' O ' ' A' ' 84' ' ' CYS . . . 48.98 167.94 0.01 OUTLIER Glycine 0 C--N 1.332 0.358 0 CA-C-N 115.732 -0.667 . . . . 20.0 112.957 179.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_exo -62.25 162.5 23.19 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.801 2.334 . . . . 20.0 112.208 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.407 ' O ' HD22 ' A' ' 89' ' ' LEU . . . -85.95 12.24 9.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.096 -0.502 . . . . 20.0 111.496 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 20.8 tpt180 -70.56 131.52 44.1 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.55 -0.295 . . . . 20.0 110.31 179.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.49 ' N ' HD22 ' A' ' 89' ' ' LEU . 1.1 mm? -100.0 122.7 43.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.531 -0.304 . . . . 20.0 110.859 -179.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.401 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 5.6 tp -114.14 109.31 49.43 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-O 120.731 0.3 . . . . 20.0 111.408 179.661 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.51 ' CG ' ' CD1' ' A' ' 100' ' ' TRP . 18.6 Cg_endo -60.35 113.88 1.87 Allowed 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.765 2.31 . . . . 20.0 111.474 179.113 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.428 ' O ' HD13 ' A' ' 94' ' ' ILE . 12.8 m120 -97.48 141.31 30.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.828 0.347 . . . . 20.0 111.872 -178.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.521 ' O ' ' N ' ' A' ' 95' ' ' GLY . . . -87.16 0.86 54.64 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-N 116.265 -0.425 . . . . 20.0 111.818 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.478 HD12 ' CH2' ' A' ' 99' ' ' TRP . 2.3 mp 34.69 31.63 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.516 0.674 . . . . 20.0 111.657 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 120.15 -49.76 0.86 Allowed Glycine 0 CA--C 1.524 0.62 0 CA-C-N 114.926 -1.034 . . . . 20.0 113.576 179.339 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.62 ' O ' ' CZ2' ' A' ' 99' ' ' TRP . 31.6 ttp180 -116.12 150.46 37.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.742 0.271 . . . . 20.0 110.278 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.585 HG12 ' CH2' ' A' ' 100' ' ' TRP . 2.2 t -123.93 116.96 49.52 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.355 0 CA-C-O 121.778 0.799 . . . . 20.0 111.943 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.573 ' HG3' ' HD1' ' A' ' 99' ' ' TRP . 0.5 OUTLIER 171.88 38.49 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.368 -1.287 . . . . 20.0 108.772 -179.218 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.62 ' CZ2' ' O ' ' A' ' 96' ' ' ARG . 4.0 p-90 -178.63 52.12 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.142 -0.935 . . . . 20.0 109.328 -177.216 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' TRP . . . . . 0.699 ' HA ' ' CE3' ' A' ' 100' ' ' TRP . 0.0 OUTLIER -53.92 138.26 37.02 Favored 'General case' 0 CA--C 1.498 -1.026 0 CA-C-O 122.494 1.14 . . . . 20.0 113.983 -176.82 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.407 ' C ' ' HB3' ' A' ' 91' ' ' PRO . 0.0 OUTLIER -122.47 83.22 47.16 Favored Pre-proline 0 N--CA 1.435 -1.184 0 CA-C-N 113.144 -1.844 . . . . 20.0 109.855 179.528 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.448 ' O ' ' CB ' ' A' ' 89' ' ' LEU . 13.2 Cg_endo -56.67 -10.52 5.38 Favored 'Trans proline' 0 CA--C 1.53 0.312 0 C-N-CA 123.293 2.662 . . . . 20.0 112.72 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . 0.426 ' C ' ' HB3' ' A' ' 89' ' ' LEU . 29.2 m120 -58.06 -34.26 69.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.303 -0.408 . . . . 20.0 111.726 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 67.36 157.45 0.74 Allowed Glycine 0 N--CA 1.453 -0.208 0 C-N-CA 120.406 -0.902 . . . . 20.0 112.201 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.579 ' O ' ' CE2' ' A' ' 107' ' ' PHE . 10.0 Cg_exo -70.11 143.5 49.37 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.701 2.267 . . . . 20.0 111.943 179.798 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -70.04 127.76 33.98 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.119 -0.326 . . . . 20.0 110.119 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . 0.579 ' CE2' ' O ' ' A' ' 105' ' ' PRO . 55.8 m-85 -113.1 136.05 53.13 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.769 0.319 . . . . 20.0 111.543 -179.299 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.496 ' HA ' ' HA ' ' A' ' 83' ' ' GLN . 29.6 ptt-85 -173.12 175.45 3.2 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.35 -0.386 . . . . 20.0 110.957 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.439 ' HA ' ' HA ' ' A' ' 142' ' ' CYS . 46.5 t -70.02 112.21 6.25 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.204 -0.665 . . . . 20.0 109.204 179.07 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.491 HG23 ' HD2' ' A' ' 111' ' ' PRO . 7.9 mt -109.49 138.39 20.55 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.115 0.483 . . . . 20.0 111.721 -178.615 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.58 ' CB ' ' CG1' ' A' ' 137' ' ' VAL . 20.3 Cg_endo -61.55 139.95 84.37 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 123.071 2.514 . . . . 20.0 111.272 178.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -100.11 -68.79 0.79 Allowed 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.552 0.575 . . . . 20.0 112.552 -179.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.44 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 60.9 ttm-85 -122.99 142.72 50.53 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.436 -0.347 . . . . 20.0 111.376 -179.017 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.503 ' CE2' HG13 ' A' ' 137' ' ' VAL . 0.7 OUTLIER -118.61 158.1 26.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.093 0.473 . . . . 20.0 111.296 -179.61 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.402 ' HB2' ' HB1' ' A' ' 138' ' ' ALA . 55.0 ttm-85 -97.29 141.63 30.16 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.807 -0.812 . . . . 20.0 108.807 178.345 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -77.66 128.15 33.62 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.878 0.37 . . . . 20.0 111.859 -178.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.489 ' HG2' HD22 ' A' ' 136' ' ' LEU . 89.6 mm-40 -126.99 137.15 53.05 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.117 -0.492 . . . . 20.0 111.233 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -133.94 94.23 3.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.971 -0.559 . . . . 20.0 110.451 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.555 ' O ' ' CD1' ' A' ' 64' ' ' LEU . 29.1 t -123.81 147.64 28.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.351 -0.386 . . . . 20.0 110.49 179.622 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.54 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 20.0 pt20 -94.37 133.87 37.47 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.42 -0.512 . . . . 20.0 110.71 -179.594 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.603 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -77.33 118.65 20.02 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.421 0.629 . . . . 20.0 110.851 -179.717 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.16 140.86 37.66 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.002 -0.999 . . . . 20.0 111.124 -179.328 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . 0.504 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.3 OUTLIER -114.38 150.33 43.6 Favored Pre-proline 0 N--CA 1.446 -0.673 0 CA-C-N 115.619 -0.719 . . . . 20.0 109.578 179.128 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . 0.443 ' HD2' ' SG ' ' A' ' 123' ' ' CYS . 59.4 Cg_exo -50.89 112.72 0.84 Allowed 'Trans proline' 0 N--CA 1.465 -0.2 0 C-N-CA 122.252 1.968 . . . . 20.0 112.147 -178.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 92.66 2.03 67.73 Favored Glycine 0 N--CA 1.449 -0.451 0 CA-C-N 115.547 -0.751 . . . . 20.0 111.736 -179.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 45.4 83.5 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 121.078 -0.582 . . . . 20.0 112.788 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.435 ' O ' ' HD2' ' A' ' 129' ' ' PRO . . . -116.63 -68.99 0.88 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.87 0.335 . . . . 20.0 111.775 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -118.06 60.74 3.79 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-O 120.976 0.417 . . . . 20.0 111.892 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . 0.435 ' HD2' ' O ' ' A' ' 127' ' ' ALA . 3.3 Cg_endo -46.37 155.32 0.72 Allowed 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 123.059 2.506 . . . . 20.0 111.458 178.913 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.54 ' O ' ' HA ' ' A' ' 120' ' ' GLN . 72.4 mtt85 -130.0 154.35 47.48 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.434 -0.348 . . . . 20.0 110.541 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.507 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 29.7 m -107.19 140.81 39.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.719 0.295 . . . . 20.0 110.392 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . 0.486 ' HD3' ' CB ' ' A' ' 64' ' ' LEU . 56.6 ttt85 -141.92 142.64 33.04 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.162 0.506 . . . . 20.0 112.203 -179.353 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.432 ' O ' HG21 ' A' ' 134' ' ' VAL . 7.5 pttt -93.3 143.95 25.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.492 -0.776 . . . . 20.0 109.076 178.159 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . 0.458 HG22 ' O ' ' A' ' 63' ' ' PHE . 3.1 t -143.99 121.15 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 CA-C-O 121.164 0.507 . . . . 20.0 111.805 -178.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.4 ' HB3' ' HB2' ' A' ' 114' ' ' TYR . 87.3 mtm-85 -92.26 112.66 24.69 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.321 -0.854 . . . . 20.0 109.289 178.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.54 ' N ' ' CD2' ' A' ' 136' ' ' LEU . 1.6 mm? -113.98 123.78 50.54 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.337 0.589 . . . . 20.0 112.279 -178.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.58 ' CG1' ' CB ' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -57.5 84.39 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.411 -0.813 . . . . 20.0 111.672 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . 0.488 ' HA ' ' CD1' ' A' ' 78' ' ' LEU . . . -69.83 -16.12 63.22 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.408 -0.517 . . . . 20.0 109.818 178.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.0 t -153.83 117.67 4.73 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.748 -0.66 . . . . 20.0 110.511 178.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' CYS . . . . . . . . . . . . . 9.3 p -135.49 159.37 41.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.324 0.583 . . . . 20.0 112.281 -179.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -142.0 144.05 33.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.259 -0.882 . . . . 20.0 109.622 178.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . 0.564 ' SG ' ' CD2' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -69.96 95.41 0.93 Allowed 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.879 -0.328 . . . . 20.0 110.802 -179.886 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.513 ' O ' ' HB2' ' A' ' 144' ' ' ARG . 19.1 tptp -139.3 136.55 34.99 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-N 116.303 -0.408 . . . . 20.0 111.102 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.513 ' HB2' ' O ' ' A' ' 143' ' ' LYS . 51.1 mtp85 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.229 -0.891 . . . . 20.0 110.794 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 19.3 mttt . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.779 0.323 . . . . 20.0 110.895 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -84.58 14.93 4.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.16 -0.473 . . . . 20.0 111.495 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.496 ' O ' ' CG1' ' A' ' 50' ' ' VAL . 52.9 t -74.85 -3.84 5.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.451 -0.341 . . . . 20.0 111.166 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 78.5 p -64.8 -22.66 67.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.132 0.491 . . . . 20.0 110.083 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.519 ' O ' ' HB ' ' A' ' 79' ' ' VAL . 95.4 mt-10 -90.54 10.65 24.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.555 -0.748 . . . . 20.0 110.263 178.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.714 ' CB ' ' HB2' ' A' ' 81' ' ' SER . 1.7 t80 -121.36 -36.17 3.13 Favored 'General case' 0 C--O 1.208 -1.108 0 N-CA-C 112.468 0.544 . . . . 20.0 112.468 -178.077 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.594 ' HA ' ' HB3' ' A' ' 81' ' ' SER . 11.4 m -33.14 114.74 0.18 Allowed 'General case' 0 N--CA 1.482 1.145 0 O-C-N 121.23 -0.919 . . . . 20.0 112.459 -179.039 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.522 ' HB3' ' HA ' ' A' ' 80' ' ' CYS . 0.6 OUTLIER -76.69 97.87 4.58 Favored 'General case' 0 C--N 1.351 0.654 0 CA-C-O 121.155 0.502 . . . . 20.0 110.245 -179.824 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.559 ' CD ' ' CD1' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -138.28 -151.55 0.39 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.44 -0.8 . . . . 20.0 110.786 -179.24 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -86.5 15.86 5.12 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.248 -0.433 . . . . 20.0 111.007 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.592 ' HG ' ' CG2' ' A' ' 79' ' ' VAL . 0.0 OUTLIER -81.07 157.16 25.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.476 0.655 . . . . 20.0 112.542 -179.163 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.462 ' CD2' ' HG ' ' A' ' 78' ' ' LEU . 5.0 m170 -146.69 143.99 29.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.345 -0.843 . . . . 20.0 110.078 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.584 ' CZ ' HG13 ' A' ' 79' ' ' VAL . 17.8 m-30 -119.89 145.84 46.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.938 0.399 . . . . 20.0 111.355 -179.649 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 26.9 p -109.56 88.97 2.87 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.939 -0.573 . . . . 20.0 111.743 -179.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.505 ' O ' ' CG2' ' A' ' 75' ' ' VAL . 64.3 ttt-85 -119.94 122.37 41.07 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.445 -0.946 . . . . 20.0 108.445 177.847 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.598 ' CD1' ' O ' ' A' ' 73' ' ' LYS . 0.2 OUTLIER -105.22 -81.2 0.54 Allowed 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.779 0.659 . . . . 20.0 112.779 -177.538 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.619 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -170.21 139.9 1.83 Allowed 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.566 -0.454 . . . . 20.0 111.828 -178.617 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.502 ' CG2' ' HG3' ' A' ' 70' ' ' ARG . 29.6 p -134.19 132.22 39.5 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.9 -0.591 . . . . 20.0 110.579 179.062 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.539 ' O ' ' C ' ' A' ' 67' ' ' GLY . 94.0 m-20 -141.98 -163.76 1.65 Allowed 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.946 -0.39 . . . . 20.0 109.946 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.812 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -28.47 144.41 0.01 OUTLIER Glycine 0 C--N 1.346 1.113 0 CA-C-O 118.736 -1.036 . . . . 20.0 110.633 179.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.551 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 50.1 Cg_exo -15.78 57.13 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.78 1 C-N-CA 125.373 4.049 . . . . 20.0 115.271 -178.53 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.812 ' N ' ' O ' ' A' ' 67' ' ' GLY . 81.5 m -164.98 164.16 20.67 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 108.625 -0.88 . . . . 20.0 108.625 178.4 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.502 ' HG3' ' CG2' ' A' ' 65' ' ' THR . 54.6 ttt180 -152.29 143.34 23.11 Favored 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 112.377 0.51 . . . . 20.0 112.377 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.619 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -86.06 161.48 18.91 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 115.718 -0.674 . . . . 20.0 110.844 179.156 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . 0.522 ' HA ' ' CD2' ' A' ' 63' ' ' PHE . . . -140.64 29.29 1.94 Allowed 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 113.0 0.741 . . . . 20.0 113.0 -179.576 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.598 ' O ' ' CD1' ' A' ' 63' ' ' PHE . 4.9 tmtm? -73.4 133.29 80.73 Favored Pre-proline 0 C--N 1.329 -0.316 0 C-N-CA 120.958 -0.297 . . . . 20.0 110.335 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . 0.464 ' HD2' ' HG2' ' A' ' 73' ' ' LYS . 50.7 Cg_exo -54.58 122.39 11.48 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.655 2.237 . . . . 20.0 112.356 -179.643 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.505 ' CG2' ' O ' ' A' ' 62' ' ' ARG . 5.1 m -135.54 159.57 40.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.852 -0.613 . . . . 20.0 111.167 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 38.8 m -118.57 128.78 54.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.083 0.468 . . . . 20.0 110.858 178.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.517 ' HB3' ' HB2' ' A' ' 60' ' ' TYR . 84.8 tt0 -131.54 139.2 49.19 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.642 -0.708 . . . . 20.0 110.031 179.314 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.576 ' N ' ' CD1' ' A' ' 78' ' ' LEU . 1.0 OUTLIER -111.37 144.32 40.75 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.307 0.575 . . . . 20.0 112.127 -179.05 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.599 ' O ' ' CG2' ' A' ' 79' ' ' VAL . 0.7 OUTLIER -100.25 93.89 3.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 108.252 -1.018 . . . . 20.0 108.252 178.612 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.647 ' C ' ' O ' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -95.59 118.59 32.58 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.814 1.042 . . . . 20.0 113.814 -176.312 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.844 ' N ' ' HB2' ' A' ' 109' ' ' CYS . 8.3 t -161.45 95.69 1.03 Allowed 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.384 -0.825 . . . . 20.0 111.314 177.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.508 ' N ' ' SG ' ' A' ' 55' ' ' CYS . . . -159.09 -154.83 7.39 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.786 -0.721 . . . . 20.0 112.108 -179.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -120.97 160.14 24.13 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.748 0.309 . . . . 20.0 110.659 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.406 ' HB2' ' HB2' ' A' ' 142' ' ' CYS . 0.0 OUTLIER -136.29 -41.73 0.64 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.33 -0.395 . . . . 20.0 111.055 -179.823 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -109.16 170.44 14.53 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.811 -0.709 . . . . 20.0 112.766 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -50.8 151.5 10.98 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.839 2.359 . . . . 20.0 112.425 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.54 ' CA ' ' HG3' ' A' ' 105' ' ' PRO . . . -83.01 14.03 3.61 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.001 -0.545 . . . . 20.0 111.553 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -67.62 133.45 49.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.846 0.355 . . . . 20.0 110.646 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.475 HD21 ' O ' ' A' ' 87' ' ' ALA . 1.3 mm? -97.27 129.93 44.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.259 -0.428 . . . . 20.0 110.933 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.5 mt -115.8 92.0 32.59 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.18 -0.464 . . . . 20.0 110.982 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.573 ' HA ' ' CZ2' ' A' ' 100' ' ' TRP . 76.1 Cg_exo -47.98 90.6 0.02 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.208 0 C-N-CA 122.562 2.175 . . . . 20.0 112.562 -179.72 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.571 ' O ' ' CZ2' ' A' ' 99' ' ' TRP . 63.3 t30 -140.35 68.88 1.35 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.19 -0.459 . . . . 20.0 110.991 179.57 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.551 ' HA ' ' CZ3' ' A' ' 100' ' ' TRP . . . -66.6 -9.62 37.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.97 -0.559 . . . . 20.0 111.496 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.528 ' O ' ' CG2' ' A' ' 94' ' ' ILE . 9.7 mt 33.25 31.7 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.037 0.446 . . . . 20.0 111.236 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . 0.529 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 95.96 -41.39 2.44 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.839 -0.619 . . . . 20.0 112.535 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.481 ' N ' ' O ' ' A' ' 93' ' ' ALA . 61.3 ttm-85 -123.82 135.99 54.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.66 0.267 . . . . 20.0 111.109 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.552 ' CG1' ' HD3' ' A' ' 101' ' ' ARG . 17.6 t -110.85 128.46 67.23 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.729 0 CA-C-O 121.702 0.763 . . . . 20.0 110.368 179.141 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.468 ' HE3' ' HD2' ' A' ' 96' ' ' ARG . 1.0 OUTLIER -160.16 20.22 0.15 Allowed 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 114.428 -1.26 . . . . 20.0 111.086 -179.137 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.624 ' N ' ' CD1' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -150.07 -100.02 0.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.774 0.287 . . . . 20.0 111.774 -178.121 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' TRP . . . . . 0.573 ' CZ2' ' HA ' ' A' ' 91' ' ' PRO . 0.0 OUTLIER -60.04 175.22 0.42 Allowed 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.573 -0.285 . . . . 20.0 110.282 179.81 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . 0.552 ' HD3' ' CG1' ' A' ' 97' ' ' VAL . 0.0 OUTLIER 155.55 150.07 0.0 OUTLIER Pre-proline 0 C--N 1.334 -0.097 0 CA-C-N 116.076 -0.511 . . . . 20.0 111.618 178.494 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.53 ' HD2' ' NE ' ' A' ' 101' ' ' ARG . 10.0 Cg_endo -52.45 -13.12 2.02 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 123.774 2.982 . . . . 20.0 113.481 -179.642 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -81.87 8.65 9.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.874 0.368 . . . . 20.0 110.946 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 127.12 149.73 7.29 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 121.081 -0.58 . . . . 20.0 112.423 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . 0.54 ' HG3' ' CA ' ' A' ' 87' ' ' ALA . 98.2 Cg_endo -83.45 133.72 6.36 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 122.96 2.44 . . . . 20.0 112.512 -179.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.478 ' O ' ' CD2' ' A' ' 107' ' ' PHE . 84.1 m-20 -84.9 130.44 34.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.12 0.486 . . . . 20.0 111.417 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . 0.483 ' O ' ' O ' ' A' ' 82' ' ' GLY . 74.7 m-85 -162.15 26.54 0.11 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.62 -0.718 . . . . 20.0 110.065 179.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.532 ' O ' ' N ' ' A' ' 143' ' ' LYS . 97.2 mtt180 -45.69 162.96 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.403 -0.817 . . . . 20.0 111.938 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.844 ' HB2' ' N ' ' A' ' 81' ' ' SER . 15.2 m -95.34 106.3 18.34 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.976 -1.011 . . . . 20.0 109.526 178.565 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.549 ' HA ' ' OH ' ' A' ' 53' ' ' TYR . 0.6 OUTLIER -108.08 149.04 38.63 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-O 121.314 0.578 . . . . 20.0 111.996 -179.677 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.577 ' CB ' ' CG1' ' A' ' 137' ' ' VAL . 19.9 Cg_endo -60.73 130.2 32.24 Favored 'Trans proline' 0 N--CA 1.466 -0.144 0 C-N-CA 122.974 2.45 . . . . 20.0 111.725 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -97.16 -68.58 0.79 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.803 0.335 . . . . 20.0 111.752 -179.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.46 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 35.1 ttm180 -122.97 147.47 46.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.284 -0.416 . . . . 20.0 110.909 -179.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.585 ' CE2' HG11 ' A' ' 137' ' ' VAL . 0.5 OUTLIER -120.73 155.93 32.89 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.404 0.621 . . . . 20.0 111.558 -179.456 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.423 ' HD2' ' NE2' ' A' ' 117' ' ' GLN . 48.3 ttm-85 -95.11 142.66 27.3 Favored 'General case' 0 N--CA 1.443 -0.785 0 N-CA-C 108.327 -0.99 . . . . 20.0 108.327 177.982 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . 0.52 ' O ' ' NE2' ' A' ' 117' ' ' GLN . . . -80.51 130.98 35.48 Favored 'General case' 0 C--N 1.315 -0.913 0 C-N-CA 120.662 -0.415 . . . . 20.0 111.365 -178.729 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.52 ' NE2' ' O ' ' A' ' 116' ' ' ALA . 87.8 mm-40 -131.58 127.64 37.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.054 -0.521 . . . . 20.0 111.122 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 80.1 mtm180 -129.38 96.06 4.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.068 -0.514 . . . . 20.0 110.358 179.079 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.55 ' O ' ' CD1' ' A' ' 64' ' ' LEU . 59.5 t -122.1 144.54 31.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.544 -0.753 . . . . 20.0 110.934 -179.472 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.533 ' N ' HG13 ' A' ' 119' ' ' VAL . 24.2 mp0 -82.13 121.48 26.65 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.812 -0.44 . . . . 20.0 109.812 179.621 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.562 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.2 OUTLIER -66.35 126.33 28.43 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.197 0.523 . . . . 20.0 110.649 -179.093 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.523 ' CD1' ' HA ' ' A' ' 71' ' ' SER . 0.9 OUTLIER -91.52 144.08 25.92 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.397 -0.82 . . . . 20.0 111.312 -178.742 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . 0.551 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -108.19 123.27 38.05 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 115.688 -0.687 . . . . 20.0 111.382 -179.663 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -67.34 103.18 0.76 Allowed 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.108 1.872 . . . . 20.0 110.763 178.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 78.46 29.75 51.79 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.457 -0.878 . . . . 20.0 111.35 -178.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . 0.498 ' O ' ' HB3' ' A' ' 123' ' ' CYS . . . -157.27 124.0 1.36 Allowed Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 111.632 -0.587 . . . . 20.0 111.632 -179.763 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.45 ' C ' ' CD ' ' A' ' 129' ' ' PRO . . . -88.29 43.33 1.12 Allowed 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 111.767 0.284 . . . . 20.0 111.767 -179.363 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -113.12 56.76 0.59 Allowed Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.968 0.413 . . . . 20.0 110.605 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . 0.476 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 46.8 Cg_endo -68.2 151.18 77.07 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.934 2.423 . . . . 20.0 112.752 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.484 ' O ' ' HA ' ' A' ' 120' ' ' GLN . 99.7 mtt180 -138.71 151.04 46.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.122 -0.49 . . . . 20.0 110.987 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 10.6 t -91.11 139.21 30.97 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.623 0.249 . . . . 20.0 110.954 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . 0.518 ' HD3' ' CB ' ' A' ' 64' ' ' LEU . 54.6 ttt85 -146.23 143.77 29.44 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.082 0.467 . . . . 20.0 112.086 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 117' ' ' GLN . 25.4 pttm -104.42 142.08 35.22 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.589 -0.732 . . . . 20.0 110.006 178.747 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . 0.481 HG23 HD21 ' A' ' 64' ' ' LEU . 1.8 m -147.58 128.65 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-O 121.276 0.56 . . . . 20.0 110.97 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.516 ' HB3' ' HB2' ' A' ' 114' ' ' TYR . 91.2 mtt-85 -89.62 110.99 21.81 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.282 -0.872 . . . . 20.0 110.315 179.54 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.587 ' N ' ' CD2' ' A' ' 136' ' ' LEU . 0.2 OUTLIER -107.86 127.24 53.55 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.873 0.368 . . . . 20.0 111.067 -179.811 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.585 HG11 ' CE2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -63.05 88.73 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.816 0.341 . . . . 20.0 111.666 -179.941 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.68 -23.88 66.39 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.25 0.548 . . . . 20.0 109.602 179.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 37.0 t -155.21 126.39 7.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.342 -0.844 . . . . 20.0 111.325 179.483 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' CYS . . . . . . . . . . . . . 26.5 p -131.23 164.14 26.22 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.386 -0.37 . . . . 20.0 110.619 179.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . 0.428 ' HG2' ' N ' ' A' ' 142' ' ' CYS . 75.3 tttt -141.54 162.14 36.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.273 -0.421 . . . . 20.0 111.495 -179.576 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . 0.805 ' HA ' ' HA ' ' A' ' 109' ' ' CYS . 0.5 OUTLIER -60.44 106.17 0.51 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.986 -0.552 . . . . 20.0 109.856 179.61 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.549 ' HB2' ' CG1' ' A' ' 110' ' ' ILE . 69.6 mmtt -132.93 141.14 48.2 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 113.261 0.837 . . . . 20.0 113.261 -179.055 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.462 ' HG2' HG23 ' A' ' 110' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.268 -0.872 . . . . 20.0 111.068 179.201 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 93.4 mttt . . . . . 0 N--CA 1.487 1.411 0 CA-C-O 120.699 0.285 . . . . 20.0 110.65 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -89.26 17.75 5.77 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.495 -0.321 . . . . 20.0 111.668 -179.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . 0.519 HG12 ' CB ' ' A' ' 81' ' ' SER . 92.7 t -71.8 -11.22 14.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 120.779 -0.368 . . . . 20.0 111.14 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 72.6 m -59.76 -33.93 72.32 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.152 0.501 . . . . 20.0 109.748 179.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.564 ' O ' ' CG2' ' A' ' 79' ' ' VAL . 96.9 mt-10 -86.29 13.28 8.31 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.381 -0.827 . . . . 20.0 110.647 179.327 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.864 ' O ' ' N ' ' A' ' 81' ' ' SER . 0.3 OUTLIER -128.48 30.32 5.17 Favored 'General case' 0 C--O 1.194 -1.829 0 CA-C-N 116.062 -0.517 . . . . 20.0 111.798 -178.75 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.467 ' O ' ' O ' ' A' ' 79' ' ' VAL . 2.1 m -70.52 131.44 44.01 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 119.973 1.26 . . . . 20.0 112.68 -178.029 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.521 ' HA ' ' CB ' ' A' ' 80' ' ' CYS . 3.9 m -71.03 -29.04 64.85 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 109.673 -0.491 . . . . 20.0 109.673 178.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.456 ' C ' ' O ' ' A' ' 55' ' ' CYS . 0.0 OUTLIER -26.77 -85.21 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.982 -0.554 . . . . 20.0 111.816 -179.435 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 36.8 tp10 -171.56 62.66 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.675 -0.693 . . . . 20.0 109.975 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.589 HD22 ' CE1' ' A' ' 60' ' ' TYR . 6.8 tt -100.23 140.2 34.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.987 -0.551 . . . . 20.0 111.871 -179.393 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.528 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 38.4 m80 -132.27 139.04 48.1 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.797 -0.638 . . . . 20.0 111.085 179.758 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.589 ' CE1' HD22 ' A' ' 58' ' ' LEU . 10.2 m-30 -115.51 152.53 32.82 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.974 0.416 . . . . 20.0 111.765 -179.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 58.6 p -102.53 79.68 1.84 Allowed 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.9 -0.591 . . . . 20.0 111.198 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.538 ' O ' ' CG2' ' A' ' 75' ' ' VAL . 16.1 tpt180 -118.32 120.27 37.13 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 108.712 -0.847 . . . . 20.0 108.712 178.197 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.589 ' CD1' HG23 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -109.08 -79.44 0.58 Allowed 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 112.663 0.616 . . . . 20.0 112.663 -177.786 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.551 ' HG ' ' OG ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -168.29 137.75 2.44 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.699 -0.4 . . . . 20.0 111.869 -178.063 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 19.3 p -129.45 149.12 51.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.852 0.358 . . . . 20.0 110.263 178.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.506 ' O ' ' C ' ' A' ' 67' ' ' GLY . 24.7 t0 -154.45 -165.51 2.09 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.396 -0.594 . . . . 20.0 109.396 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.847 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -32.29 147.55 0.01 OUTLIER Glycine 0 C--N 1.345 1.082 0 N-CA-C 109.879 -1.289 . . . . 20.0 109.879 178.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.502 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 25.3 Cg_exo -15.95 55.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 125.138 3.892 . . . . 20.0 115.29 -178.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.847 ' N ' ' O ' ' A' ' 67' ' ' GLY . 33.3 m -162.23 162.41 28.21 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 123.492 0.717 . . . . 20.0 109.121 178.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -158.41 144.58 17.11 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.079 0.466 . . . . 20.0 111.988 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' SER . . . . . 0.584 ' CA ' ' HA ' ' A' ' 121' ' ' LEU . 1.0 OUTLIER -83.05 172.37 12.8 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 115.59 -0.732 . . . . 20.0 110.819 179.287 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -152.87 36.51 0.49 Allowed 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.26 -0.576 . . . . 20.0 112.422 178.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.563 ' O ' ' CD1' ' A' ' 63' ' ' PHE . 30.3 mmtt -79.89 163.68 56.88 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.405 -0.361 . . . . 20.0 110.637 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -63.51 116.07 3.42 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.601 2.201 . . . . 20.0 112.505 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' VAL . . . . . 0.589 HG23 ' CD1' ' A' ' 63' ' ' PHE . 4.4 m -140.07 136.52 37.99 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 CA-C-N 116.573 -0.285 . . . . 20.0 111.101 179.332 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 54.6 m -126.49 123.29 37.48 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 120.918 0.389 . . . . 20.0 112.031 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.544 ' CG ' ' HB2' ' A' ' 60' ' ' TYR . 20.0 pt-20 -131.17 148.64 52.74 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.034 -0.53 . . . . 20.0 109.677 178.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LEU . . . . . 0.546 ' N ' HD12 ' A' ' 78' ' ' LEU . 6.5 mp -101.07 158.36 16.07 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 113.575 0.954 . . . . 20.0 113.575 -178.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' VAL . . . . . 0.665 ' CG2' ' O ' ' A' ' 79' ' ' VAL . 1.4 m -135.06 84.01 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 CA-C-N 113.903 -1.499 . . . . 20.0 109.162 178.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.566 ' C ' ' HB2' ' A' ' 109' ' ' CYS . 3.2 p -98.65 137.3 37.48 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.511 0.93 . . . . 20.0 113.511 -177.15 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' SER . . . . . 0.864 ' N ' ' O ' ' A' ' 53' ' ' TYR . 40.3 t -151.05 108.18 3.58 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.808 0.843 . . . . 20.0 110.041 178.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . 0.458 ' O ' ' HA ' ' A' ' 108' ' ' ARG . . . -163.13 -151.61 6.48 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.663 -0.78 . . . . 20.0 112.374 -179.089 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.415 ' C ' ' SG ' ' A' ' 142' ' ' CYS . 58.3 tt0 -108.15 141.49 39.79 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.627 -0.509 . . . . 20.0 109.627 179.207 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' CYS . . . . . 0.445 ' SG ' ' O ' ' A' ' 142' ' ' CYS . 4.5 m -100.7 153.61 19.3 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.575 -0.284 . . . . 20.0 110.605 -179.399 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLY . . . . . 0.425 ' N ' ' CD ' ' A' ' 86' ' ' PRO . . . -54.23 -49.53 59.44 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 120.989 -0.624 . . . . 20.0 113.254 -179.147 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' PRO . . . . . 0.425 ' CD ' ' N ' ' A' ' 85' ' ' GLY . 51.8 Cg_exo -56.55 127.41 25.82 Favored 'Trans proline' 0 N--CA 1.473 0.284 0 C-N-CA 122.818 2.345 . . . . 20.0 112.755 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -113.08 25.16 11.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.127 -0.488 . . . . 20.0 111.989 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -67.08 124.44 23.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.073 0.463 . . . . 20.0 110.699 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.474 HD21 ' O ' ' A' ' 103' ' ' ASN . 10.7 mt -111.88 107.37 16.38 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.86 -0.609 . . . . 20.0 110.845 -179.415 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -115.18 119.25 38.94 Favored Pre-proline 0 C--N 1.327 -0.395 0 N-CA-C 112.123 0.416 . . . . 20.0 112.123 -179.526 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' PRO . . . . . 0.594 ' HB2' ' CD2' ' A' ' 100' ' ' TRP . 44.0 Cg_endo -65.99 131.0 25.8 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.743 2.295 . . . . 20.0 111.306 178.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ASN . . . . . 0.599 ' O ' ' CH2' ' A' ' 99' ' ' TRP . 48.9 m-20 -101.16 146.81 27.01 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 113.303 0.853 . . . . 20.0 113.303 -178.276 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ALA . . . . . 0.697 ' HA ' ' CZ3' ' A' ' 100' ' ' TRP . . . -74.06 -20.7 60.2 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.298 -0.864 . . . . 20.0 112.68 179.478 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ILE . . . . . 0.59 ' CD1' ' CH2' ' A' ' 99' ' ' TRP . 58.0 mt 30.55 33.85 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 121.116 0.484 . . . . 20.0 111.395 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . 0.565 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 97.63 -48.69 1.49 Allowed Glycine 0 CA--C 1.519 0.288 0 CA-C-N 115.721 -0.672 . . . . 20.0 112.203 -179.618 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . 0.595 ' O ' ' CZ2' ' A' ' 99' ' ' TRP . 50.8 mtp85 -117.98 142.22 47.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.51 0.195 . . . . 20.0 110.518 179.396 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' VAL . . . . . 0.555 HG12 ' CZ3' ' A' ' 100' ' ' TRP . 10.8 t -123.48 133.97 67.65 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.924 0 CA-C-O 121.68 0.752 . . . . 20.0 110.91 178.842 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.452 ' CB ' ' O ' ' A' ' 97' ' ' VAL . 0.2 OUTLIER 161.27 -30.45 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 114.498 -1.228 . . . . 20.0 108.671 -178.988 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' TRP . . . . . 0.599 ' CH2' ' O ' ' A' ' 92' ' ' ASN . 31.1 p-90 -96.54 22.05 8.49 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 113.324 -1.762 . . . . 20.0 109.408 179.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' TRP . . . . . 0.7 ' HA ' ' CE3' ' A' ' 100' ' ' TRP . 0.0 OUTLIER -28.79 136.93 0.02 OUTLIER 'General case' 0 CA--C 1.497 -1.067 0 CA-C-O 121.908 0.861 . . . . 20.0 113.179 -177.317 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 11.2 mtp180 -124.78 80.71 62.2 Favored Pre-proline 0 N--CA 1.437 -1.095 0 CA-C-N 114.028 -1.442 . . . . 20.0 111.07 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.452 ' O ' ' CB ' ' A' ' 89' ' ' LEU . 26.5 Cg_endo -64.15 -4.11 7.2 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 122.804 2.336 . . . . 20.0 112.153 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ASN . . . . . 0.474 ' O ' HD21 ' A' ' 89' ' ' LEU . 34.8 m120 -54.76 -32.63 60.19 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.071 0.462 . . . . 20.0 110.069 179.239 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 107.58 151.75 17.17 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.823 -0.703 . . . . 20.0 112.677 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -69.86 167.35 24.82 Favored 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 122.905 2.403 . . . . 20.0 112.003 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.468 ' O ' ' O ' ' A' ' 144' ' ' ARG . 62.4 t0 -74.46 128.35 35.33 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.32 -0.4 . . . . 20.0 110.979 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 97.4 m-85 -112.41 155.86 23.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.943 0.402 . . . . 20.0 111.231 -179.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ARG . . . . . 0.519 ' N ' ' HB3' ' A' ' 144' ' ' ARG . 57.6 ttp180 -173.03 174.13 3.54 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.041 -0.527 . . . . 20.0 110.673 -179.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.775 ' HA ' ' HA ' ' A' ' 142' ' ' CYS . 4.5 m -85.35 138.5 32.25 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.822 -0.172 . . . . 20.0 110.857 179.561 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ILE . . . . . 0.578 HG13 ' HB3' ' A' ' 143' ' ' LYS . 2.7 pp -147.56 154.64 45.01 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.316 0.579 . . . . 20.0 112.149 178.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' PRO . . . . . 0.483 ' HD2' ' HB ' ' A' ' 110' ' ' ILE . 16.6 Cg_endo -56.45 143.1 88.45 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 123.341 2.694 . . . . 20.0 112.028 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 67.5 t0 -126.59 -57.43 1.36 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.403 -0.362 . . . . 20.0 111.686 -179.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ARG . . . . . 0.526 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 48.0 ttt180 -121.38 150.16 41.89 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.298 -0.41 . . . . 20.0 111.072 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . 0.592 ' HB3' ' N ' ' A' ' 136' ' ' LEU . 0.5 OUTLIER -125.48 160.77 28.67 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.702 0.763 . . . . 20.0 112.629 -179.289 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.519 ' HD2' ' NE2' ' A' ' 117' ' ' GLN . 42.9 ttm-85 -97.84 140.4 32.26 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 114.539 -1.21 . . . . 20.0 107.907 176.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -80.51 130.66 35.28 Favored 'General case' 0 C--N 1.313 -0.988 0 C-N-CA 120.683 -0.407 . . . . 20.0 111.633 -178.39 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.519 ' NE2' ' HD2' ' A' ' 115' ' ' ARG . 89.1 mm-40 -133.79 136.62 44.62 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.09 -0.504 . . . . 20.0 110.807 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 50.1 ttt180 -134.02 94.71 3.3 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.996 -0.547 . . . . 20.0 110.189 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' VAL . . . . . 0.563 HG13 ' CB ' ' A' ' 73' ' ' LYS . 9.1 m -131.61 162.19 39.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.861 -0.608 . . . . 20.0 110.859 -179.402 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' GLN . . . . . 0.547 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 21.7 pt20 -99.86 143.46 30.05 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.286 -0.415 . . . . 20.0 112.017 -179.121 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.584 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -79.51 131.52 36.06 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.85 -0.614 . . . . 20.0 110.049 179.456 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' LEU . . . . . 0.492 ' N ' HD13 ' A' ' 122' ' ' LEU . 3.5 mp -97.22 140.76 31.23 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.774 -0.648 . . . . 20.0 111.942 -178.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' CYS . . . . . 0.502 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -118.59 152.34 51.05 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.176 -0.92 . . . . 20.0 109.837 179.313 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' PRO . . . . . 0.426 ' HD2' ' SG ' ' A' ' 123' ' ' CYS . 82.0 Cg_exo -47.73 109.78 0.26 Allowed 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 121.603 1.535 . . . . 20.0 111.044 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' GLY . . . . . 0.424 ' O ' ' C ' ' A' ' 126' ' ' GLY . . . 95.56 3.6 61.07 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.89 -0.672 . . . . 20.0 112.202 -178.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . 0.424 ' C ' ' O ' ' A' ' 125' ' ' GLY . . . 36.47 63.29 0.7 Allowed Glycine 0 C--N 1.335 0.481 0 C-N-CA 120.685 -0.769 . . . . 20.0 111.788 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -97.41 -53.08 3.57 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 111.849 0.314 . . . . 20.0 111.849 -179.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -122.2 59.14 10.88 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 120.939 0.4 . . . . 20.0 111.741 -179.203 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -55.75 149.18 51.4 Favored 'Trans proline' 0 CA--C 1.528 0.203 0 C-N-CA 122.981 2.454 . . . . 20.0 111.945 179.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' ARG . . . . . 0.547 ' O ' ' HA ' ' A' ' 120' ' ' GLN . 95.9 mtt-85 -130.49 155.57 46.24 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.358 -0.383 . . . . 20.0 110.822 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' SER . . . . . 0.541 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 66.6 m -109.04 133.91 52.36 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.898 0.38 . . . . 20.0 111.936 -179.606 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' ARG . . . . . 0.449 ' HD2' ' CB ' ' A' ' 64' ' ' LEU . 15.8 ttm180 -140.96 142.44 34.33 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.045 -0.525 . . . . 20.0 111.879 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.446 ' O ' HG12 ' A' ' 134' ' ' VAL . 53.3 pttt -100.15 146.51 26.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.596 -0.729 . . . . 20.0 109.155 178.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' VAL . . . . . 0.457 HG21 HD22 ' A' ' 64' ' ' LEU . 0.4 OUTLIER -153.03 133.3 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-O 121.385 0.612 . . . . 20.0 112.398 -178.576 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . 0.462 ' HB3' ' HB2' ' A' ' 114' ' ' TYR . 62.1 mtp85 -91.37 113.06 25.23 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.823 -1.081 . . . . 20.0 109.89 178.475 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.592 ' N ' ' HB3' ' A' ' 114' ' ' TYR . 7.6 mt -112.38 130.02 56.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.971 0.415 . . . . 20.0 111.927 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' VAL . . . . . 0.526 ' HA ' ' O ' ' A' ' 113' ' ' ARG . 0.2 OUTLIER -64.61 94.58 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 112.401 0.519 . . . . 20.0 112.401 -179.407 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -80.27 -7.07 58.85 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-O 121.158 0.504 . . . . 20.0 109.74 178.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' SER . . . . . 0.42 ' HA ' HD22 ' A' ' 78' ' ' LEU . 20.1 t -163.29 129.78 3.33 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 115.405 -0.816 . . . . 20.0 109.919 179.13 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' CYS . . . . . 0.453 ' HB3' ' HA ' ' A' ' 111' ' ' PRO . 25.5 p -129.4 165.74 20.95 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.028 0.442 . . . . 20.0 111.49 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 36.1 mttt -123.02 154.4 38.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.718 -0.673 . . . . 20.0 110.032 179.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . 0.775 ' HA ' ' HA ' ' A' ' 109' ' ' CYS . 53.4 t -66.21 103.82 1.06 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.724 -0.473 . . . . 20.0 109.724 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' LYS . . . . . 0.578 ' HB3' HG13 ' A' ' 110' ' ' ILE . 20.5 tptt -147.16 136.66 22.79 Favored 'General case' 0 N--CA 1.461 0.097 0 C-N-CA 118.762 -1.175 . . . . 20.0 113.376 -178.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' ARG . . . . . 0.519 ' HB3' ' N ' ' A' ' 108' ' ' ARG . 11.7 tpt180 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.258 -0.877 . . . . 20.0 110.616 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' HIS . . . . . 0.427 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 30.4 m170 . . . . . 0 N--CA 1.461 0.112 0 N-CA-C 111.854 0.316 . . . . 20.0 111.854 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.59 ' CZ ' HG11 ' A' ' 79' ' ' VAL . 0.8 OUTLIER -126.15 166.28 17.34 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.125 -0.488 . . . . 20.0 111.143 179.793 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.95 79.67 1.54 Allowed 'General case' 0 C--O 1.231 0.121 0 CA-C-O 120.999 0.428 . . . . 20.0 111.716 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.947 ' O ' HG21 ' A' ' 75' ' ' VAL . 53.0 mtm180 -124.7 124.29 41.86 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.154 -1.054 . . . . 20.0 108.154 177.571 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.656 ' CD1' HG22 ' A' ' 75' ' ' VAL . 0.1 OUTLIER -109.53 -79.08 0.58 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 113.007 0.743 . . . . 20.0 113.007 -177.368 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.943 HD21 ' HB ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -170.72 136.74 1.23 Allowed 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.277 -0.569 . . . . 20.0 112.435 -178.128 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.974 HG22 ' HG3' ' A' ' 70' ' ' ARG . 16.8 p -132.96 132.06 41.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.06 -0.518 . . . . 20.0 110.295 178.385 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.598 ' HB2' HD13 ' A' ' 121' ' ' LEU . 91.7 m-20 -140.27 -163.68 1.57 Allowed 'General case' 0 C--O 1.237 0.44 0 N-CA-C 110.074 -0.343 . . . . 20.0 110.074 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.837 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -29.86 146.2 0.01 OUTLIER Glycine 0 C--N 1.345 1.036 0 CA-C-O 118.597 -1.113 . . . . 20.0 110.622 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.492 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 39.6 Cg_exo -15.11 56.23 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 125.292 3.995 . . . . 20.0 115.183 -178.66 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.837 ' N ' ' O ' ' A' ' 67' ' ' GLY . 39.8 m -163.84 163.68 23.76 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 108.453 -0.943 . . . . 20.0 108.453 178.661 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.974 ' HG3' HG22 ' A' ' 65' ' ' THR . 58.0 ttp180 -154.64 145.88 22.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.112 0.482 . . . . 20.0 111.84 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' SER . . . . . 1.002 ' HA ' HD12 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -89.27 160.54 16.86 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.751 -0.659 . . . . 20.0 110.465 179.075 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.465 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . . . -147.66 28.36 0.96 Allowed 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.177 0.806 . . . . 20.0 113.177 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.651 ' HB3' HG21 ' A' ' 119' ' ' VAL . 1.5 tttt -79.33 143.2 59.71 Favored Pre-proline 0 C--N 1.326 -0.436 0 N-CA-C 110.017 -0.364 . . . . 20.0 110.017 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.506 ' HD2' ' HG3' ' A' ' 73' ' ' LYS . 76.9 Cg_exo -51.28 122.29 9.85 Favored 'Trans proline' 0 C--O 1.232 0.225 0 C-N-CA 122.758 2.306 . . . . 20.0 113.024 -178.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.947 HG21 ' O ' ' A' ' 62' ' ' ARG . 20.0 m -136.72 145.5 30.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 115.791 -0.641 . . . . 20.0 110.97 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 41.7 m -119.14 128.52 54.35 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.919 0.39 . . . . 20.0 110.307 178.389 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.688 ' OE1' HD12 ' A' ' 136' ' ' LEU . 20.3 pt-20 -143.32 150.32 39.02 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.894 -0.594 . . . . 20.0 110.252 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.593 HD12 ' N ' ' A' ' 78' ' ' LEU . 6.0 mp -100.91 140.99 34.42 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 121.174 0.511 . . . . 20.0 111.076 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.797 HG23 ' O ' ' A' ' 79' ' ' VAL . 10.7 m . . . . . 0 N--CA 1.441 -0.91 0 CA-C-N 115.423 -0.808 . . . . 20.0 109.842 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 93.3 m-20 . . . . . 0 C--O 1.231 0.115 0 N-CA-C 112.018 0.377 . . . . 20.0 112.018 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ARG . . . . . 0.402 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 25.3 ttm180 -121.2 147.84 45.06 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.354 -0.384 . . . . 20.0 110.832 -179.434 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.913 ' CE2' HG13 ' A' ' 137' ' ' VAL . 1.0 OUTLIER -119.65 160.8 21.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.174 0.511 . . . . 20.0 111.441 -179.114 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.641 ' HB2' ' HB2' ' A' ' 138' ' ' ALA . 50.9 ttm-85 -96.93 147.18 24.24 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.882 -0.784 . . . . 20.0 108.882 178.514 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -82.91 134.24 35.08 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.076 0.465 . . . . 20.0 111.938 -178.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.708 ' HG2' HD23 ' A' ' 136' ' ' LEU . 20.9 mm100 -133.94 120.53 20.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.54 -0.755 . . . . 20.0 110.032 179.351 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 71.9 ttp85 -118.04 98.61 6.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.924 0.392 . . . . 20.0 110.663 179.687 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.943 ' HB ' HD21 ' A' ' 64' ' ' LEU . 92.2 t -131.14 145.06 35.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.902 -0.59 . . . . 20.0 111.3 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.557 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 24.4 mp0 -91.53 140.92 29.28 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.751 0.31 . . . . 20.0 110.518 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.884 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.0 OUTLIER -79.4 129.72 34.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.196 0.522 . . . . 20.0 110.801 -179.835 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 1.002 HD12 ' HA ' ' A' ' 71' ' ' SER . 1.5 mp -95.12 138.46 32.8 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.551 -0.75 . . . . 20.0 111.524 -179.048 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' CYS . . . . . 0.492 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER . . . . . 0 C--N 1.323 -0.585 0 CA-C-N 115.403 -0.817 . . . . 20.0 109.877 179.462 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.115 0 N-CA-C 112.271 0.471 . . . . 20.0 112.271 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -123.19 56.03 8.72 Favored Pre-proline 0 C--N 1.33 -0.242 0 N-CA-C 112.219 0.451 . . . . 20.0 112.219 -179.154 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.68 143.81 47.43 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.639 2.226 . . . . 20.0 112.081 179.156 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.884 ' HB2' HD12 ' A' ' 121' ' ' LEU . 67.5 mtt85 -132.02 153.38 50.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.379 -0.373 . . . . 20.0 110.623 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.456 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 43.9 t -98.84 133.72 42.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.801 0.334 . . . . 20.0 111.128 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' ARG . . . . . 0.479 ' HB3' HD13 ' A' ' 64' ' ' LEU . 74.5 ttt-85 -139.1 142.99 38.08 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.188 0.518 . . . . 20.0 111.761 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 3.6 pttm -96.09 146.07 24.96 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.445 -0.798 . . . . 20.0 110.259 179.17 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.556 ' HB ' HD21 ' A' ' 136' ' ' LEU . 0.0 OUTLIER -145.16 121.59 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 CA-C-O 121.287 0.565 . . . . 20.0 111.794 -179.415 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 135' ' ' ARG . . . . . 0.745 ' C ' HD22 ' A' ' 136' ' ' LEU . 86.1 mtt-85 -92.1 118.6 30.97 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.349 -0.842 . . . . 20.0 110.09 178.657 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.745 HD22 ' C ' ' A' ' 135' ' ' ARG . 1.0 OUTLIER -114.35 120.2 39.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.01 0.433 . . . . 20.0 112.087 -179.252 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.913 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -51.28 84.54 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.269 -0.423 . . . . 20.0 111.455 179.811 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.641 ' HB2' ' HB2' ' A' ' 115' ' ' ARG . . . -75.5 -6.44 50.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.009 0.433 . . . . 20.0 110.193 179.101 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 17.3 t . . . . . 0 C--N 1.332 -0.162 0 CA-C-N 115.82 -0.627 . . . . 20.0 110.517 179.245 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 7.5 m170 . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.911 0.386 . . . . 20.0 111.243 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.631 ' CD1' HG13 ' A' ' 79' ' ' VAL . 12.7 m-85 -129.25 148.63 51.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.083 -0.508 . . . . 20.0 111.639 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.418 ' OG1' ' CZ ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -103.86 87.15 2.73 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.038 0.447 . . . . 20.0 111.091 -179.819 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.949 ' O ' HG21 ' A' ' 75' ' ' VAL . 60.7 ttm-85 -122.37 124.96 44.89 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.572 -0.899 . . . . 20.0 108.572 178.544 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.685 ' O ' HG21 ' A' ' 134' ' ' VAL . 0.1 OUTLIER -111.18 -83.39 0.57 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.98 0.733 . . . . 20.0 112.98 -177.606 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 1.008 HD11 HG13 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -169.17 141.77 2.64 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 120.575 -0.45 . . . . 20.0 112.04 -178.405 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.784 HG22 ' HG3' ' A' ' 70' ' ' ARG . 31.0 p -136.4 131.62 34.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.101 -0.5 . . . . 20.0 110.806 178.793 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.652 ' HB2' HD13 ' A' ' 121' ' ' LEU . 93.4 m-20 -140.72 -162.13 1.31 Allowed 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.547 -0.538 . . . . 20.0 109.547 179.658 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.814 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -29.65 144.34 0.01 OUTLIER Glycine 0 C--N 1.347 1.183 0 CA-C-O 118.494 -1.17 . . . . 20.0 110.277 179.441 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.515 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 56.9 Cg_exo -16.57 58.53 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 125.071 3.848 . . . . 20.0 114.864 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.814 ' N ' ' O ' ' A' ' 67' ' ' GLY . 20.7 m -162.58 159.12 24.29 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 108.956 -0.757 . . . . 20.0 108.956 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.784 ' HG3' HG22 ' A' ' 65' ' ' THR . 79.3 ttt180 -149.97 141.29 23.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.218 0.532 . . . . 20.0 112.068 179.714 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.599 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -84.54 162.69 19.75 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.446 -0.797 . . . . 20.0 110.393 179.004 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -147.34 28.3 0.99 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.415 0.894 . . . . 20.0 113.415 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.907 ' HB2' HG21 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -75.76 141.97 72.85 Favored Pre-proline 0 C--N 1.327 -0.379 0 C-N-CA 120.54 -0.464 . . . . 20.0 110.27 179.249 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -50.63 122.51 9.76 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.706 2.27 . . . . 20.0 112.619 -179.281 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.949 HG21 ' O ' ' A' ' 62' ' ' ARG . 17.3 m -137.27 151.08 26.38 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 CA-C-N 116.202 -0.454 . . . . 20.0 111.891 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 88.1 m -111.73 124.24 51.92 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.069 -0.715 . . . . 20.0 109.069 177.628 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.64 ' C ' HD12 ' A' ' 78' ' ' LEU . 84.8 tt0 -125.31 133.1 52.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.192 0.52 . . . . 20.0 112.085 -179.061 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.733 HD12 ' N ' ' A' ' 78' ' ' LEU . 3.8 mp -108.06 138.29 44.58 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.534 -0.757 . . . . 20.0 109.405 178.36 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.634 HG23 ' O ' ' A' ' 79' ' ' VAL . 35.0 m . . . . . 0 C--N 1.317 -0.805 0 CA-C-O 121.481 0.657 . . . . 20.0 111.184 -178.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 . . . . . 0 CA--C 1.529 0.152 0 N-CA-C 112.989 0.737 . . . . 20.0 112.989 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ARG . . . . . 0.496 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 41.0 ttm180 -119.82 149.05 42.69 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.245 0.461 . . . . 20.0 112.245 -178.356 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 1.021 ' CE2' HG13 ' A' ' 137' ' ' VAL . 1.3 m-85 -124.01 159.01 30.79 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.551 -0.75 . . . . 20.0 111.602 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.491 HH21 ' HB1' ' A' ' 138' ' ' ALA . 43.9 ttm-85 -95.43 148.31 22.61 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.467 -0.938 . . . . 20.0 108.467 177.738 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -83.33 137.94 33.75 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.137 0.494 . . . . 20.0 111.421 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.452 ' O ' ' HA ' ' A' ' 133' ' ' LYS . 28.4 mm100 -137.18 109.81 7.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.811 -0.632 . . . . 20.0 110.867 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.482 ' HA ' ' O ' ' A' ' 132' ' ' ARG . 93.8 mtt180 -125.42 98.25 5.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.059 -0.519 . . . . 20.0 110.739 179.394 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 1.008 HG13 HD11 ' A' ' 64' ' ' LEU . 14.7 p -133.72 152.12 34.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.877 -0.601 . . . . 20.0 110.857 -179.728 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.52 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 27.1 mp0 -77.92 135.73 37.9 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.932 0.396 . . . . 20.0 111.493 -179.234 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.889 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.2 OUTLIER -79.22 127.71 32.39 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.345 -0.613 . . . . 20.0 109.345 179.103 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.62 131.86 34.56 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.861 -0.608 . . . . 20.0 111.446 -178.715 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' CYS . . . . . 0.597 ' CB ' ' HB3' ' A' ' 128' ' ' ALA . 0.5 OUTLIER . . . . . 0 C--N 1.323 -0.547 0 CA-C-N 115.438 -0.801 . . . . 20.0 109.881 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.186 0 N-CA-C 112.384 0.512 . . . . 20.0 112.384 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.597 ' HB3' ' CB ' ' A' ' 123' ' ' CYS . . . -129.63 56.26 23.21 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 112.388 0.514 . . . . 20.0 112.388 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' PRO . . . . . 0.518 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 62.3 Cg_endo -73.74 136.32 23.02 Favored 'Trans proline' 0 CA--C 1.528 0.182 0 C-N-CA 122.529 2.153 . . . . 20.0 112.055 179.078 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.889 ' HB2' HD12 ' A' ' 121' ' ' LEU . 89.1 mtt180 -140.27 133.94 30.32 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.62 0.248 . . . . 20.0 111.271 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.417 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 23.3 t -85.51 136.71 33.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.952 0.406 . . . . 20.0 111.657 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' ARG . . . . . 0.691 HH12 HG13 ' A' ' 134' ' ' VAL . 56.6 ttt-85 -140.52 143.54 35.46 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.803 -0.635 . . . . 20.0 111.26 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.452 ' HA ' ' O ' ' A' ' 117' ' ' GLN . 19.7 pttp -100.93 144.61 29.66 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.09 -0.504 . . . . 20.0 110.66 179.473 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.691 HG13 HH12 ' A' ' 132' ' ' ARG . 0.0 OUTLIER -147.99 123.17 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 120.946 0.403 . . . . 20.0 111.721 -179.618 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 135' ' ' ARG . . . . . 0.596 ' O ' HD23 ' A' ' 136' ' ' LEU . 90.5 mtm-85 -90.85 110.89 22.11 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.855 -0.612 . . . . 20.0 110.213 178.423 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.61 ' N ' ' HB3' ' A' ' 114' ' ' TYR . 5.0 mt -114.04 126.85 55.58 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.255 0.55 . . . . 20.0 112.047 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 1.021 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.2 OUTLIER -57.83 83.22 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.569 -0.741 . . . . 20.0 111.405 -179.704 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.491 ' HB1' HH21 ' A' ' 115' ' ' ARG . . . -72.95 -6.98 48.94 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.053 0.454 . . . . 20.0 110.428 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 47.2 t . . . . . 0 C--N 1.331 -0.209 0 CA-C-N 115.787 -0.642 . . . . 20.0 110.169 179.171 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 59' ' ' HIS . . . . . 0.441 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 25.8 m170 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.895 0.379 . . . . 20.0 110.792 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.89 ' CD1' HG13 ' A' ' 79' ' ' VAL . 14.9 m-85 -128.16 156.14 43.35 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.027 -0.533 . . . . 20.0 111.589 -179.124 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 40.1 p -111.05 88.41 2.78 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 112.325 0.491 . . . . 20.0 112.325 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.797 ' O ' HG21 ' A' ' 75' ' ' VAL . 51.4 mtm180 -117.33 123.36 46.32 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.291 -1.003 . . . . 20.0 108.291 177.151 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.907 ' O ' HD23 ' A' ' 64' ' ' LEU . 1.7 m-85 -103.21 -79.29 0.54 Allowed 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 112.34 0.496 . . . . 20.0 112.34 -177.448 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.907 HD23 ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -177.46 142.16 0.32 Allowed 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.581 -0.448 . . . . 20.0 111.44 -178.76 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.733 HG22 ' HG3' ' A' ' 70' ' ' ARG . 30.0 p -138.9 132.71 30.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.058 -0.519 . . . . 20.0 110.081 178.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.558 ' O ' ' C ' ' A' ' 67' ' ' GLY . 5.1 t0 -150.29 -155.71 0.65 Allowed 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.701 -0.227 . . . . 20.0 110.397 -179.417 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.789 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -26.38 137.77 0.01 OUTLIER Glycine 0 C--N 1.347 1.171 0 N-CA-C 110.26 -1.136 . . . . 20.0 110.26 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.565 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 36.7 Cg_exo -17.09 59.74 0.0 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.97 0 C-N-CA 125.136 3.891 . . . . 20.0 115.387 -177.85 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.789 ' N ' ' O ' ' A' ' 67' ' ' GLY . 74.1 m -165.33 162.87 19.91 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 108.7 -0.852 . . . . 20.0 108.7 178.051 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.733 ' HG3' HG22 ' A' ' 65' ' ' THR . 54.9 ttt180 -147.09 140.82 25.73 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 112.555 0.576 . . . . 20.0 112.555 -179.321 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.674 ' CA ' ' HA ' ' A' ' 121' ' ' LEU . 1.4 t -87.98 158.36 18.67 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-N 115.896 -0.593 . . . . 20.0 110.253 178.519 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.427 ' HA ' ' CD2' ' A' ' 63' ' ' PHE . . . -146.93 27.37 1.07 Allowed 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 114.427 1.269 . . . . 20.0 114.427 -179.119 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.705 ' HB3' HG21 ' A' ' 119' ' ' VAL . 19.5 tttt -76.62 136.57 67.48 Favored Pre-proline 0 C--N 1.327 -0.411 0 C-N-CA 120.054 -0.658 . . . . 20.0 109.493 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -51.35 129.03 27.54 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.926 2.417 . . . . 20.0 113.172 -178.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.797 HG21 ' O ' ' A' ' 62' ' ' ARG . 17.4 m -142.3 147.79 20.91 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 CA-C-N 115.886 -0.597 . . . . 20.0 111.472 179.638 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 18.9 m -116.83 126.15 52.62 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.526 -0.546 . . . . 20.0 109.526 178.518 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.719 ' OE1' HD12 ' A' ' 136' ' ' LEU . 15.9 pt-20 -143.09 155.49 44.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.971 0.415 . . . . 20.0 111.554 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.575 HD12 ' N ' ' A' ' 78' ' ' LEU . 6.3 mp -105.39 143.59 33.34 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.757 -0.656 . . . . 20.0 110.272 178.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.89 HG13 ' CD1' ' A' ' 60' ' ' TYR . 32.8 m . . . . . 0 C--N 1.323 -0.576 0 CA-C-O 121.037 0.446 . . . . 20.0 110.632 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 46.6 t0 . . . . . 0 N--CA 1.455 -0.181 0 CA-C-O 120.739 0.304 . . . . 20.0 111.538 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ARG . . . . . 0.441 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 53.2 ttt85 -126.38 143.59 51.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.286 -0.415 . . . . 20.0 111.519 -179.678 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.818 ' CD1' HG13 ' A' ' 137' ' ' VAL . 2.3 m-85 -118.66 157.39 27.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.908 -0.587 . . . . 20.0 110.6 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.652 ' HB2' ' HB2' ' A' ' 138' ' ' ALA . 55.5 ttm-85 -93.74 139.84 30.36 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 108.602 -0.888 . . . . 20.0 108.602 178.024 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -77.01 131.68 38.58 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 120.302 -0.559 . . . . 20.0 110.684 -178.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.673 ' CD ' HD23 ' A' ' 136' ' ' LEU . 13.4 mt-30 -133.46 101.87 5.31 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.961 -0.563 . . . . 20.0 110.57 -179.683 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 43.2 ttt85 -109.21 99.54 8.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.967 0.413 . . . . 20.0 110.28 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.721 ' HB ' HD21 ' A' ' 64' ' ' LEU . 45.3 t -129.33 148.92 33.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 115.895 -0.593 . . . . 20.0 110.976 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.565 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 13.1 pt20 -92.21 134.82 34.52 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.391 -0.368 . . . . 20.0 110.223 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.697 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.2 OUTLIER -74.48 120.85 20.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.137 0.494 . . . . 20.0 111.134 -179.27 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.509 ' N ' ' O ' ' A' ' 70' ' ' ARG . 0.2 OUTLIER -89.69 138.77 31.19 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.469 -0.787 . . . . 20.0 111.114 -179.242 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 123' ' ' CYS . . . . . 0.565 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.482 0 CA-C-N 116.06 -0.518 . . . . 20.0 111.02 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.489 ' O ' ' HD2' ' A' ' 129' ' ' PRO . . . . . . . . 0 N--CA 1.455 -0.185 0 N-CA-C 112.057 0.391 . . . . 20.0 112.057 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.447 ' N ' ' CD ' ' A' ' 129' ' ' PRO . . . -113.44 53.89 0.56 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.125 0.488 . . . . 20.0 110.648 179.314 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 129' ' ' PRO . . . . . 0.49 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 36.9 Cg_endo -65.86 151.58 83.83 Favored 'Trans proline' 0 N--CA 1.464 -0.251 0 C-N-CA 122.977 2.451 . . . . 20.0 112.767 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.697 ' HB2' HD12 ' A' ' 121' ' ' LEU . 80.8 mtt85 -134.98 155.76 50.19 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 116.004 -0.544 . . . . 20.0 110.634 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.45 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 13.2 p -103.52 133.46 48.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.86 0.362 . . . . 20.0 111.23 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 60.6 ttt85 -140.37 143.57 35.79 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.094 -0.503 . . . . 20.0 111.593 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -97.02 149.31 22.06 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 115.884 -0.598 . . . . 20.0 110.44 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.722 HG12 HD21 ' A' ' 136' ' ' LEU . 3.2 t -147.68 123.92 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-O 121.118 0.485 . . . . 20.0 111.768 -179.607 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 135' ' ' ARG . . . . . 0.681 ' C ' HD22 ' A' ' 136' ' ' LEU . 93.9 mtt-85 -100.45 109.73 21.89 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.516 -0.765 . . . . 20.0 109.526 178.351 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.735 HD22 ' N ' ' A' ' 136' ' ' LEU . 1.1 mm? -111.57 125.69 54.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.1 0.476 . . . . 20.0 112.224 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.818 HG13 ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -52.83 83.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.1 -0.5 . . . . 20.0 111.393 179.853 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.652 ' HB2' ' HB2' ' A' ' 115' ' ' ARG . . . -74.36 -8.83 57.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.082 0.468 . . . . 20.0 110.039 178.974 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.7 p . . . . . 0 C--N 1.332 -0.189 0 CA-C-N 115.653 -0.703 . . . . 20.0 109.68 179.11 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.455 -0.218 0 CA-C-O 120.902 0.382 . . . . 20.0 111.439 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.602 ' CD2' HG11 ' A' ' 79' ' ' VAL . 20.6 m-30 -110.67 150.06 29.57 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.698 0.629 . . . . 20.0 112.698 -179.018 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 24.0 p -118.88 84.99 2.28 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 115.051 -0.977 . . . . 20.0 110.293 178.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.876 ' O ' HG21 ' A' ' 75' ' ' VAL . 57.1 ttt85 -112.43 125.64 54.44 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 108.473 -0.936 . . . . 20.0 108.473 178.44 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.851 ' CD1' HG22 ' A' ' 75' ' ' VAL . 0.1 OUTLIER -110.01 -84.75 0.55 Allowed 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.555 0.576 . . . . 20.0 112.555 -177.935 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.916 HD21 ' CG2' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -164.5 132.55 3.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.888 0.375 . . . . 20.0 111.448 -178.68 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.977 HG22 ' HG3' ' A' ' 70' ' ' ARG . 44.2 p -131.44 132.92 44.69 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.95 -0.568 . . . . 20.0 110.603 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.762 ' CG ' HD13 ' A' ' 121' ' ' LEU . 20.1 p-10 -145.01 -161.36 1.28 Allowed 'General case' 0 C--O 1.237 0.426 0 N-CA-C 110.355 -0.239 . . . . 20.0 110.355 179.377 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.837 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -30.51 149.09 0.01 OUTLIER Glycine 0 C--N 1.342 0.902 0 CA-C-O 118.784 -1.009 . . . . 20.0 110.688 179.183 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.502 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 57.0 Cg_exo -16.67 53.42 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.657 1 C-N-CA 125.852 4.368 . . . . 20.0 115.613 -178.476 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.837 ' N ' ' O ' ' A' ' 67' ' ' GLY . 18.3 m -164.56 160.28 20.1 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 108.344 -0.984 . . . . 20.0 108.344 178.412 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.977 ' HG3' HG22 ' A' ' 65' ' ' THR . 71.5 ttt180 -153.58 140.46 19.16 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.865 0.364 . . . . 20.0 111.414 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.654 ' HA ' HD12 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -81.15 165.19 21.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.923 -0.581 . . . . 20.0 110.324 179.279 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -148.26 24.03 1.03 Allowed 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.672 0.619 . . . . 20.0 112.672 178.457 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.67 ' O ' HG13 ' A' ' 75' ' ' VAL . 1.8 mmpt? -67.3 128.97 93.84 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 109.786 -0.45 . . . . 20.0 109.786 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -46.69 117.72 2.24 Favored 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 122.411 2.074 . . . . 20.0 112.693 -179.44 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.876 HG21 ' O ' ' A' ' 62' ' ' ARG . 28.8 m -133.24 155.69 41.09 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.244 0 CA-C-N 116.14 -0.482 . . . . 20.0 110.893 179.484 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.424 HG22 HD11 ' A' ' 78' ' ' LEU . 14.3 m -116.54 121.24 41.21 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.786 -0.45 . . . . 20.0 109.786 177.847 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.569 ' C ' HD12 ' A' ' 78' ' ' LEU . 78.6 tt0 -120.53 124.07 44.45 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.945 -0.57 . . . . 20.0 110.414 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.725 HD12 ' N ' ' A' ' 78' ' ' LEU . 3.9 mp -111.47 120.59 42.67 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 121.646 0.736 . . . . 20.0 111.61 -179.694 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.842 HG23 ' O ' ' A' ' 79' ' ' VAL . 3.9 m . . . . . 0 C--N 1.311 -1.068 0 CA-C-N 114.544 -1.207 . . . . 20.0 109.509 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 . . . . . 0 CA--C 1.533 0.312 0 N-CA-C 112.508 0.558 . . . . 20.0 112.508 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ARG . . . . . 0.539 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 57.5 ttt180 -117.63 154.15 32.07 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.542 0.211 . . . . 20.0 111.444 -179.159 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 1.01 ' CE2' HG13 ' A' ' 137' ' ' VAL . 2.3 m-85 -127.81 155.3 44.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.488 0.661 . . . . 20.0 111.82 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.529 ' NH2' ' HB1' ' A' ' 138' ' ' ALA . 27.3 ttm-85 -94.29 146.27 24.15 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.968 -1.014 . . . . 20.0 108.959 178.715 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -94.74 116.39 28.68 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.29 0.567 . . . . 20.0 110.65 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -130.63 111.62 12.38 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.531 -0.759 . . . . 20.0 109.684 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 59.9 ttp180 -110.49 101.3 10.0 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.877 -0.601 . . . . 20.0 110.356 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.916 ' CG2' HD21 ' A' ' 64' ' ' LEU . 35.4 m -125.42 162.95 27.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 120.872 0.368 . . . . 20.0 111.264 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.564 ' HA ' ' HA ' ' A' ' 131' ' ' SER . 14.4 pt20 -95.99 137.84 34.48 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-O 121.53 0.681 . . . . 20.0 112.17 -178.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.764 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -74.79 133.9 41.88 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 115.218 -0.901 . . . . 20.0 109.557 179.094 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.655 HD12 ' N ' ' A' ' 122' ' ' LEU . 2.3 mp -94.72 140.34 30.02 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.404 0.621 . . . . 20.0 111.638 -178.55 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 123' ' ' CYS . . . . . 0.477 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.3 OUTLIER . . . . . 0 C--N 1.321 -0.639 0 CA-C-N 115.27 -0.877 . . . . 20.0 109.455 178.957 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 -0.101 0 N-CA-C 112.519 0.563 . . . . 20.0 112.519 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -125.28 58.3 19.73 Favored Pre-proline 0 C--N 1.325 -0.484 0 C-N-CA 120.886 -0.326 . . . . 20.0 111.819 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -48.87 150.15 6.92 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.477 2.118 . . . . 20.0 111.295 178.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.764 ' HB2' HD12 ' A' ' 121' ' ' LEU . 98.3 mtt180 -123.75 148.43 46.63 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 121.054 -0.258 . . . . 20.0 110.86 -179.609 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.564 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 22.9 t -100.46 134.61 43.16 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.004 0.431 . . . . 20.0 111.705 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 132' ' ' ARG . . . . . 0.542 ' HD3' ' CB ' ' A' ' 64' ' ' LEU . 47.4 ttt85 -141.2 141.77 34.04 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.854 -0.612 . . . . 20.0 111.194 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 16.7 pttm -92.91 145.2 24.56 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.783 0.325 . . . . 20.0 111.067 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.497 HG21 ' O ' ' A' ' 63' ' ' PHE . 41.2 t -147.66 130.62 8.0 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.799 0 CA-C-O 121.529 0.681 . . . . 20.0 112.295 -179.058 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 135' ' ' ARG . . . . . 0.625 ' O ' HD23 ' A' ' 136' ' ' LEU . 36.5 ptt-85 -113.52 111.85 22.59 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.868 -1.06 . . . . 20.0 109.652 178.411 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.625 HD23 ' O ' ' A' ' 135' ' ' ARG . 8.7 mt -119.05 143.05 47.32 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.372 0.508 . . . . 20.0 112.372 -179.315 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 1.01 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -63.32 83.76 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.989 -0.551 . . . . 20.0 111.028 179.192 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.529 ' HB1' ' NH2' ' A' ' 115' ' ' ARG . . . -65.98 -19.82 65.99 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.881 0.372 . . . . 20.0 110.672 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 38.6 t . . . . . 0 N--CA 1.465 0.304 0 CA-C-N 116.06 -0.518 . . . . 20.0 110.372 -179.882 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 59' ' ' HIS . . . . . 0.602 ' CG ' HG22 ' A' ' 76' ' ' THR . 3.0 m-70 . . . . . 0 N--CA 1.453 -0.278 0 CA-C-O 120.573 0.225 . . . . 20.0 111.486 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.634 ' CD1' HG13 ' A' ' 79' ' ' VAL . 0.2 OUTLIER -147.9 161.8 40.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.988 0.423 . . . . 20.0 111.28 179.483 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.555 HG23 ' CE1' ' A' ' 63' ' ' PHE . 52.8 m -76.11 136.22 39.85 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.609 0.719 . . . . 20.0 112.128 -178.67 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.893 ' O ' HG21 ' A' ' 75' ' ' VAL . 47.4 tpt85 174.86 109.61 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.59 -1.186 . . . . 20.0 108.799 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.584 ' HD1' HG13 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -116.41 -80.95 0.61 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.551 0.575 . . . . 20.0 112.551 -178.343 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.635 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -164.57 132.45 3.32 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 112.109 0.411 . . . . 20.0 112.109 -178.786 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.491 ' O ' ' NH1' ' A' ' 132' ' ' ARG . 72.6 p -129.12 136.62 50.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.067 -0.515 . . . . 20.0 110.232 178.517 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.868 ' OD2' HD13 ' A' ' 121' ' ' LEU . 31.4 p-10 -145.34 -164.33 1.92 Allowed 'General case' 0 C--O 1.237 0.426 0 CA-C-N 116.454 -0.339 . . . . 20.0 110.361 -179.789 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.845 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -31.72 147.99 0.01 OUTLIER Glycine 0 C--N 1.345 1.028 0 CA-C-O 118.453 -1.193 . . . . 20.0 110.152 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.547 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 56.3 Cg_exo -16.99 56.07 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.689 0 C-N-CA 125.167 3.911 . . . . 20.0 115.103 -178.388 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.845 ' N ' ' O ' ' A' ' 67' ' ' GLY . 34.4 m -163.22 157.68 20.69 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 108.272 -1.01 . . . . 20.0 108.272 178.603 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.517 ' O ' ' N ' ' A' ' 122' ' ' LEU . 80.6 mtt180 -149.26 143.95 26.2 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.679 0.622 . . . . 20.0 112.679 -179.448 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.635 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -89.02 159.01 17.8 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.478 -0.783 . . . . 20.0 109.521 177.938 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.578 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . . . -145.85 22.7 1.41 Allowed 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 113.68 0.992 . . . . 20.0 113.68 -179.354 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.751 ' CB ' HG11 ' A' ' 119' ' ' VAL . 0.1 OUTLIER -67.11 139.74 95.41 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 109.433 -0.58 . . . . 20.0 109.433 178.999 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.46 ' HD2' ' HG3' ' A' ' 73' ' ' LYS . 54.1 Cg_exo -51.87 125.94 18.53 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.353 2.035 . . . . 20.0 112.333 -179.127 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.893 HG21 ' O ' ' A' ' 62' ' ' ARG . 19.0 m -131.41 161.07 41.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.001 0.429 . . . . 20.0 111.248 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.602 HG22 ' CG ' ' A' ' 59' ' ' HIS . 0.0 OUTLIER -134.97 97.08 3.65 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.849 -0.614 . . . . 20.0 109.983 178.749 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.634 ' OE2' HD22 ' A' ' 136' ' ' LEU . 67.8 mt-10 -110.99 161.27 16.03 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.738 -0.664 . . . . 20.0 110.23 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.498 HD12 ' C ' ' A' ' 77' ' ' GLU . 8.7 mp -111.02 132.98 53.76 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.404 0.621 . . . . 20.0 111.494 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.762 HG23 ' O ' ' A' ' 79' ' ' VAL . 23.4 m . . . . . 0 N--CA 1.447 -0.587 0 CA-C-N 115.023 -0.989 . . . . 20.0 110.073 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 50.3 t0 . . . . . 0 CA--C 1.529 0.147 0 N-CA-C 112.539 0.57 . . . . 20.0 112.539 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ARG . . . . . 0.813 ' O ' HG12 ' A' ' 137' ' ' VAL . 56.9 ttm-85 -111.98 156.66 21.78 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.104 0.409 . . . . 20.0 112.104 -178.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.979 ' CE2' HG13 ' A' ' 137' ' ' VAL . 4.4 m-85 -134.51 165.49 25.08 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.681 -0.69 . . . . 20.0 112.188 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.514 ' N ' ' O ' ' A' ' 136' ' ' LEU . 14.2 ttm180 -103.3 151.31 22.86 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.611 -1.177 . . . . 20.0 108.358 177.739 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -90.52 124.84 35.33 Favored 'General case' 0 C--N 1.319 -0.761 0 C-N-CA 120.482 -0.487 . . . . 20.0 111.597 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.413 ' O ' ' HA ' ' A' ' 133' ' ' LYS . 23.6 mm100 -131.44 131.3 43.44 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.889 -0.596 . . . . 20.0 110.71 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.414 ' HA ' ' O ' ' A' ' 132' ' ' ARG . 50.9 mtm180 -127.35 95.68 4.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.203 -0.453 . . . . 20.0 110.156 178.776 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.751 HG11 ' CB ' ' A' ' 73' ' ' LYS . 41.5 t -119.22 145.44 25.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.813 -0.631 . . . . 20.0 111.2 -179.45 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.524 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 8.1 pt20 -79.27 131.23 36.09 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.174 -0.467 . . . . 20.0 109.803 179.53 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.9 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -78.46 125.49 29.44 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.088 0.471 . . . . 20.0 109.785 179.91 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.517 ' N ' ' O ' ' A' ' 70' ' ' ARG . 0.3 OUTLIER -85.77 131.96 34.22 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.435 -0.802 . . . . 20.0 111.665 -178.35 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 123' ' ' CYS . . . . . 0.566 ' CB ' ' HB3' ' A' ' 128' ' ' ALA . 0.5 OUTLIER . . . . . 0 C--N 1.323 -0.572 0 CA-C-N 115.16 -0.927 . . . . 20.0 109.035 179.028 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.159 0 N-CA-C 112.333 0.494 . . . . 20.0 112.333 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.566 ' HB3' ' CB ' ' A' ' 123' ' ' CYS . . . -133.12 51.02 6.25 Favored Pre-proline 0 C--N 1.331 -0.23 0 N-CA-C 112.727 0.64 . . . . 20.0 112.727 -179.413 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 129' ' ' PRO . . . . . 0.47 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 45.6 Cg_endo -68.97 140.16 44.9 Favored 'Trans proline' 0 CA--C 1.528 0.177 0 C-N-CA 122.421 2.081 . . . . 20.0 112.528 179.277 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.9 ' HB2' HD12 ' A' ' 121' ' ' LEU . 70.1 mtp85 -142.11 134.22 27.54 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.406 -0.361 . . . . 20.0 110.659 179.34 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 22.3 t -85.02 135.46 34.01 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.791 0.329 . . . . 20.0 110.701 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 132' ' ' ARG . . . . . 0.491 ' NH1' ' O ' ' A' ' 65' ' ' THR . 66.8 ttt180 -143.53 140.9 30.49 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.158 0.429 . . . . 20.0 112.158 -179.082 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.413 ' HA ' ' O ' ' A' ' 117' ' ' GLN . 2.5 pttp -98.41 139.13 34.62 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.473 -0.566 . . . . 20.0 109.473 178.246 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.411 HG21 ' O ' ' A' ' 63' ' ' PHE . 13.1 m -145.33 128.57 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 CA-C-O 121.401 0.619 . . . . 20.0 111.364 -179.529 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 135' ' ' ARG . . . . . 0.724 ' C ' HD23 ' A' ' 136' ' ' LEU . 55.9 mtm180 -81.59 122.15 27.23 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.939 -1.028 . . . . 20.0 110.007 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.724 HD23 ' C ' ' A' ' 135' ' ' ARG . 9.2 mt -117.5 126.19 52.17 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.878 0.37 . . . . 20.0 111.998 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.979 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.2 OUTLIER -71.33 89.48 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.403 -0.362 . . . . 20.0 111.909 179.692 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -78.44 -9.38 59.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.176 0.512 . . . . 20.0 109.809 178.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.3 p . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 115.575 -0.739 . . . . 20.0 110.353 179.28 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 59' ' ' HIS . . . . . 0.525 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 74.8 m-70 . . . . . 0 N--CA 1.455 -0.215 0 CA-C-O 120.868 0.366 . . . . 20.0 111.631 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.613 ' CE1' HG11 ' A' ' 79' ' ' VAL . 13.3 m-30 -120.22 154.92 34.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.193 0.52 . . . . 20.0 111.519 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.406 ' O ' ' OG1' ' A' ' 61' ' ' THR . 0.2 OUTLIER -100.81 86.43 3.09 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.511 -0.768 . . . . 20.0 111.435 -179.298 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.99 ' O ' HG21 ' A' ' 75' ' ' VAL . 37.4 ttp180 -117.66 119.73 35.85 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.606 -0.887 . . . . 20.0 108.606 178.373 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.779 ' O ' HD23 ' A' ' 64' ' ' LEU . 0.1 OUTLIER -106.75 -80.03 0.57 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.851 0.685 . . . . 20.0 112.851 -177.755 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.862 HD21 ' HB ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -174.37 146.21 1.05 Allowed 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 120.692 -0.403 . . . . 20.0 112.035 -178.479 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 71.0 p -137.97 148.57 45.34 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.084 -0.507 . . . . 20.0 111.379 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.518 ' O ' ' C ' ' A' ' 67' ' ' GLY . 7.9 t0 -154.13 -167.5 2.66 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.108 -0.496 . . . . 20.0 109.835 179.051 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.835 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -32.56 149.17 0.01 OUTLIER Glycine 0 C--N 1.345 1.036 0 CA-C-O 118.171 -1.349 . . . . 20.0 110.197 179.093 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.503 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 77.6 Cg_exo -18.27 57.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 124.742 3.628 . . . . 20.0 114.949 -178.353 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.835 ' N ' ' O ' ' A' ' 67' ' ' GLY . 55.7 m -163.82 154.24 15.43 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 108.164 -1.05 . . . . 20.0 108.164 178.872 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.604 ' O ' HD12 ' A' ' 122' ' ' LEU . 74.1 mtt85 -151.84 144.3 24.14 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.61 0.596 . . . . 20.0 112.61 -179.409 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.621 ' CA ' ' HA ' ' A' ' 121' ' ' LEU . 0.3 OUTLIER -83.17 164.39 20.22 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.318 -0.856 . . . . 20.0 110.14 178.659 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -152.16 34.52 0.52 Allowed 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.309 0.855 . . . . 20.0 113.309 -179.68 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.719 ' HB2' HG11 ' A' ' 119' ' ' VAL . 21.8 mttm -82.35 148.55 59.52 Favored Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 109.193 -0.669 . . . . 20.0 109.193 178.723 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_endo -58.42 120.11 7.78 Favored 'Trans proline' 0 CA--C 1.525 0.072 0 C-N-CA 122.314 2.009 . . . . 20.0 112.871 -178.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.99 HG21 ' O ' ' A' ' 62' ' ' ARG . 16.4 m -133.99 143.74 37.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.672 -0.695 . . . . 20.0 110.813 179.531 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 73.4 m -125.29 129.56 50.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.955 0.407 . . . . 20.0 111.55 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.525 ' O ' ' HA ' ' A' ' 59' ' ' HIS . 15.0 pt-20 -144.23 154.92 43.6 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.91 -0.586 . . . . 20.0 109.633 178.466 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.571 HD13 ' O ' ' A' ' 137' ' ' VAL . 6.4 mp -88.18 148.38 24.43 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.377 0.608 . . . . 20.0 112.095 -179.425 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.668 ' O ' ' CG2' ' A' ' 79' ' ' VAL . 0.8 OUTLIER . . . . . 0 N--CA 1.444 -0.762 0 CA-C-N 114.909 -1.041 . . . . 20.0 109.119 179.082 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 48.8 t0 . . . . . 0 N--CA 1.457 -0.111 0 CA-C-O 120.676 0.274 . . . . 20.0 111.468 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ARG . . . . . 0.477 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 57.9 ttp180 -127.22 146.12 50.53 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.881 0.372 . . . . 20.0 111.393 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 1.166 ' CE2' HG13 ' A' ' 137' ' ' VAL . 2.9 m-85 -120.89 154.68 35.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.842 -0.617 . . . . 20.0 111.562 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.63 ' HB2' ' HB2' ' A' ' 138' ' ' ALA . 58.9 ttm-85 -92.13 147.44 22.93 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 108.646 -0.872 . . . . 20.0 108.646 178.338 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -82.41 123.0 28.73 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 120.814 -0.355 . . . . 20.0 111.206 -179.132 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.586 ' HG2' HD23 ' A' ' 136' ' ' LEU . 24.6 mm100 -126.4 125.44 42.19 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 116.308 -0.405 . . . . 20.0 110.352 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 67.2 ttp85 -124.34 100.17 6.56 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.248 0.547 . . . . 20.0 110.553 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.862 ' HB ' HD21 ' A' ' 64' ' ' LEU . 86.2 t -125.1 147.66 29.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.372 -0.831 . . . . 20.0 111.093 -179.481 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.586 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 10.8 pt20 -92.12 133.87 35.37 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.858 -0.423 . . . . 20.0 109.858 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.902 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -78.24 135.16 37.52 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.25 0.547 . . . . 20.0 111.759 -178.82 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.604 HD12 ' O ' ' A' ' 70' ' ' ARG . 0.3 OUTLIER -82.39 146.84 29.12 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.248 -0.887 . . . . 20.0 110.282 179.801 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 123' ' ' CYS . . . . . 0.426 ' SG ' ' O ' ' A' ' 128' ' ' ALA . 3.5 m . . . . . 0 N--CA 1.45 -0.428 0 CA-C-O 120.975 0.417 . . . . 20.0 110.768 -178.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.186 0 N-CA-C 111.872 0.323 . . . . 20.0 111.872 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 128' ' ' ALA . . . . . 0.426 ' O ' ' SG ' ' A' ' 123' ' ' CYS . . . -120.85 63.89 11.54 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 121.117 0.484 . . . . 20.0 110.624 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -57.93 151.01 60.13 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.98 2.453 . . . . 20.0 112.015 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.902 ' HB2' HD12 ' A' ' 121' ' ' LEU . 73.8 mtp85 -124.12 154.75 39.55 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 116.3 -0.409 . . . . 20.0 110.915 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.445 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 47.0 t -106.2 133.12 51.4 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.786 0.327 . . . . 20.0 111.789 -179.357 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 58.0 ttt85 -147.8 138.3 23.08 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 112.223 0.453 . . . . 20.0 112.223 179.582 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 12.5 pttp -94.45 146.84 23.8 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.08 -0.509 . . . . 20.0 109.706 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.603 HG21 ' O ' ' A' ' 63' ' ' PHE . 4.9 t -147.28 127.84 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.71 0 CA-C-O 121.485 0.659 . . . . 20.0 111.95 -179.206 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 135' ' ' ARG . . . . . 0.777 ' C ' HD22 ' A' ' 136' ' ' LEU . 31.4 ptt180 -93.13 121.2 34.24 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.87 -1.059 . . . . 20.0 109.966 179.193 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.777 HD22 ' C ' ' A' ' 135' ' ' ARG . 0.7 OUTLIER -114.45 126.55 55.09 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.395 0.517 . . . . 20.0 112.395 -178.497 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 1.166 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -53.43 84.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.551 -0.295 . . . . 20.0 111.713 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.63 ' HB2' ' HB2' ' A' ' 115' ' ' ARG . . . -64.72 -20.32 66.26 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.303 0.573 . . . . 20.0 110.152 179.28 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 36.1 t . . . . . 0 C--N 1.327 -0.377 0 CA-C-N 115.404 -0.816 . . . . 20.0 110.483 179.508 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 1.4 m170 . . . . . 0 N--CA 1.451 -0.385 0 N-CA-C 109.014 -0.736 . . . . 20.0 109.014 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 1.033 ' CE1' HG13 ' A' ' 79' ' ' VAL . 5.7 p90 -126.64 157.69 38.31 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.948 0.404 . . . . 20.0 111.711 -177.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.0 p -105.1 95.11 5.62 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.941 -0.572 . . . . 20.0 111.981 -179.101 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.733 ' O ' HG21 ' A' ' 75' ' ' VAL . 55.0 ttm-85 -116.98 125.11 50.9 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.263 -1.014 . . . . 20.0 108.263 177.969 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.712 ' C ' HD23 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -116.9 -79.81 0.59 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 113.442 0.904 . . . . 20.0 113.442 -177.13 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.914 HD21 ' HB ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -171.21 141.15 1.57 Allowed 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.443 -0.503 . . . . 20.0 112.293 -177.269 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.783 HG22 ' HG3' ' A' ' 70' ' ' ARG . 30.6 p -134.42 133.59 40.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.483 . . . . 20.0 110.395 178.248 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.507 ' O ' ' C ' ' A' ' 67' ' ' GLY . 15.0 t0 -148.86 -162.31 1.53 Allowed 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.365 -0.379 . . . . 20.0 110.056 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.841 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -31.2 148.25 0.01 OUTLIER Glycine 0 C--N 1.344 1.015 0 CA-C-O 118.343 -1.254 . . . . 20.0 110.485 179.563 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.488 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 19.5 Cg_exo -16.51 60.21 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 124.75 3.633 . . . . 20.0 113.993 -178.818 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.841 ' N ' ' O ' ' A' ' 67' ' ' GLY . 59.9 m -163.14 150.77 13.25 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 114.923 -1.035 . . . . 20.0 109.251 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.783 ' HG3' HG22 ' A' ' 65' ' ' THR . 57.3 ttt180 -145.68 124.55 12.69 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.84 0.352 . . . . 20.0 110.672 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.626 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -74.71 156.59 36.47 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 116.109 -0.496 . . . . 20.0 110.324 179.669 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -150.45 31.94 0.65 Allowed 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 113.305 0.854 . . . . 20.0 113.305 -179.47 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.655 ' O ' HG13 ' A' ' 75' ' ' VAL . 6.8 ttmt -75.24 144.97 79.46 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.985 -0.376 . . . . 20.0 109.985 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.459 ' HD2' ' CG ' ' A' ' 73' ' ' LYS . 50.2 Cg_exo -53.11 113.1 1.12 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.169 1.913 . . . . 20.0 112.002 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.733 HG21 ' O ' ' A' ' 62' ' ' ARG . 24.1 m -132.13 149.4 32.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.971 -0.559 . . . . 20.0 111.567 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 6.1 m -115.01 118.13 32.55 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.568 -0.53 . . . . 20.0 109.568 178.419 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.662 ' CD ' HD12 ' A' ' 136' ' ' LEU . 44.1 mm-40 -125.04 151.12 46.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.521 -0.308 . . . . 20.0 110.769 -179.528 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.497 HD12 ' N ' ' A' ' 78' ' ' LEU . 6.0 mp -119.34 125.55 49.3 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 113.054 0.761 . . . . 20.0 113.054 -179.014 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 1.033 HG13 ' CE1' ' A' ' 60' ' ' TYR . 2.5 m . . . . . 0 N--CA 1.448 -0.547 0 CA-C-N 114.473 -1.24 . . . . 20.0 109.698 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 21.0 t70 . . . . . 0 CA--C 1.532 0.26 0 N-CA-C 112.69 0.626 . . . . 20.0 112.69 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ARG . . . . . 0.475 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 39.2 ttm180 -119.31 151.0 39.18 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.732 0.301 . . . . 20.0 111.72 -178.865 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.836 ' CE2' HG13 ' A' ' 137' ' ' VAL . 4.4 m-85 -122.71 141.99 51.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.942 -0.572 . . . . 20.0 111.539 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.598 ' HB3' ' HB2' ' A' ' 138' ' ' ALA . 30.7 ttp180 -93.15 143.85 25.85 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 115.757 -0.656 . . . . 20.0 109.402 178.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -76.13 132.88 40.29 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.012 0.434 . . . . 20.0 111.198 -178.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.434 ' N ' ' O ' ' A' ' 134' ' ' VAL . 26.4 mm100 -125.31 137.39 54.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.829 -0.623 . . . . 20.0 110.723 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 70.6 ttt-85 -130.2 106.9 8.9 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.11 -0.495 . . . . 20.0 110.863 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.914 ' HB ' HD21 ' A' ' 64' ' ' LEU . 21.5 t -135.03 152.16 32.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.062 -0.517 . . . . 20.0 111.358 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.544 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 11.1 pt20 -92.24 130.27 37.98 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.512 -0.313 . . . . 20.0 110.406 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.619 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.2 OUTLIER -77.0 126.61 31.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.005 0.431 . . . . 20.0 110.8 -179.982 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.54 HD12 ' O ' ' A' ' 70' ' ' ARG . 0.3 OUTLIER -90.64 134.83 34.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.93 -0.577 . . . . 20.0 111.419 -179.388 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 123' ' ' CYS . . . . . 0.403 ' HB3' ' O ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.849 -0.614 . . . . 20.0 109.981 179.367 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.416 ' O ' ' HD2' ' A' ' 129' ' ' PRO . . . . . . . . 0 C--O 1.232 0.171 0 N-CA-C 111.896 0.332 . . . . 20.0 111.896 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -116.61 62.48 2.62 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 112.232 0.456 . . . . 20.0 112.232 -179.02 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 129' ' ' PRO . . . . . 0.416 ' HD2' ' O ' ' A' ' 127' ' ' ALA . 9.7 Cg_endo -49.91 146.7 16.01 Favored 'Trans proline' 0 N--CA 1.463 -0.295 0 C-N-CA 122.511 2.14 . . . . 20.0 110.898 178.612 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.551 ' HB2' HD12 ' A' ' 121' ' ' LEU . 14.6 mtp-105 -127.84 154.3 45.62 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 121.01 -0.276 . . . . 20.0 111.467 -179.056 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 99.7 p -105.18 139.85 39.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.326 -0.397 . . . . 20.0 111.303 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 53.9 ttt85 -145.51 138.9 26.41 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.085 0.469 . . . . 20.0 112.045 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -91.38 141.93 28.23 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.696 -0.684 . . . . 20.0 109.404 178.459 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.456 HG21 ' HB3' ' A' ' 64' ' ' LEU . 2.8 t -145.47 125.72 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 CA-C-O 121.318 0.58 . . . . 20.0 111.812 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 135' ' ' ARG . . . . . 0.64 ' O ' HD23 ' A' ' 136' ' ' LEU . 49.5 ptt85 -99.21 113.82 26.29 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.155 -0.929 . . . . 20.0 110.175 179.015 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.662 HD12 ' CD ' ' A' ' 77' ' ' GLU . 32.5 mt -127.61 148.99 50.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.067 0.46 . . . . 20.0 111.311 -179.801 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.836 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -57.55 92.75 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.728 -0.669 . . . . 20.0 112.397 -179.451 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.598 ' HB2' ' HB3' ' A' ' 115' ' ' ARG . . . -73.94 -13.06 60.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.142 0.496 . . . . 20.0 109.825 178.462 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 96.3 p . . . . . 0 C--N 1.333 -0.139 0 CA-C-N 115.697 -0.683 . . . . 20.0 110.089 179.108 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 4.2 m170 . . . . . 0 N--CA 1.466 0.33 0 CA-C-O 120.851 0.357 . . . . 20.0 110.991 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -119.83 159.32 24.82 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 112.432 0.53 . . . . 20.0 112.432 -178.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 42.5 p -123.62 83.85 2.19 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-N 115.705 -0.679 . . . . 20.0 110.442 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.689 ' O ' HG21 ' A' ' 75' ' ' VAL . 63.9 mtm180 -118.55 123.84 46.05 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 107.857 -1.164 . . . . 20.0 107.857 178.092 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.732 ' CD2' HG22 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -108.07 -78.71 0.58 Allowed 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.609 0.596 . . . . 20.0 112.609 -177.189 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.734 HD21 ' HB ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -169.09 138.43 2.12 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.539 -0.464 . . . . 20.0 112.133 -178.246 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.67 HG22 ' HG3' ' A' ' 70' ' ' ARG . 40.6 p -129.26 143.57 50.9 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.514 -0.55 . . . . 20.0 109.514 177.844 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.552 ' O ' ' C ' ' A' ' 67' ' ' GLY . 5.9 t0 -153.0 -162.69 1.54 Allowed 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.94 -0.393 . . . . 20.0 109.94 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.872 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -29.05 141.64 0.01 OUTLIER Glycine 0 C--N 1.345 1.039 0 CA-C-O 118.424 -1.209 . . . . 20.0 110.301 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.513 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 56.2 Cg_exo -15.77 55.02 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 125.287 3.991 . . . . 20.0 114.514 -178.414 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.872 ' N ' ' O ' ' A' ' 67' ' ' GLY . 19.6 m -162.81 167.34 23.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.005 -0.998 . . . . 20.0 108.537 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.67 ' HG3' HG22 ' A' ' 65' ' ' THR . 65.0 ttt180 -161.35 143.86 12.2 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.965 -0.294 . . . . 20.0 111.523 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.824 ' HA ' HD12 ' A' ' 122' ' ' LEU . 0.9 OUTLIER -83.86 171.17 13.34 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 116.442 -0.345 . . . . 20.0 110.253 178.996 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -152.29 25.54 0.61 Allowed 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 113.44 0.904 . . . . 20.0 113.44 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.579 ' HB2' HG11 ' A' ' 119' ' ' VAL . 0.2 OUTLIER -68.49 144.19 96.13 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 109.165 -0.679 . . . . 20.0 109.165 178.901 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.92 114.64 1.99 Allowed 'Trans proline' 0 CA--C 1.527 0.17 0 C-N-CA 122.411 2.074 . . . . 20.0 112.329 -179.168 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.732 HG22 ' CD2' ' A' ' 63' ' ' PHE . 16.1 m -130.85 155.36 41.84 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.167 0 CA-C-O 120.955 0.407 . . . . 20.0 111.518 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.521 HG22 HD11 ' A' ' 78' ' ' LEU . 70.4 m -116.36 123.93 48.82 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.99 -0.55 . . . . 20.0 110.601 179.015 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.602 ' OE1' HD13 ' A' ' 136' ' ' LEU . 52.6 tp10 -121.73 127.51 50.77 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.193 -0.458 . . . . 20.0 110.4 179.255 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.751 HD12 ' N ' ' A' ' 78' ' ' LEU . 1.7 mp -112.91 122.89 48.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.413 0.625 . . . . 20.0 111.551 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.816 HG23 ' O ' ' A' ' 79' ' ' VAL . 1.5 m . . . . . 0 C--N 1.322 -0.605 0 CA-C-O 122.065 0.936 . . . . 20.0 108.891 178.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 . . . . . 0 CA--C 1.53 0.194 0 N-CA-C 111.957 0.354 . . . . 20.0 111.957 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ARG . . . . . 0.558 ' O ' HG12 ' A' ' 137' ' ' VAL . 40.9 ttm180 -124.61 151.8 44.37 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.968 0.358 . . . . 20.0 111.968 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.906 ' CZ ' HG13 ' A' ' 137' ' ' VAL . 0.9 OUTLIER -130.11 152.92 49.03 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.609 -0.723 . . . . 20.0 111.724 -179.693 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.585 ' O ' ' HA ' ' A' ' 135' ' ' ARG . 18.3 ttm-85 -93.98 137.61 33.0 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 115.868 -0.605 . . . . 20.0 109.7 178.625 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -82.1 120.86 25.84 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.756 0.312 . . . . 20.0 110.847 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.491 ' CG ' ' O ' ' A' ' 134' ' ' VAL . 4.5 pt20 -133.55 139.55 46.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.98 0.419 . . . . 20.0 111.269 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.411 ' HG2' ' CB ' ' A' ' 133' ' ' LYS . 71.7 mtp85 -123.14 108.81 13.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.926 -0.579 . . . . 20.0 110.841 179.374 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.734 ' HB ' HD21 ' A' ' 64' ' ' LEU . 74.8 t -120.36 145.06 27.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.786 -0.643 . . . . 20.0 110.773 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.565 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 26.9 mp0 -88.0 127.82 35.39 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.208 -0.451 . . . . 20.0 110.445 -179.748 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.78 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.2 OUTLIER -76.68 126.99 31.94 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.393 0.616 . . . . 20.0 111.589 -178.61 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.824 HD12 ' HA ' ' A' ' 71' ' ' SER . 3.1 mp -89.38 141.99 28.06 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.083 -0.962 . . . . 20.0 111.713 -179.149 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' CYS . . . . . 0.513 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.2 OUTLIER . . . . . 0 C--N 1.322 -0.626 0 CA-C-N 115.563 -0.744 . . . . 20.0 109.248 178.271 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.111 0 CA-C-O 120.559 0.219 . . . . 20.0 111.567 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -121.52 60.77 10.88 Favored Pre-proline 0 C--N 1.332 -0.18 0 CA-C-O 120.944 0.402 . . . . 20.0 111.895 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -48.57 152.6 3.98 Favored 'Trans proline' 0 CA--C 1.528 0.213 0 C-N-CA 123.48 2.787 . . . . 20.0 112.483 179.325 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.78 ' HB2' HD12 ' A' ' 121' ' ' LEU . 80.5 mtt-85 -125.43 158.58 34.03 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.352 -0.385 . . . . 20.0 111.088 -179.249 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 9.7 t -114.66 136.67 52.79 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.511 -0.313 . . . . 20.0 110.742 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 132' ' ' ARG . . . . . 0.426 ' HD3' ' HB2' ' A' ' 64' ' ' LEU . 52.9 ttt85 -148.74 136.05 20.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.848 0.356 . . . . 20.0 111.793 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.411 ' CB ' ' HG2' ' A' ' 118' ' ' ARG . 25.1 pttm -96.45 140.53 30.96 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.69 -0.485 . . . . 20.0 109.69 178.688 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.491 ' O ' ' CG ' ' A' ' 117' ' ' GLN . 7.8 t -145.44 125.96 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 CA-C-O 121.198 0.523 . . . . 20.0 111.779 -178.802 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 135' ' ' ARG . . . . . 0.598 ' HG2' ' HB2' ' A' ' 114' ' ' TYR . 39.1 ttt180 -99.03 111.9 24.17 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.561 -0.745 . . . . 20.0 109.43 178.325 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.602 HD13 ' OE1' ' A' ' 77' ' ' GLU . 22.0 mt -113.31 140.04 48.34 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.749 0.648 . . . . 20.0 112.749 -178.426 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.906 HG13 ' CZ ' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -58.93 84.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 CA-C-N 116.219 -0.446 . . . . 20.0 111.455 179.43 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.418 ' HB1' HH21 ' A' ' 115' ' ' ARG . . . -74.14 -12.06 60.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.94 0.4 . . . . 20.0 110.43 179.34 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.5 t . . . . . 0 C--N 1.332 -0.189 0 CA-C-N 115.89 -0.595 . . . . 20.0 110.358 179.231 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 5.9 m170 . . . . . 0 N--CA 1.453 -0.296 0 CA-C-O 120.829 0.347 . . . . 20.0 110.576 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.774 ' CE1' HG13 ' A' ' 79' ' ' VAL . 0.5 OUTLIER -143.5 163.07 34.17 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.212 -0.449 . . . . 20.0 110.362 -179.858 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 30.1 p -106.99 93.32 4.49 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 112.862 0.69 . . . . 20.0 112.862 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.936 ' O ' HG21 ' A' ' 75' ' ' VAL . 23.1 mtt-85 -127.26 127.71 44.83 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 108.043 -1.095 . . . . 20.0 108.043 176.678 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.586 ' C ' HD23 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -118.47 -79.51 0.6 Allowed 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 113.053 0.76 . . . . 20.0 113.053 -177.0 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 1.076 HD11 HG23 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -166.43 136.96 3.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.014 0.435 . . . . 20.0 111.984 -178.314 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 59.9 p -129.88 140.01 51.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.719 -0.673 . . . . 20.0 110.356 178.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.535 ' O ' ' C ' ' A' ' 67' ' ' GLY . 11.7 t0 -147.86 -164.32 1.98 Allowed 'General case' 0 C--O 1.236 0.353 0 N-CA-C 109.968 -0.382 . . . . 20.0 109.968 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.866 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -30.67 146.04 0.01 OUTLIER Glycine 0 C--N 1.343 0.963 0 N-CA-C 110.2 -1.16 . . . . 20.0 110.2 179.48 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.493 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 59.4 Cg_exo -16.43 55.19 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 125.256 3.971 . . . . 20.0 115.037 -178.365 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.866 ' N ' ' O ' ' A' ' 67' ' ' GLY . 33.4 m -163.89 163.8 23.59 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.476 -0.935 . . . . 20.0 108.476 178.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.474 ' HG3' ' O ' ' A' ' 69' ' ' CYS . 82.1 mtt85 -157.71 148.02 20.68 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.342 0.591 . . . . 20.0 112.357 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.814 ' HA ' HD12 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -88.26 164.06 15.79 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 115.302 -0.863 . . . . 20.0 109.952 178.568 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.411 ' HA ' ' CE1' ' A' ' 63' ' ' PHE . . . -149.73 26.77 0.82 Allowed 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 119.957 -0.697 . . . . 20.0 112.734 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.724 ' CB ' HG11 ' A' ' 119' ' ' VAL . 1.3 mptp? -73.58 145.7 85.1 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-O 120.888 0.375 . . . . 20.0 110.277 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -49.84 123.03 9.98 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.797 2.331 . . . . 20.0 112.79 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.936 HG21 ' O ' ' A' ' 62' ' ' ARG . 23.9 m -137.73 145.53 28.9 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.162 0 CA-C-N 116.053 -0.521 . . . . 20.0 111.503 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 21.3 m -123.18 115.27 21.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.915 -0.584 . . . . 20.0 109.625 178.367 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.577 ' CD ' HD12 ' A' ' 136' ' ' LEU . 48.1 mt-10 -130.26 163.43 26.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.629 0.252 . . . . 20.0 110.818 -179.527 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.686 HD13 ' O ' ' A' ' 137' ' ' VAL . 6.0 mp -118.11 136.69 53.43 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 121.139 0.495 . . . . 20.0 111.578 179.098 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.81 HG23 ' O ' ' A' ' 79' ' ' VAL . 19.7 m . . . . . 0 C--N 1.325 -0.479 0 CA-C-N 115.677 -0.692 . . . . 20.0 110.287 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 . . . . . 0 CA--C 1.531 0.224 0 N-CA-C 111.922 0.342 . . . . 20.0 111.922 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ARG . . . . . 0.543 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 24.9 ttm105 -125.93 145.18 50.38 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.525 0.202 . . . . 20.0 111.224 -179.582 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.874 ' CD1' HG13 ' A' ' 137' ' ' VAL . 0.8 OUTLIER -118.57 159.82 22.88 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 121.448 0.642 . . . . 20.0 111.941 -179.513 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.62 ' HB2' ' HB2' ' A' ' 138' ' ' ALA . 38.5 ttm-85 -100.89 140.45 35.16 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 114.768 -1.105 . . . . 20.0 108.702 178.191 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -80.45 123.32 27.96 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 116.116 -0.493 . . . . 20.0 111.394 -178.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.69 ' HG2' HD23 ' A' ' 136' ' ' LEU . 22.6 mm100 -124.93 124.77 42.74 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.971 -0.559 . . . . 20.0 109.887 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 67.0 ttp85 -130.28 92.43 3.28 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.025 0.441 . . . . 20.0 111.055 -179.553 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 1.076 HG23 HD11 ' A' ' 64' ' ' LEU . 35.1 m -126.3 170.22 16.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.562 -0.745 . . . . 20.0 110.666 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.555 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 13.0 pt20 -110.94 138.58 47.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.998 0.428 . . . . 20.0 110.946 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.827 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -75.82 125.04 28.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.975 -0.557 . . . . 20.0 110.928 -179.608 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.814 HD12 ' HA ' ' A' ' 71' ' ' SER . 1.9 mp -91.45 142.96 27.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.478 -0.783 . . . . 20.0 111.742 -178.78 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' CYS . . . . . 0.493 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.4 OUTLIER . . . . . 0 C--N 1.323 -0.564 0 CA-C-N 115.372 -0.831 . . . . 20.0 110.538 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.207 0 N-CA-C 112.053 0.39 . . . . 20.0 112.053 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -125.87 56.36 15.25 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 120.905 0.383 . . . . 20.0 111.506 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -52.82 146.92 33.97 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.642 2.228 . . . . 20.0 111.458 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.827 ' HB2' HD12 ' A' ' 121' ' ' LEU . 79.8 mtt85 -125.69 150.6 47.51 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.16 -0.473 . . . . 20.0 111.112 -179.126 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.541 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 14.1 p -102.94 133.76 47.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.955 -0.566 . . . . 20.0 110.449 179.789 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 67.6 ttt180 -144.8 141.48 29.21 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.002 -0.545 . . . . 20.0 111.269 -179.234 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 14.4 pttp -103.3 149.65 24.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 20.0 110.414 179.206 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.557 HG23 ' HB2' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -151.88 130.28 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 CA-C-O 121.195 0.521 . . . . 20.0 111.399 -179.279 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 135' ' ' ARG . . . . . 0.67 ' C ' HD22 ' A' ' 136' ' ' LEU . 86.1 mtm-85 -91.15 122.6 33.93 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.603 -0.726 . . . . 20.0 109.719 178.594 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.83 HD22 ' N ' ' A' ' 136' ' ' LEU . 0.7 OUTLIER -121.23 127.01 51.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.252 0.549 . . . . 20.0 112.341 -178.655 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.874 HG13 ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -55.49 92.0 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.937 -0.574 . . . . 20.0 111.803 179.639 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.62 ' HB2' ' HB2' ' A' ' 115' ' ' ARG . . . -81.48 -5.72 58.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.196 -0.456 . . . . 20.0 110.616 179.303 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 115.756 -0.656 . . . . 20.0 109.677 179.273 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 59' ' ' HIS . . . . . 0.407 ' C ' ' CD1' ' A' ' 60' ' ' TYR . 24.0 m170 . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.771 0.32 . . . . 20.0 110.717 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.66 ' CD1' HG13 ' A' ' 79' ' ' VAL . 2.7 m-85 -132.06 150.08 52.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 20.0 111.381 -179.007 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -97.51 96.99 8.7 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.984 -0.553 . . . . 20.0 111.75 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.943 ' O ' HG21 ' A' ' 75' ' ' VAL . 23.2 tpt180 -126.28 121.6 33.11 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 107.714 -1.217 . . . . 20.0 107.714 177.709 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.606 ' CD2' ' O ' ' A' ' 73' ' ' LYS . 0.0 OUTLIER -112.48 -81.28 0.59 Allowed 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.003 -0.679 . . . . 20.0 112.702 -177.445 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.922 HD21 ' HB ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -169.06 137.6 2.02 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.214 -0.594 . . . . 20.0 112.203 -178.192 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.923 HG22 ' HG3' ' A' ' 70' ' ' ARG . 51.9 p -129.74 136.42 49.63 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.721 -0.672 . . . . 20.0 109.246 178.329 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.527 ' O ' ' C ' ' A' ' 67' ' ' GLY . 8.6 t0 -148.82 -158.31 0.9 Allowed 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.606 -0.438 . . . . 20.0 111.008 -179.195 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.864 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -31.37 141.5 0.04 OUTLIER Glycine 0 C--N 1.346 1.118 0 N-CA-C 109.718 -1.353 . . . . 20.0 109.718 179.518 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.521 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 20.1 Cg_exo -15.54 53.16 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.889 1 C-N-CA 125.409 4.072 . . . . 20.0 115.48 -178.207 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.864 ' N ' ' O ' ' A' ' 67' ' ' GLY . 65.4 m -159.29 162.85 36.1 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 107.885 -1.154 . . . . 20.0 107.885 178.093 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.923 ' HG3' HG22 ' A' ' 65' ' ' THR . 62.5 ttt180 -148.41 137.94 22.1 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.567 0.58 . . . . 20.0 112.567 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.637 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.6 OUTLIER -81.15 162.91 23.46 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 115.931 -0.577 . . . . 20.0 110.278 178.543 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -151.7 27.83 0.63 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.942 0.719 . . . . 20.0 112.942 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.611 ' HB2' ' CG1' ' A' ' 119' ' ' VAL . 9.9 tttt -71.17 150.5 94.56 Favored Pre-proline 0 C--N 1.327 -0.379 0 N-CA-C 109.85 -0.426 . . . . 20.0 109.85 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.557 ' HD2' ' CG ' ' A' ' 73' ' ' LYS . 41.9 Cg_exo -59.85 115.07 2.37 Favored 'Trans proline' 0 N--CA 1.464 -0.247 0 C-N-CA 122.175 1.917 . . . . 20.0 112.241 -179.258 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.943 HG21 ' O ' ' A' ' 62' ' ' ARG . 4.9 m -134.77 155.42 38.43 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.202 0 CA-C-N 115.676 -0.693 . . . . 20.0 111.062 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 18.7 m -126.76 121.76 32.89 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.717 -0.674 . . . . 20.0 109.813 179.135 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.511 ' CB ' HD13 ' A' ' 136' ' ' LEU . 6.1 pt-20 -130.58 150.78 51.62 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.041 0.448 . . . . 20.0 111.404 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.628 HD12 ' N ' ' A' ' 78' ' ' LEU . 5.2 mp -102.6 141.09 35.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.884 -0.598 . . . . 20.0 111.104 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.66 HG13 ' CD1' ' A' ' 60' ' ' TYR . 5.8 m . . . . . 0 N--CA 1.446 -0.641 0 N-CA-C 109.207 -0.664 . . . . 20.0 109.207 178.684 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 10.5 t70 . . . . . 0 N--CA 1.456 -0.162 0 CA-C-O 120.876 0.37 . . . . 20.0 111.232 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ARG . . . . . 0.528 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 21.4 ttm180 -125.92 141.93 51.75 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.088 -0.506 . . . . 20.0 111.008 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.867 ' CE2' HG13 ' A' ' 137' ' ' VAL . 0.8 OUTLIER -116.59 159.39 22.21 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-O 121.677 0.751 . . . . 20.0 112.098 -179.477 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.412 ' N ' ' O ' ' A' ' 136' ' ' LEU . 47.2 ttm-85 -97.5 146.49 25.19 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 114.423 -1.262 . . . . 20.0 108.413 177.684 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -83.31 136.42 34.38 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 120.717 -0.393 . . . . 20.0 111.691 -178.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.767 ' HB2' HG23 ' A' ' 134' ' ' VAL . 27.9 mm100 -134.47 135.26 42.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.984 -0.553 . . . . 20.0 110.81 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 58.3 ttt-85 -128.38 93.96 3.77 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.359 -0.382 . . . . 20.0 110.298 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.922 ' HB ' HD21 ' A' ' 64' ' ' LEU . 25.1 t -129.17 144.69 37.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 N-CA-C 112.501 0.556 . . . . 20.0 112.501 -178.469 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.501 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 19.0 pt20 -88.24 131.15 34.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.169 -0.469 . . . . 20.0 110.711 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.594 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -77.26 116.15 17.63 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.08 -0.509 . . . . 20.0 111.163 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.469 HD12 ' HA ' ' A' ' 71' ' ' SER . 0.2 OUTLIER -80.27 150.67 29.92 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.6 -0.727 . . . . 20.0 111.107 -179.922 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 123' ' ' CYS . . . . . 0.521 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER . . . . . 0 C--N 1.332 -0.184 0 CA-C-O 120.827 0.346 . . . . 20.0 110.81 179.433 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.465 ' C ' ' HD3' ' A' ' 129' ' ' PRO . . . . . . . . 0 N--CA 1.462 0.129 0 N-CA-C 112.968 0.729 . . . . 20.0 112.968 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -114.16 60.52 1.0 Allowed Pre-proline 0 C--N 1.327 -0.375 0 CA-C-O 121.093 0.473 . . . . 20.0 110.533 178.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 129' ' ' PRO . . . . . 0.465 ' HD3' ' C ' ' A' ' 127' ' ' ALA . 41.3 Cg_endo -68.62 146.88 68.79 Favored 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 123.38 2.72 . . . . 20.0 112.71 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.563 ' HB2' HD12 ' A' ' 121' ' ' LEU . 83.2 mtt85 -134.35 148.36 50.7 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.874 -0.603 . . . . 20.0 110.46 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.495 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 57.8 p -89.8 141.12 28.93 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 121.096 -0.241 . . . . 20.0 110.869 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' ARG . . . . . 0.425 ' HB3' HD13 ' A' ' 64' ' ' LEU . 53.4 ttt85 -146.86 148.39 31.8 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.135 0.493 . . . . 20.0 112.135 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 1.9 pttt -101.39 145.72 28.55 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 115.382 -0.826 . . . . 20.0 109.884 178.57 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.767 HG23 ' HB2' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -149.29 126.54 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-O 121.399 0.619 . . . . 20.0 111.448 179.86 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 135' ' ' ARG . . . . . 0.595 ' C ' HD23 ' A' ' 136' ' ' LEU . 85.1 mtm180 -95.42 112.76 24.42 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.061 -0.972 . . . . 20.0 109.771 179.063 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.595 HD23 ' C ' ' A' ' 135' ' ' ARG . 1.7 mt -113.99 125.35 53.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.524 0.678 . . . . 20.0 112.677 -179.489 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.867 HG13 ' CE2' ' A' ' 114' ' ' TYR . 2.3 m -55.39 90.77 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.088 -0.96 . . . . 20.0 112.835 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -65.53 -25.46 67.46 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.488 -0.93 . . . . 20.0 108.488 177.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 26.3 p . . . . . 0 CA--C 1.531 0.223 0 CA-C-N 114.992 -1.004 . . . . 20.0 110.632 179.146 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 59' ' ' HIS . . . . . 0.417 ' C ' ' CD1' ' A' ' 60' ' ' TYR . 9.0 m170 . . . . . 0 CA--C 1.52 -0.193 0 CA-C-O 121.052 0.453 . . . . 20.0 111.181 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.655 ' CD1' HG13 ' A' ' 79' ' ' VAL . 10.2 m-85 -133.77 148.74 51.4 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.732 -0.667 . . . . 20.0 111.697 -178.684 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 73.2 p -103.29 82.46 2.06 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.178 -0.465 . . . . 20.0 111.318 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.904 ' O ' HG21 ' A' ' 75' ' ' VAL . 68.0 ttt180 -114.93 123.19 48.5 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 108.405 -0.961 . . . . 20.0 108.405 177.846 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.931 ' O ' HG11 ' A' ' 134' ' ' VAL . 0.1 OUTLIER -110.6 -80.24 0.58 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.154 0.427 . . . . 20.0 112.154 -177.859 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.675 ' O ' HD23 ' A' ' 121' ' ' LEU . 0.0 OUTLIER -166.92 133.97 2.43 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.62 -0.432 . . . . 20.0 111.089 -178.887 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 49.4 p -131.04 141.68 50.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.355 -0.384 . . . . 20.0 110.756 179.538 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.525 ' O ' ' C ' ' A' ' 67' ' ' GLY . 9.3 t0 -152.37 -163.92 1.84 Allowed 'General case' 0 C--O 1.236 0.382 0 N-CA-C 109.785 -0.45 . . . . 20.0 109.785 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.861 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -31.85 148.17 0.01 OUTLIER Glycine 0 C--N 1.345 1.058 0 CA-C-O 118.098 -1.39 . . . . 20.0 110.167 179.135 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.524 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 41.6 Cg_exo -18.14 54.44 0.0 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 124.971 3.78 . . . . 20.0 115.289 -178.255 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.861 ' N ' ' O ' ' A' ' 67' ' ' GLY . 59.1 m -162.66 153.76 17.45 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 115.603 -0.726 . . . . 20.0 109.117 179.118 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.526 ' O ' ' N ' ' A' ' 122' ' ' LEU . 95.5 mtt180 -150.29 150.01 30.92 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.213 0.53 . . . . 20.0 112.335 -179.672 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.633 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -90.21 161.52 15.68 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 115.445 -0.798 . . . . 20.0 110.105 178.496 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.18 35.17 0.99 Allowed 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 114.276 1.213 . . . . 20.0 114.276 -179.31 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.985 ' HB2' HG11 ' A' ' 119' ' ' VAL . 0.9 OUTLIER -80.19 157.75 72.89 Favored Pre-proline 0 C--N 1.327 -0.387 0 C-N-CA 120.632 -0.427 . . . . 20.0 109.989 178.736 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.408 ' HD2' ' HG3' ' A' ' 73' ' ' LYS . 28.7 Cg_endo -61.92 116.27 3.35 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.479 2.12 . . . . 20.0 112.513 -179.363 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.904 HG21 ' O ' ' A' ' 62' ' ' ARG . 8.3 m -133.71 154.44 38.51 Favored 'Isoleucine or valine' 0 C--O 1.23 0.037 0 CA-C-O 120.857 0.36 . . . . 20.0 111.675 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 45.4 m -117.93 121.49 40.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.96 -0.563 . . . . 20.0 109.98 178.721 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.661 ' C ' HD12 ' A' ' 78' ' ' LEU . 81.0 tt0 -123.92 141.52 51.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.962 0.41 . . . . 20.0 111.814 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 1.02 HD13 ' O ' ' A' ' 137' ' ' VAL . 1.5 mp -117.57 125.68 51.23 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.864 -0.607 . . . . 20.0 110.965 179.297 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.794 HG23 ' O ' ' A' ' 79' ' ' VAL . 18.5 m . . . . . 0 N--CA 1.446 -0.657 0 CA-C-N 115.779 -0.646 . . . . 20.0 110.746 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 . . . . . 0 CA--C 1.528 0.13 0 N-CA-C 112.327 0.491 . . . . 20.0 112.327 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 113' ' ' ARG . . . . . 0.447 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 42.3 ttm180 -121.69 147.87 45.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.033 0.444 . . . . 20.0 112.002 -178.597 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 1.019 ' CE2' HG13 ' A' ' 137' ' ' VAL . 0.1 OUTLIER -125.76 158.72 34.19 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.822 -0.626 . . . . 20.0 111.3 179.844 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 62.0 ttm-85 -93.51 142.53 27.24 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.661 -0.866 . . . . 20.0 108.661 178.036 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -80.78 132.81 35.55 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.138 0.494 . . . . 20.0 111.771 -178.426 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.83 ' HB2' HG23 ' A' ' 134' ' ' VAL . 27.8 mm100 -129.62 144.32 51.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.457 -0.792 . . . . 20.0 109.967 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 48.7 ttp180 -139.65 91.08 2.45 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.507 -0.315 . . . . 20.0 110.7 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.985 HG11 ' HB2' ' A' ' 73' ' ' LYS . 0.6 OUTLIER -125.57 164.37 25.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.387 -0.37 . . . . 20.0 110.885 -179.869 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.553 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 14.0 pt20 -106.22 138.37 42.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.155 0.503 . . . . 20.0 111.137 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.832 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -79.43 126.91 31.45 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.573 -0.739 . . . . 20.0 111.443 -179.787 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.526 ' N ' ' O ' ' A' ' 70' ' ' ARG . 0.3 OUTLIER -76.2 144.53 40.41 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.236 -0.893 . . . . 20.0 109.773 179.29 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 3.0 m . . . . . 0 C--N 1.324 -0.505 0 CA-C-N 116.104 -0.498 . . . . 20.0 110.113 -178.977 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.19 0 N-CA-C 112.382 0.512 . . . . 20.0 112.382 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -120.44 66.28 12.38 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-O 121.096 0.474 . . . . 20.0 110.393 179.138 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_endo -52.05 148.88 22.57 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 123.101 2.534 . . . . 20.0 112.635 -179.551 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.832 ' HB2' HD12 ' A' ' 121' ' ' LEU . 56.7 mtp85 -125.75 151.55 46.54 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.039 -0.528 . . . . 20.0 110.496 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.44 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 47.5 t -102.72 135.88 43.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.682 0.277 . . . . 20.0 110.392 179.653 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 25.7 tpt180 -144.72 144.82 31.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.169 0.509 . . . . 20.0 111.745 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 18.2 pttp -99.19 143.7 29.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.473 -0.785 . . . . 20.0 109.664 178.605 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.931 HG11 ' O ' ' A' ' 63' ' ' PHE . 3.1 m -146.33 130.0 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 CA-C-O 121.349 0.595 . . . . 20.0 111.252 -179.599 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 135' ' ' ARG . . . . . 0.825 ' C ' HD22 ' A' ' 136' ' ' LEU . 83.2 mtt-85 -92.79 127.79 38.42 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.128 -0.942 . . . . 20.0 110.207 179.424 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.825 HD22 ' C ' ' A' ' 135' ' ' ARG . 0.8 OUTLIER -117.6 114.38 23.33 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.005 0.372 . . . . 20.0 112.005 -178.871 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 1.02 ' O ' HD13 ' A' ' 78' ' ' LEU . 0.0 OUTLIER -59.74 76.51 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.798 0.333 . . . . 20.0 110.349 178.832 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.538 ' N ' ' O ' ' A' ' 136' ' ' LEU . . . -66.47 -10.46 44.55 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.196 -0.456 . . . . 20.0 110.832 -179.64 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 51.6 p . . . . . 0 C--N 1.326 -0.423 0 CA-C-N 115.882 -0.599 . . . . 20.0 110.108 179.28 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.233 0.205 0 CA-C-O 120.785 0.326 . . . . 20.0 110.706 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.74 ' CD1' HG13 ' A' ' 79' ' ' VAL . 12.7 m-85 -127.58 149.02 50.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.201 -0.454 . . . . 20.0 112.002 -179.078 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 57.8 p -107.95 90.46 3.3 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.802 -0.636 . . . . 20.0 111.518 -179.446 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.945 ' O ' HG21 ' A' ' 75' ' ' VAL . 40.7 mmt180 -120.52 125.03 46.83 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.524 -0.917 . . . . 20.0 108.524 178.079 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.575 ' CD1' ' O ' ' A' ' 73' ' ' LYS . 0.0 OUTLIER -112.88 -82.88 0.59 Allowed 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.729 0.64 . . . . 20.0 112.729 -178.185 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.625 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -168.84 141.83 2.84 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.475 -0.49 . . . . 20.0 112.136 -178.201 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.683 HG22 ' HG3' ' A' ' 70' ' ' ARG . 81.1 p -134.98 134.61 40.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.265 -0.425 . . . . 20.0 110.681 178.515 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.73 ' HB2' HD13 ' A' ' 121' ' ' LEU . 92.1 m-20 -141.32 -165.52 1.99 Allowed 'General case' 0 C--O 1.237 0.426 0 N-CA-C 109.7 -0.481 . . . . 20.0 109.7 179.411 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.786 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -30.32 143.98 0.01 OUTLIER Glycine 0 C--N 1.345 1.055 0 N-CA-C 110.243 -1.143 . . . . 20.0 110.243 179.334 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.505 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 14.1 Cg_exo -16.07 58.73 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 125.193 3.929 . . . . 20.0 115.412 -178.077 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.786 ' N ' ' O ' ' A' ' 67' ' ' GLY . 59.8 m -164.11 158.86 19.74 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 108.168 -1.049 . . . . 20.0 108.168 178.201 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.683 ' HG3' HG22 ' A' ' 65' ' ' THR . 49.4 ttp180 -150.81 143.16 24.26 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.93 0.715 . . . . 20.0 112.93 -179.312 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.625 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -84.28 160.77 20.67 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 115.202 -0.908 . . . . 20.0 110.36 178.554 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -147.51 28.05 0.99 Allowed 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 113.47 0.915 . . . . 20.0 113.47 -179.587 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 1.048 ' HB2' HG11 ' A' ' 119' ' ' VAL . 1.0 OUTLIER -72.95 155.8 90.22 Favored Pre-proline 0 C--N 1.324 -0.509 0 C-N-CA 120.548 -0.461 . . . . 20.0 110.09 179.268 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -61.3 119.45 6.6 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.352 2.035 . . . . 20.0 111.97 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.945 HG21 ' O ' ' A' ' 62' ' ' ARG . 11.1 m -135.71 147.01 28.75 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 CA-C-N 116.422 -0.354 . . . . 20.0 111.191 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 41.2 m -113.79 123.95 51.07 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.021 0.438 . . . . 20.0 110.294 178.809 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.613 ' C ' HD12 ' A' ' 78' ' ' LEU . 40.0 tp10 -128.67 138.36 52.12 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.713 -0.676 . . . . 20.0 110.401 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.887 HD13 ' O ' ' A' ' 137' ' ' VAL . 1.4 mp -115.39 134.21 55.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.43 -0.35 . . . . 20.0 110.56 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.782 HG23 ' O ' ' A' ' 79' ' ' VAL . 15.1 m . . . . . 0 N--CA 1.449 -0.52 0 CA-C-O 121.005 0.431 . . . . 20.0 111.335 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 83.4 m-20 . . . . . 0 N--CA 1.455 -0.184 0 CA-C-O 120.633 0.254 . . . . 20.0 111.668 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 113' ' ' ARG . . . . . 0.536 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 38.9 ttm180 -118.07 151.95 36.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.734 0.302 . . . . 20.0 111.493 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.919 ' CE2' HG13 ' A' ' 137' ' ' VAL . 2.5 m-85 -127.82 164.18 22.76 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.611 0.72 . . . . 20.0 111.699 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.417 ' N ' ' O ' ' A' ' 136' ' ' LEU . 49.0 ttm-85 -99.21 145.27 27.42 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 114.732 -1.122 . . . . 20.0 108.078 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -90.59 115.11 27.47 Favored 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 120.164 -0.614 . . . . 20.0 111.187 -179.055 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -132.22 137.3 47.51 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.068 -0.514 . . . . 20.0 111.352 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' ARG . . . . . 0.499 ' HG2' ' HA ' ' A' ' 133' ' ' LYS . 87.6 mtt-85 -127.94 111.9 14.09 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.686 -0.688 . . . . 20.0 109.946 179.455 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 1.048 HG11 ' HB2' ' A' ' 73' ' ' LYS . 38.8 t -127.46 146.23 33.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 116.188 -0.46 . . . . 20.0 111.89 -178.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.579 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 28.3 mp0 -78.15 131.34 37.17 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 116.208 -0.451 . . . . 20.0 111.13 -179.799 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.905 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.3 OUTLIER -79.3 122.13 25.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 20.0 109.984 179.569 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.75 136.71 34.06 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.383 0.611 . . . . 20.0 111.851 -178.421 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' CYS . . . . . 0.505 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.497 0 CA-C-N 115.359 -0.837 . . . . 20.0 109.986 179.289 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.139 0 N-CA-C 112.399 0.518 . . . . 20.0 112.399 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -121.29 57.08 6.42 Favored Pre-proline 0 C--N 1.33 -0.254 0 N-CA-C 112.269 0.47 . . . . 20.0 112.269 -179.077 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' PRO . . . . . 0.499 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 37.7 Cg_endo -67.4 141.46 56.24 Favored 'Trans proline' 0 CA--C 1.528 0.221 0 C-N-CA 122.512 2.141 . . . . 20.0 111.722 178.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.905 ' HB2' HD12 ' A' ' 121' ' ' LEU . 84.5 mtt180 -139.64 136.47 34.36 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 121.019 -0.272 . . . . 20.0 111.511 -179.578 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 28.1 t -88.1 133.75 33.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.85 0.357 . . . . 20.0 111.43 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 132' ' ' ARG . . . . . 0.495 ' HD3' ' HB2' ' A' ' 64' ' ' LEU . 58.1 ttt85 -139.94 138.08 35.29 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.119 -0.491 . . . . 20.0 111.783 -179.698 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.499 ' HA ' ' HG2' ' A' ' 118' ' ' ARG . 12.0 pttt -87.08 142.94 27.55 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.103 -0.498 . . . . 20.0 110.122 179.015 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.611 HG12 ' CD2' ' A' ' 136' ' ' LEU . 15.6 t -142.58 126.03 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 CA-C-O 121.284 0.564 . . . . 20.0 111.477 -179.611 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 135' ' ' ARG . . . . . 0.48 ' O ' ' CD2' ' A' ' 114' ' ' TYR . 99.7 mtt180 -95.13 99.07 11.11 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.152 -0.931 . . . . 20.0 109.265 178.148 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.611 ' CD2' HG12 ' A' ' 134' ' ' VAL . 5.3 mt -104.78 133.85 48.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.461 0.648 . . . . 20.0 112.502 -179.335 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.919 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.3 OUTLIER -68.93 89.34 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.286 -0.87 . . . . 20.0 112.106 -179.587 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -72.32 -12.6 61.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.333 0.587 . . . . 20.0 109.481 178.571 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 5.6 t . . . . . 0 CA--C 1.529 0.165 0 CA-C-N 115.246 -0.888 . . . . 20.0 110.303 179.048 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 59' ' ' HIS . . . . . 0.603 ' CG ' HG22 ' A' ' 76' ' ' THR . 30.0 m170 . . . . . 0 C--O 1.232 0.178 0 N-CA-C 112.022 0.379 . . . . 20.0 112.022 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.655 ' CZ ' HG12 ' A' ' 79' ' ' VAL . 0.2 OUTLIER -153.55 168.67 25.38 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.24 -0.436 . . . . 20.0 111.198 179.514 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.627 ' CG2' ' CZ ' ' A' ' 63' ' ' PHE . 32.3 m -93.8 126.58 39.07 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.87 0.843 . . . . 20.0 112.912 -178.434 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.862 ' O ' HG21 ' A' ' 75' ' ' VAL . 40.7 mtm180 -169.43 121.01 0.72 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.21 -1.359 . . . . 20.0 108.038 177.83 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.627 ' CZ ' ' CG2' ' A' ' 61' ' ' THR . 0.0 OUTLIER -120.28 -81.04 0.63 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 113.027 0.751 . . . . 20.0 113.027 -178.047 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.913 HD21 ' HB ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -166.58 139.68 3.85 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.169 0.433 . . . . 20.0 112.169 -177.756 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.466 ' O ' ' OD1' ' A' ' 66' ' ' ASP . 68.9 p -133.42 128.29 35.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.805 -0.634 . . . . 20.0 110.232 178.68 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.918 ' HB2' HD13 ' A' ' 121' ' ' LEU . 73.6 m-20 -139.42 -165.06 1.79 Allowed 'General case' 0 C--O 1.236 0.346 0 N-CA-C 110.011 -0.366 . . . . 20.0 110.011 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.833 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -29.59 144.61 0.01 OUTLIER Glycine 0 C--N 1.344 0.988 0 CA-C-O 118.798 -1.001 . . . . 20.0 110.733 179.47 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.504 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 39.0 Cg_exo -14.91 54.51 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.723 1 C-N-CA 125.949 4.433 . . . . 20.0 115.106 -178.756 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.833 ' N ' ' O ' ' A' ' 67' ' ' GLY . 17.1 m -163.27 157.67 20.55 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.138 -1.06 . . . . 20.0 108.138 178.677 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -145.98 146.92 31.19 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.091 0.472 . . . . 20.0 112.042 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.623 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -89.23 160.72 16.79 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 115.512 -0.767 . . . . 20.0 109.955 178.861 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -149.87 28.49 0.76 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 114.21 1.189 . . . . 20.0 114.21 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.589 ' O ' ' CD2' ' A' ' 63' ' ' PHE . 17.3 tttt -73.72 140.48 78.18 Favored Pre-proline 0 C--N 1.328 -0.332 0 C-N-CA 120.551 -0.459 . . . . 20.0 110.164 178.872 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.531 ' HD2' ' HG2' ' A' ' 73' ' ' LYS . 63.9 Cg_exo -51.34 125.87 17.7 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 122.392 2.061 . . . . 20.0 112.419 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.862 HG21 ' O ' ' A' ' 62' ' ' ARG . 26.3 m -133.63 163.25 37.97 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.159 0 CA-C-O 121.123 0.487 . . . . 20.0 112.033 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.603 HG22 ' CG ' ' A' ' 59' ' ' HIS . 0.2 OUTLIER -136.76 100.37 4.3 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.635 -0.711 . . . . 20.0 109.916 178.944 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.598 ' CD ' HD12 ' A' ' 136' ' ' LEU . 83.5 mt-10 -114.43 162.98 15.96 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.1 -0.5 . . . . 20.0 111.568 -178.81 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.834 HD13 ' O ' ' A' ' 137' ' ' VAL . 5.6 mp -111.1 142.35 43.39 Favored 'General case' 0 CA--C 1.512 -0.498 0 CA-C-O 121.355 0.598 . . . . 20.0 111.302 179.125 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.82 HG23 ' O ' ' A' ' 79' ' ' VAL . 7.7 m . . . . . 0 C--N 1.318 -0.796 0 CA-C-N 115.294 -0.866 . . . . 20.0 110.718 -179.279 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 . . . . . 0 CA--C 1.529 0.156 0 N-CA-C 112.552 0.575 . . . . 20.0 112.552 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 113' ' ' ARG . . . . . 0.427 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 60.9 ttm-85 -122.99 142.72 50.53 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.436 -0.347 . . . . 20.0 111.376 -179.017 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.886 ' CD2' HG13 ' A' ' 137' ' ' VAL . 0.7 OUTLIER -118.61 158.1 26.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.093 0.473 . . . . 20.0 111.296 -179.61 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 55.0 ttm-85 -97.29 141.63 30.16 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.807 -0.812 . . . . 20.0 108.807 178.345 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -77.66 128.15 33.62 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.878 0.37 . . . . 20.0 111.859 -178.382 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.837 ' HG2' HD23 ' A' ' 136' ' ' LEU . 27.5 mm100 -126.99 137.15 53.05 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.117 -0.492 . . . . 20.0 111.233 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -133.94 94.23 3.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.971 -0.559 . . . . 20.0 110.451 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.913 ' HB ' HD21 ' A' ' 64' ' ' LEU . 29.1 t -123.81 147.64 28.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.351 -0.386 . . . . 20.0 110.49 179.622 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.563 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 7.0 pt20 -94.37 133.87 37.47 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.42 -0.512 . . . . 20.0 110.71 -179.594 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.918 HD13 ' HB2' ' A' ' 66' ' ' ASP . 0.1 OUTLIER -77.33 118.65 20.02 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.421 0.629 . . . . 20.0 110.851 -179.717 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.16 140.86 37.66 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.002 -0.999 . . . . 20.0 111.124 -179.328 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 123' ' ' CYS . . . . . 0.504 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.3 OUTLIER . . . . . 0 N--CA 1.446 -0.673 0 CA-C-N 115.619 -0.719 . . . . 20.0 109.578 179.128 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.458 ' O ' ' HD2' ' A' ' 129' ' ' PRO . . . . . . . . 0 N--CA 1.456 -0.165 0 N-CA-C 111.775 0.287 . . . . 20.0 111.775 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -118.06 60.74 3.79 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-O 120.976 0.417 . . . . 20.0 111.892 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 129' ' ' PRO . . . . . 0.458 ' HD2' ' O ' ' A' ' 127' ' ' ALA . 3.3 Cg_endo -46.37 155.32 0.72 Allowed 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 123.059 2.506 . . . . 20.0 111.458 178.913 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.774 ' HB2' HD12 ' A' ' 121' ' ' LEU . 72.4 mtt85 -130.0 154.35 47.48 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.434 -0.348 . . . . 20.0 110.541 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.534 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 29.7 m -107.19 140.81 39.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.719 0.295 . . . . 20.0 110.392 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 132' ' ' ARG . . . . . 0.5 ' HD3' ' CB ' ' A' ' 64' ' ' LEU . 56.6 ttt85 -141.92 142.64 33.04 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.162 0.506 . . . . 20.0 112.203 -179.353 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 7.5 pttt -93.3 143.95 25.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.492 -0.776 . . . . 20.0 109.076 178.159 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.454 ' O ' ' CD2' ' A' ' 136' ' ' LEU . 3.1 t -143.99 121.15 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 CA-C-O 121.164 0.507 . . . . 20.0 111.805 -178.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 135' ' ' ARG . . . . . 0.598 ' C ' HD22 ' A' ' 136' ' ' LEU . 87.3 mtm-85 -92.26 112.66 24.69 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.321 -0.854 . . . . 20.0 109.289 178.69 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.837 HD23 ' HG2' ' A' ' 117' ' ' GLN . 1.6 mm? -113.98 123.78 50.54 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.337 0.589 . . . . 20.0 112.279 -178.844 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.886 HG13 ' CD2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -57.5 84.39 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.411 -0.813 . . . . 20.0 111.672 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 138' ' ' ALA . . . . . 0.49 ' HA ' ' CD1' ' A' ' 78' ' ' LEU . . . -69.83 -16.12 63.22 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.408 -0.517 . . . . 20.0 109.818 178.904 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 C--O 1.233 0.207 0 CA-C-N 115.748 -0.66 . . . . 20.0 110.511 178.979 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 59' ' ' HIS . . . . . 0.401 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 3.0 m-70 . . . . . 0 CA--C 1.53 0.179 0 N-CA-C 110.078 -0.342 . . . . 20.0 110.078 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.668 ' CZ ' HG11 ' A' ' 79' ' ' VAL . 17.8 m-30 -119.89 145.84 46.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.938 0.399 . . . . 20.0 111.355 -179.649 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 26.9 p -109.56 88.97 2.87 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.939 -0.573 . . . . 20.0 111.743 -179.608 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 1.063 ' O ' HG21 ' A' ' 75' ' ' VAL . 64.3 ttt-85 -119.94 122.37 41.07 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.445 -0.946 . . . . 20.0 108.445 177.847 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.695 ' O ' HD23 ' A' ' 64' ' ' LEU . 0.2 OUTLIER -105.22 -81.2 0.54 Allowed 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.779 0.659 . . . . 20.0 112.779 -177.538 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.695 HD23 ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -170.21 139.9 1.83 Allowed 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.566 -0.454 . . . . 20.0 111.828 -178.617 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.96 HG22 ' HG3' ' A' ' 70' ' ' ARG . 29.6 p -134.19 132.22 39.5 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.9 -0.591 . . . . 20.0 110.579 179.062 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.857 ' HB2' HD13 ' A' ' 121' ' ' LEU . 94.0 m-20 -141.98 -163.76 1.65 Allowed 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.946 -0.39 . . . . 20.0 109.946 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.812 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -28.47 144.41 0.01 OUTLIER Glycine 0 C--N 1.346 1.113 0 CA-C-O 118.736 -1.036 . . . . 20.0 110.633 179.567 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.551 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 50.1 Cg_exo -15.78 57.13 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.78 1 C-N-CA 125.373 4.049 . . . . 20.0 115.271 -178.53 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.812 ' N ' ' O ' ' A' ' 67' ' ' GLY . 81.5 m -164.98 164.16 20.67 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 108.625 -0.88 . . . . 20.0 108.625 178.4 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.96 ' HG3' HG22 ' A' ' 65' ' ' THR . 54.6 ttt180 -152.29 143.34 23.11 Favored 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 112.377 0.51 . . . . 20.0 112.377 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.984 ' HA ' HD12 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -86.06 161.48 18.91 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 115.718 -0.674 . . . . 20.0 110.844 179.156 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ALA . . . . . 0.548 ' HA ' ' CD2' ' A' ' 63' ' ' PHE . . . -140.64 29.29 1.94 Allowed 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 113.0 0.741 . . . . 20.0 113.0 -179.576 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.823 ' CB ' HG21 ' A' ' 119' ' ' VAL . 4.9 tmtm? -73.4 133.29 80.73 Favored Pre-proline 0 C--N 1.329 -0.316 0 C-N-CA 120.958 -0.297 . . . . 20.0 110.335 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' PRO . . . . . 0.474 ' HD2' ' HG2' ' A' ' 73' ' ' LYS . 50.7 Cg_exo -54.58 122.39 11.48 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.655 2.237 . . . . 20.0 112.356 -179.643 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 1.063 HG21 ' O ' ' A' ' 62' ' ' ARG . 5.1 m -135.54 159.57 40.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.852 -0.613 . . . . 20.0 111.167 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 38.8 m -118.57 128.78 54.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.083 0.468 . . . . 20.0 110.858 178.692 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.546 ' HB3' ' HB2' ' A' ' 60' ' ' TYR . 84.8 tt0 -131.54 139.2 49.19 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.642 -0.708 . . . . 20.0 110.031 179.314 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.833 HD12 ' N ' ' A' ' 78' ' ' LEU . 1.0 OUTLIER -111.37 144.32 40.75 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.307 0.575 . . . . 20.0 112.127 -179.05 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.668 HG11 ' CZ ' ' A' ' 60' ' ' TYR . 0.7 OUTLIER . . . . . 0 C--N 1.322 -0.601 0 N-CA-C 108.252 -1.018 . . . . 20.0 108.252 178.612 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 . . . . . 0 N--CA 1.456 -0.172 0 CA-C-O 120.803 0.335 . . . . 20.0 111.752 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 113' ' ' ARG . . . . . 0.447 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 35.1 ttm180 -122.97 147.47 46.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.284 -0.416 . . . . 20.0 110.909 -179.834 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.854 ' CE2' HG13 ' A' ' 137' ' ' VAL . 0.5 OUTLIER -120.73 155.93 32.89 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.404 0.621 . . . . 20.0 111.558 -179.456 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 48.3 ttm-85 -95.11 142.66 27.3 Favored 'General case' 0 N--CA 1.443 -0.785 0 N-CA-C 108.327 -0.99 . . . . 20.0 108.327 177.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -80.51 130.98 35.48 Favored 'General case' 0 C--N 1.315 -0.913 0 C-N-CA 120.662 -0.415 . . . . 20.0 111.365 -178.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.664 ' HB2' HG23 ' A' ' 134' ' ' VAL . 26.2 mm100 -131.58 127.64 37.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.054 -0.521 . . . . 20.0 111.122 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 80.1 mtm180 -129.38 96.06 4.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.068 -0.514 . . . . 20.0 110.358 179.079 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 0.823 HG21 ' CB ' ' A' ' 73' ' ' LYS . 59.5 t -122.1 144.54 31.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.544 -0.753 . . . . 20.0 110.934 -179.472 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.507 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 2.4 mp0 -82.13 121.48 26.65 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.812 -0.44 . . . . 20.0 109.812 179.621 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.857 HD13 ' HB2' ' A' ' 66' ' ' ASP . 0.2 OUTLIER -66.35 126.33 28.43 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.197 0.523 . . . . 20.0 110.649 -179.093 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.984 HD12 ' HA ' ' A' ' 71' ' ' SER . 0.9 OUTLIER -91.52 144.08 25.92 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.397 -0.82 . . . . 20.0 111.312 -178.742 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 123' ' ' CYS . . . . . 0.551 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER . . . . . 0 C--N 1.322 -0.596 0 CA-C-N 115.688 -0.687 . . . . 20.0 111.382 -179.663 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' ALA . . . . . 0.469 ' C ' ' HD3' ' A' ' 129' ' ' PRO . . . . . . . . 0 N--CA 1.456 -0.151 0 N-CA-C 111.767 0.284 . . . . 20.0 111.767 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -113.12 56.76 0.59 Allowed Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.968 0.413 . . . . 20.0 110.605 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' PRO . . . . . 0.469 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 46.8 Cg_endo -68.2 151.18 77.07 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.934 2.423 . . . . 20.0 112.752 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.552 ' HB2' HD12 ' A' ' 121' ' ' LEU . 99.7 mtt180 -138.71 151.04 46.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.122 -0.49 . . . . 20.0 110.987 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 10.6 t -91.11 139.21 30.97 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.623 0.249 . . . . 20.0 110.954 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 132' ' ' ARG . . . . . 0.524 ' HD3' ' CB ' ' A' ' 64' ' ' LEU . 54.6 ttt85 -146.23 143.77 29.44 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.082 0.467 . . . . 20.0 112.086 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 133' ' ' LYS . . . . . 0.475 ' HA ' ' O ' ' A' ' 117' ' ' GLN . 25.4 pttm -104.42 142.08 35.22 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.589 -0.732 . . . . 20.0 110.006 178.747 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.664 HG23 ' HB2' ' A' ' 117' ' ' GLN . 1.8 m -147.58 128.65 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-O 121.276 0.56 . . . . 20.0 110.97 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 135' ' ' ARG . . . . . 0.541 ' HB3' ' HB2' ' A' ' 114' ' ' TYR . 91.2 mtt-85 -89.62 110.99 21.81 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.282 -0.872 . . . . 20.0 110.315 179.54 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.587 ' CD2' ' N ' ' A' ' 136' ' ' LEU . 0.2 OUTLIER -107.86 127.24 53.55 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.873 0.368 . . . . 20.0 111.067 -179.811 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.854 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -63.05 88.73 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.816 0.341 . . . . 20.0 111.666 -179.941 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.68 -23.88 66.39 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.25 0.548 . . . . 20.0 109.602 179.07 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 37.0 t . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 115.342 -0.844 . . . . 20.0 111.325 179.483 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 59' ' ' HIS . . . . . 0.553 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 86.9 m-70 . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 120.561 0.22 . . . . 20.0 111.085 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.614 ' CE2' HG11 ' A' ' 79' ' ' VAL . 10.2 m-30 -115.51 152.53 32.82 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.974 0.416 . . . . 20.0 111.765 -179.769 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 58.6 p -102.53 79.68 1.84 Allowed 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.9 -0.591 . . . . 20.0 111.198 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.911 ' O ' HG21 ' A' ' 75' ' ' VAL . 16.1 tpt180 -118.32 120.27 37.13 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 108.712 -0.847 . . . . 20.0 108.712 178.197 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.636 ' C ' HD23 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -109.08 -79.44 0.58 Allowed 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 112.663 0.616 . . . . 20.0 112.663 -177.786 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 1.002 HD11 HG23 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -168.29 137.75 2.44 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.699 -0.4 . . . . 20.0 111.869 -178.063 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.693 HG22 ' HG3' ' A' ' 70' ' ' ARG . 19.3 p -129.45 149.12 51.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.852 0.358 . . . . 20.0 110.263 178.425 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.506 ' O ' ' C ' ' A' ' 67' ' ' GLY . 24.7 t0 -154.45 -165.51 2.09 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.396 -0.594 . . . . 20.0 109.396 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.847 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -32.29 147.55 0.01 OUTLIER Glycine 0 C--N 1.345 1.082 0 N-CA-C 109.879 -1.289 . . . . 20.0 109.879 178.927 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.502 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 25.3 Cg_exo -15.95 55.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 125.138 3.892 . . . . 20.0 115.29 -178.496 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' CYS . . . . . 0.847 ' N ' ' O ' ' A' ' 67' ' ' GLY . 33.3 m -162.23 162.41 28.21 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 123.492 0.717 . . . . 20.0 109.121 178.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ARG . . . . . 0.693 ' HG3' HG22 ' A' ' 65' ' ' THR . 75.7 ttt180 -158.41 144.58 17.11 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.079 0.466 . . . . 20.0 111.988 179.768 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' SER . . . . . 0.644 ' HB3' HD12 ' A' ' 64' ' ' LEU . 1.0 OUTLIER -83.05 172.37 12.8 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 115.59 -0.732 . . . . 20.0 110.819 179.287 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -152.87 36.51 0.49 Allowed 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.26 -0.576 . . . . 20.0 112.422 178.784 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LYS . . . . . 0.652 ' CB ' HG11 ' A' ' 119' ' ' VAL . 30.3 mmtt -79.89 163.68 56.88 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.405 -0.361 . . . . 20.0 110.637 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -63.51 116.07 3.42 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.601 2.201 . . . . 20.0 112.505 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' VAL . . . . . 0.911 HG21 ' O ' ' A' ' 62' ' ' ARG . 4.4 m -140.07 136.52 37.99 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 CA-C-N 116.573 -0.285 . . . . 20.0 111.101 179.332 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.446 HG23 ' HB3' ' A' ' 59' ' ' HIS . 54.6 m -126.49 123.29 37.48 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 120.918 0.389 . . . . 20.0 112.031 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.57 ' CG ' ' HB2' ' A' ' 60' ' ' TYR . 20.0 pt-20 -131.17 148.64 52.74 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.034 -0.53 . . . . 20.0 109.677 178.876 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LEU . . . . . 0.568 HD12 ' N ' ' A' ' 78' ' ' LEU . 6.5 mp -101.07 158.36 16.07 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 113.575 0.954 . . . . 20.0 113.575 -178.687 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' VAL . . . . . 0.81 HG23 ' O ' ' A' ' 79' ' ' VAL . 1.4 m . . . . . 0 N--CA 1.446 -0.647 0 CA-C-N 113.903 -1.499 . . . . 20.0 109.162 178.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 67.5 t0 . . . . . 0 N--CA 1.457 -0.084 0 CA-C-O 120.768 0.318 . . . . 20.0 111.686 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 113' ' ' ARG . . . . . 0.521 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 48.0 ttt180 -121.38 150.16 41.89 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.298 -0.41 . . . . 20.0 111.072 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' TYR . . . . . 0.816 ' CE2' HG13 ' A' ' 137' ' ' VAL . 0.5 OUTLIER -125.48 160.77 28.67 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.702 0.763 . . . . 20.0 112.629 -179.289 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 42.9 ttm-85 -97.84 140.4 32.26 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 114.539 -1.21 . . . . 20.0 107.907 176.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -80.51 130.66 35.28 Favored 'General case' 0 C--N 1.313 -0.988 0 C-N-CA 120.683 -0.407 . . . . 20.0 111.633 -178.39 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 22.5 mm100 -133.79 136.62 44.62 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.09 -0.504 . . . . 20.0 110.807 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 50.1 ttt180 -134.02 94.71 3.3 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.996 -0.547 . . . . 20.0 110.189 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' VAL . . . . . 1.002 HG23 HD11 ' A' ' 64' ' ' LEU . 9.1 m -131.61 162.19 39.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.861 -0.608 . . . . 20.0 110.859 -179.402 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' GLN . . . . . 0.567 ' HA ' ' HA ' ' A' ' 131' ' ' SER . 7.2 pt20 -99.86 143.46 30.05 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.286 -0.415 . . . . 20.0 112.017 -179.121 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.783 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -79.51 131.52 36.06 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.85 -0.614 . . . . 20.0 110.049 179.456 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 122' ' ' LEU . . . . . 0.642 HD12 ' N ' ' A' ' 122' ' ' LEU . 3.5 mp -97.22 140.76 31.23 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.774 -0.648 . . . . 20.0 111.942 -178.611 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' CYS . . . . . 0.502 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER . . . . . 0 C--N 1.323 -0.578 0 CA-C-N 115.176 -0.92 . . . . 20.0 109.837 179.313 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.206 0 N-CA-C 111.849 0.314 . . . . 20.0 111.849 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -122.2 59.14 10.88 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 120.939 0.4 . . . . 20.0 111.741 -179.203 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -55.75 149.18 51.4 Favored 'Trans proline' 0 CA--C 1.528 0.203 0 C-N-CA 122.981 2.454 . . . . 20.0 111.945 179.229 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 130' ' ' ARG . . . . . 0.783 ' HB2' HD12 ' A' ' 121' ' ' LEU . 95.9 mtt-85 -130.49 155.57 46.24 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.358 -0.383 . . . . 20.0 110.822 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 131' ' ' SER . . . . . 0.567 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 66.6 m -109.04 133.91 52.36 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.898 0.38 . . . . 20.0 111.936 -179.606 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' ARG . . . . . 0.462 ' HD2' ' HB2' ' A' ' 64' ' ' LEU . 15.8 ttm180 -140.96 142.44 34.33 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.045 -0.525 . . . . 20.0 111.879 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -100.15 146.51 26.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.596 -0.729 . . . . 20.0 109.155 178.363 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' VAL . . . . . 0.528 HG21 ' O ' ' A' ' 63' ' ' PHE . 0.4 OUTLIER -153.03 133.3 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-O 121.385 0.612 . . . . 20.0 112.398 -178.576 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 135' ' ' ARG . . . . . 0.489 ' C ' HD23 ' A' ' 136' ' ' LEU . 62.1 mtp85 -91.37 113.06 25.23 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.823 -1.081 . . . . 20.0 109.89 178.475 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.768 HD12 ' HB ' ' A' ' 75' ' ' VAL . 7.6 mt -112.38 130.02 56.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.971 0.415 . . . . 20.0 111.927 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 137' ' ' VAL . . . . . 0.816 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.2 OUTLIER -64.61 94.58 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 112.401 0.519 . . . . 20.0 112.401 -179.407 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -80.27 -7.07 58.85 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-O 121.158 0.504 . . . . 20.0 109.74 178.329 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 20.1 t . . . . . 0 N--CA 1.461 0.117 0 CA-C-N 115.405 -0.816 . . . . 20.0 109.919 179.13 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.5 mttt . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.762 0.315 . . . . 20.0 111.424 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.494 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 89.6 m-20 -85.07 14.15 5.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.33 -0.395 . . . . 20.0 110.956 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 50.5 t -68.86 -38.86 79.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.125 -0.489 . . . . 20.0 111.732 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 69.8 m -83.87 -1.41 54.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.314 -0.403 . . . . 20.0 111.852 -179.26 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.494 ' HG3' ' HA ' ' A' ' 49' ' ' ASP . 97.3 mt-10 -63.3 -33.7 76.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.73 0.3 . . . . 20.0 110.751 179.763 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.627 ' CD1' ' CB ' ' A' ' 142' ' ' CYS . 0.0 OUTLIER -110.99 -80.11 0.58 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.171 0.51 . . . . 20.0 110.487 179.463 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.464 ' O ' ' SG ' ' A' ' 55' ' ' CYS . 28.2 t -147.08 -160.39 1.15 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.442 -0.799 . . . . 20.0 109.981 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.464 ' SG ' ' O ' ' A' ' 54' ' ' SER . 3.8 p 41.75 50.3 3.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.279 -0.419 . . . . 20.0 111.31 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.598 ' CZ ' HD12 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -55.36 -168.06 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.307 -0.406 . . . . 20.0 110.555 179.603 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.436 ' N ' ' HG2' ' A' ' 56' ' ' ARG . 97.6 mt-10 -67.07 70.98 0.09 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.586 -0.524 . . . . 20.0 109.586 179.014 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.99 HD22 HG22 ' A' ' 79' ' ' VAL . 7.9 tt -96.13 142.2 28.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.595 -0.73 . . . . 20.0 111.726 -178.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.676 ' N ' HD23 ' A' ' 58' ' ' LEU . 30.4 m170 -122.55 140.04 53.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.538 -0.755 . . . . 20.0 111.854 -179.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.59 ' CZ ' HG11 ' A' ' 79' ' ' VAL . 0.8 OUTLIER -126.15 166.28 17.34 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.125 -0.488 . . . . 20.0 111.143 179.793 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.95 79.67 1.54 Allowed 'General case' 0 C--O 1.231 0.121 0 CA-C-O 120.999 0.428 . . . . 20.0 111.716 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.947 ' O ' HG21 ' A' ' 75' ' ' VAL . 53.0 mtm180 -124.7 124.29 41.86 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.154 -1.054 . . . . 20.0 108.154 177.571 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.656 ' CD1' HG22 ' A' ' 75' ' ' VAL . 0.1 OUTLIER -109.53 -79.08 0.58 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 113.007 0.743 . . . . 20.0 113.007 -177.368 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.943 HD21 ' HB ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -170.72 136.74 1.23 Allowed 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.277 -0.569 . . . . 20.0 112.435 -178.128 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.974 HG22 ' HG3' ' A' ' 70' ' ' ARG . 16.8 p -132.96 132.06 41.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.06 -0.518 . . . . 20.0 110.295 178.385 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.598 ' HB2' HD13 ' A' ' 121' ' ' LEU . 91.7 m-20 -140.27 -163.68 1.57 Allowed 'General case' 0 C--O 1.237 0.44 0 N-CA-C 110.074 -0.343 . . . . 20.0 110.074 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.837 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -29.86 146.2 0.01 OUTLIER Glycine 0 C--N 1.345 1.036 0 CA-C-O 118.597 -1.113 . . . . 20.0 110.622 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.492 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 39.6 Cg_exo -15.11 56.23 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 125.292 3.995 . . . . 20.0 115.183 -178.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.837 ' N ' ' O ' ' A' ' 67' ' ' GLY . 39.8 m -163.84 163.68 23.76 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 108.453 -0.943 . . . . 20.0 108.453 178.661 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.974 ' HG3' HG22 ' A' ' 65' ' ' THR . 58.0 ttp180 -154.64 145.88 22.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.112 0.482 . . . . 20.0 111.84 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' SER . . . . . 1.002 ' HA ' HD12 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -89.27 160.54 16.86 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.751 -0.659 . . . . 20.0 110.465 179.075 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.465 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . . . -147.66 28.36 0.96 Allowed 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.177 0.806 . . . . 20.0 113.177 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.651 ' HB3' HG21 ' A' ' 119' ' ' VAL . 1.5 tttt -79.33 143.2 59.71 Favored Pre-proline 0 C--N 1.326 -0.436 0 N-CA-C 110.017 -0.364 . . . . 20.0 110.017 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.506 ' HD2' ' HG3' ' A' ' 73' ' ' LYS . 76.9 Cg_exo -51.28 122.29 9.85 Favored 'Trans proline' 0 C--O 1.232 0.225 0 C-N-CA 122.758 2.306 . . . . 20.0 113.024 -178.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.947 HG21 ' O ' ' A' ' 62' ' ' ARG . 20.0 m -136.72 145.5 30.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 115.791 -0.641 . . . . 20.0 110.97 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 41.7 m -119.14 128.52 54.35 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.919 0.39 . . . . 20.0 110.307 178.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.688 ' OE1' HD12 ' A' ' 136' ' ' LEU . 20.3 pt-20 -143.32 150.32 39.02 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.894 -0.594 . . . . 20.0 110.252 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.593 HD12 ' N ' ' A' ' 78' ' ' LEU . 6.0 mp -100.91 140.99 34.42 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 121.174 0.511 . . . . 20.0 111.076 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.99 HG22 HD22 ' A' ' 58' ' ' LEU . 10.7 m -97.92 86.25 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.91 0 CA-C-N 115.423 -0.808 . . . . 20.0 109.842 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.427 ' HA ' ' CB ' ' A' ' 55' ' ' CYS . 0.1 OUTLIER -81.46 90.45 6.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.691 -0.686 . . . . 20.0 110.809 -179.182 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.7 p -150.48 114.74 5.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.597 -0.729 . . . . 20.0 110.385 179.341 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.531 ' O ' ' HA ' ' A' ' 108' ' ' ARG . . . -162.41 -142.55 3.42 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.863 -0.684 . . . . 20.0 112.058 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 85.2 mt-30 -135.17 138.56 43.8 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 110.238 -0.282 . . . . 20.0 110.238 179.173 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.429 ' SG ' ' CG ' ' A' ' 53' ' ' TYR . 5.1 m -160.9 24.12 0.14 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.82 0.343 . . . . 20.0 110.905 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLY . . . . . 0.571 ' HA3' ' CD2' ' A' ' 107' ' ' PHE . . . -129.0 162.18 22.51 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.624 -0.798 . . . . 20.0 112.571 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.81 146.34 95.9 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 123.022 2.482 . . . . 20.0 112.601 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -92.62 23.0 4.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.144 -0.48 . . . . 20.0 110.673 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 29.9 tpt180 -69.69 130.48 42.48 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.842 -0.617 . . . . 20.0 111.639 -179.277 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.549 HD22 ' N ' ' A' ' 89' ' ' LEU . 1.3 mm? -97.2 134.42 40.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.811 -0.631 . . . . 20.0 109.83 179.064 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.541 ' H ' HD12 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -109.4 98.34 31.4 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-O 120.749 0.309 . . . . 20.0 111.42 -179.578 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 90' ' ' LEU . 56.7 Cg_endo -70.92 115.34 4.22 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.638 2.225 . . . . 20.0 111.976 179.534 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.507 ' O ' ' CZ2' ' A' ' 99' ' ' TRP . 86.6 m-20 -139.78 31.31 2.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 20.0 111.255 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.799 ' HB1' HG22 ' A' ' 97' ' ' VAL . . . -65.14 -1.91 2.51 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.352 0.501 . . . . 20.0 112.352 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.444 HG13 ' O ' ' A' ' 92' ' ' ASN . 1.1 mt 33.89 32.49 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 121.313 0.577 . . . . 20.0 111.4 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLY . . . . . 0.509 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 108.52 -42.57 1.91 Allowed Glycine 0 N--CA 1.451 -0.3 0 CA-C-N 115.306 -0.861 . . . . 20.0 112.993 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.511 ' HD3' ' CE ' ' A' ' 98' ' ' LYS . 52.2 ttt180 -122.13 132.01 54.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.801 0.334 . . . . 20.0 110.934 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.799 HG22 ' HB1' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -116.38 113.06 41.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 CA-C-O 121.276 0.56 . . . . 20.0 110.863 -179.739 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.542 ' HG3' ' N ' ' A' ' 99' ' ' TRP . 9.2 ptpt -147.6 -45.76 0.17 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.249 -0.887 . . . . 20.0 110.334 -179.549 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.653 ' CZ3' ' CE3' ' A' ' 100' ' ' TRP . 0.2 OUTLIER -58.76 -84.39 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.26 -1.336 . . . . 20.0 109.783 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 100' ' ' TRP . . . . . 0.732 ' CZ3' HG13 ' A' ' 97' ' ' VAL . 0.0 OUTLIER -96.42 -176.46 3.64 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.325 -0.991 . . . . 20.0 108.325 177.698 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.757 ' HD2' HG12 ' A' ' 97' ' ' VAL . 36.1 mmm-85 -166.35 140.77 3.56 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 120.665 0.269 . . . . 20.0 110.746 178.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 101' ' ' ARG . 32.0 Cg_exo -59.44 47.63 0.06 OUTLIER 'Trans proline' 0 N--CA 1.476 0.487 0 C-N-CA 123.569 2.846 . . . . 20.0 113.954 -179.421 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ASN . . . . . 0.497 ' N ' ' O ' ' A' ' 101' ' ' ARG . 71.2 m-20 -82.38 2.74 30.94 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.83 0.348 . . . . 20.0 110.465 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.417 ' HA2' ' HD3' ' A' ' 105' ' ' PRO . . . 108.27 144.91 11.32 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 121.193 -0.527 . . . . 20.0 112.611 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.618 ' HB2' ' CE2' ' A' ' 107' ' ' PHE . 11.7 Cg_exo -69.86 147.05 61.37 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.937 2.425 . . . . 20.0 112.339 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -85.85 102.25 13.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.369 -0.378 . . . . 20.0 110.899 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.618 ' CE2' ' HB2' ' A' ' 105' ' ' PRO . 25.3 m-85 -126.09 149.7 48.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.324 -0.398 . . . . 20.0 110.805 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.531 ' HA ' ' O ' ' A' ' 82' ' ' GLY . 25.5 ptt180 -170.72 179.68 3.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.942 0.401 . . . . 20.0 111.194 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 142' ' ' CYS . 24.6 m -69.6 146.27 51.87 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.036 -0.529 . . . . 20.0 109.657 179.477 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.447 HG12 ' O ' ' A' ' 143' ' ' LYS . 3.2 mm -113.76 121.52 36.95 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-O 120.865 0.364 . . . . 20.0 111.948 -179.439 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.935 ' CB ' HG11 ' A' ' 137' ' ' VAL . 36.8 Cg_endo -64.86 134.99 42.54 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.516 2.144 . . . . 20.0 111.427 179.17 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 93.3 m-20 -107.83 -66.83 1.0 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.018 0.377 . . . . 20.0 112.018 -179.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.402 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 25.3 ttm180 -121.2 147.84 45.06 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.354 -0.384 . . . . 20.0 110.832 -179.434 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.913 ' CE2' HG13 ' A' ' 137' ' ' VAL . 1.0 OUTLIER -119.65 160.8 21.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.174 0.511 . . . . 20.0 111.441 -179.114 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.641 ' HB2' ' HB2' ' A' ' 138' ' ' ALA . 50.9 ttm-85 -96.93 147.18 24.24 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.882 -0.784 . . . . 20.0 108.882 178.514 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -82.91 134.24 35.08 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.076 0.465 . . . . 20.0 111.938 -178.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.708 ' HG2' HD23 ' A' ' 136' ' ' LEU . 20.9 mm100 -133.94 120.53 20.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.54 -0.755 . . . . 20.0 110.032 179.351 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 71.9 ttp85 -118.04 98.61 6.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.924 0.392 . . . . 20.0 110.663 179.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.943 ' HB ' HD21 ' A' ' 64' ' ' LEU . 92.2 t -131.14 145.06 35.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.902 -0.59 . . . . 20.0 111.3 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.557 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 24.4 mp0 -91.53 140.92 29.28 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.751 0.31 . . . . 20.0 110.518 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.884 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.0 OUTLIER -79.4 129.72 34.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.196 0.522 . . . . 20.0 110.801 -179.835 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 1.002 HD12 ' HA ' ' A' ' 71' ' ' SER . 1.5 mp -95.12 138.46 32.8 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.551 -0.75 . . . . 20.0 111.524 -179.048 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' CYS . . . . . 0.526 ' SG ' ' HD2' ' A' ' 124' ' ' PRO . 0.1 OUTLIER -115.28 156.72 45.28 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.403 -0.817 . . . . 20.0 109.877 179.462 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.526 ' HD2' ' SG ' ' A' ' 123' ' ' CYS . 73.9 Cg_exo -50.28 112.51 0.75 Allowed 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.007 1.804 . . . . 20.0 111.908 -179.562 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 98.35 -9.36 62.87 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.946 -0.645 . . . . 20.0 112.477 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 56.47 59.45 10.72 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.746 -0.74 . . . . 20.0 112.521 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -118.44 -31.69 4.85 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.271 0.471 . . . . 20.0 112.271 -179.337 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -123.19 56.03 8.72 Favored Pre-proline 0 C--N 1.33 -0.242 0 N-CA-C 112.219 0.451 . . . . 20.0 112.219 -179.154 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.68 143.81 47.43 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.639 2.226 . . . . 20.0 112.081 179.156 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.884 ' HB2' HD12 ' A' ' 121' ' ' LEU . 67.5 mtt85 -132.02 153.38 50.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.379 -0.373 . . . . 20.0 110.623 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.456 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 43.9 t -98.84 133.72 42.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.801 0.334 . . . . 20.0 111.128 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' ARG . . . . . 0.479 ' HB3' HD13 ' A' ' 64' ' ' LEU . 74.5 ttt-85 -139.1 142.99 38.08 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.188 0.518 . . . . 20.0 111.761 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 3.6 pttm -96.09 146.07 24.96 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.445 -0.798 . . . . 20.0 110.259 179.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.556 ' HB ' HD21 ' A' ' 136' ' ' LEU . 0.0 OUTLIER -145.16 121.59 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 CA-C-O 121.287 0.565 . . . . 20.0 111.794 -179.415 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.745 ' C ' HD22 ' A' ' 136' ' ' LEU . 86.1 mtt-85 -92.1 118.6 30.97 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.349 -0.842 . . . . 20.0 110.09 178.657 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.745 HD22 ' C ' ' A' ' 135' ' ' ARG . 1.0 OUTLIER -114.35 120.2 39.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.01 0.433 . . . . 20.0 112.087 -179.252 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.935 HG11 ' CB ' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -51.28 84.54 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.269 -0.423 . . . . 20.0 111.455 179.811 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.641 ' HB2' ' HB2' ' A' ' 115' ' ' ARG . . . -75.5 -6.44 50.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.009 0.433 . . . . 20.0 110.193 179.101 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 17.3 t -161.67 120.96 2.46 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.82 -0.627 . . . . 20.0 110.517 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' CYS . . . . . 0.481 ' HB3' ' HA ' ' A' ' 111' ' ' PRO . 11.3 p -141.0 169.81 16.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.533 -0.303 . . . . 20.0 110.904 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -128.82 148.49 50.88 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 116.546 -0.297 . . . . 20.0 110.401 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 142' ' ' CYS . . . . . 0.627 ' CB ' ' CD1' ' A' ' 53' ' ' TYR . 11.3 t -83.89 99.01 10.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.962 0.411 . . . . 20.0 110.068 179.605 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.488 ' O ' ' HG2' ' A' ' 144' ' ' ARG . 19.7 mmtm -130.24 145.49 51.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.932 -0.576 . . . . 20.0 111.39 -179.373 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.488 ' HG2' ' O ' ' A' ' 143' ' ' LYS . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.172 -0.918 . . . . 20.0 111.249 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 37.5 mtmm . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.773 0.32 . . . . 20.0 111.322 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.448 ' HB2' ' CD ' ' A' ' 52' ' ' GLU . 47.4 p30 -89.59 15.34 9.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.232 -0.44 . . . . 20.0 111.821 -179.594 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 92.0 t -71.86 -29.91 35.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.761 0.315 . . . . 20.0 111.741 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 79.7 p -78.41 -6.75 56.15 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.416 -0.356 . . . . 20.0 111.427 -179.376 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.448 ' CD ' ' HB2' ' A' ' 49' ' ' ASP . 96.9 mt-10 -64.4 -31.85 73.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.892 0.377 . . . . 20.0 110.796 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.59 ' CD2' ' O ' ' A' ' 53' ' ' TYR . 2.0 p90 -111.49 22.94 14.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.132 -0.486 . . . . 20.0 110.521 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.436 ' OG ' ' HG3' ' A' ' 56' ' ' ARG . 16.3 t -56.71 119.43 6.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.207 0.527 . . . . 20.0 110.846 -179.007 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.449 ' SG ' ' SG ' ' A' ' 80' ' ' CYS . 0.7 OUTLIER -110.24 25.35 11.88 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.415 -0.811 . . . . 20.0 110.618 -179.641 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.56 ' HD3' ' N ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -44.21 167.83 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.958 -0.565 . . . . 20.0 111.102 179.869 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.493 ' HG3' ' O ' ' A' ' 57' ' ' GLU . 22.0 pt-20 -44.05 88.32 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.97 -0.559 . . . . 20.0 111.451 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 1.01 ' O ' HD12 ' A' ' 58' ' ' LEU . 2.3 pp -108.09 132.35 53.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.772 -0.649 . . . . 20.0 110.505 179.555 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -146.96 131.18 17.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.911 0.386 . . . . 20.0 111.243 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.631 ' CD1' HG13 ' A' ' 79' ' ' VAL . 12.7 m-85 -129.25 148.63 51.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.083 -0.508 . . . . 20.0 111.639 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.418 ' OG1' ' CZ ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -103.86 87.15 2.73 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.038 0.447 . . . . 20.0 111.091 -179.819 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.949 ' O ' HG21 ' A' ' 75' ' ' VAL . 60.7 ttm-85 -122.37 124.96 44.89 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.572 -0.899 . . . . 20.0 108.572 178.544 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.685 ' O ' HG21 ' A' ' 134' ' ' VAL . 0.1 OUTLIER -111.18 -83.39 0.57 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.98 0.733 . . . . 20.0 112.98 -177.606 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 1.008 HD11 HG13 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -169.17 141.77 2.64 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 120.575 -0.45 . . . . 20.0 112.04 -178.405 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.784 HG22 ' HG3' ' A' ' 70' ' ' ARG . 31.0 p -136.4 131.62 34.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.101 -0.5 . . . . 20.0 110.806 178.793 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.652 ' HB2' HD13 ' A' ' 121' ' ' LEU . 93.4 m-20 -140.72 -162.13 1.31 Allowed 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.547 -0.538 . . . . 20.0 109.547 179.658 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.814 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -29.65 144.34 0.01 OUTLIER Glycine 0 C--N 1.347 1.183 0 CA-C-O 118.494 -1.17 . . . . 20.0 110.277 179.441 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.515 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 56.9 Cg_exo -16.57 58.53 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 125.071 3.848 . . . . 20.0 114.864 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.814 ' N ' ' O ' ' A' ' 67' ' ' GLY . 20.7 m -162.58 159.12 24.29 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 108.956 -0.757 . . . . 20.0 108.956 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.784 ' HG3' HG22 ' A' ' 65' ' ' THR . 79.3 ttt180 -149.97 141.29 23.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.218 0.532 . . . . 20.0 112.068 179.714 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.599 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -84.54 162.69 19.75 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.446 -0.797 . . . . 20.0 110.393 179.004 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -147.34 28.3 0.99 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.415 0.894 . . . . 20.0 113.415 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.907 ' HB2' HG21 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -75.76 141.97 72.85 Favored Pre-proline 0 C--N 1.327 -0.379 0 C-N-CA 120.54 -0.464 . . . . 20.0 110.27 179.249 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -50.63 122.51 9.76 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.706 2.27 . . . . 20.0 112.619 -179.281 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.949 HG21 ' O ' ' A' ' 62' ' ' ARG . 17.3 m -137.27 151.08 26.38 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 CA-C-N 116.202 -0.454 . . . . 20.0 111.891 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 88.1 m -111.73 124.24 51.92 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.069 -0.715 . . . . 20.0 109.069 177.628 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.64 ' C ' HD12 ' A' ' 78' ' ' LEU . 84.8 tt0 -125.31 133.1 52.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.192 0.52 . . . . 20.0 112.085 -179.061 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.733 HD12 ' N ' ' A' ' 78' ' ' LEU . 3.8 mp -108.06 138.29 44.58 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.534 -0.757 . . . . 20.0 109.405 178.36 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.813 ' H ' HD13 ' A' ' 58' ' ' LEU . 35.0 m -97.41 83.04 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 CA-C-O 121.481 0.657 . . . . 20.0 111.184 -178.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.485 ' O ' ' HD3' ' A' ' 111' ' ' PRO . 0.8 OUTLIER -115.65 107.3 14.92 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 114.875 -1.057 . . . . 20.0 109.97 179.488 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.4 m -151.62 96.16 2.22 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 120.214 -0.594 . . . . 20.0 112.58 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 109' ' ' CYS . . . 171.32 -170.73 43.54 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.547 -0.751 . . . . 20.0 111.503 179.434 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.532 ' O ' ' N ' ' A' ' 108' ' ' ARG . 92.6 mt-30 -137.52 138.27 39.48 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.977 0.417 . . . . 20.0 111.065 178.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.5 ' N ' ' HA ' ' A' ' 144' ' ' ARG . 61.4 m -97.68 133.18 42.57 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.18 -0.464 . . . . 20.0 110.878 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLY . . . . . 0.57 ' HA3' ' CE2' ' A' ' 107' ' ' PHE . . . -145.75 -177.21 20.29 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.685 -0.769 . . . . 20.0 112.365 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -56.76 140.89 92.08 Favored 'Trans proline' 0 N--CA 1.465 -0.18 0 C-N-CA 122.592 2.195 . . . . 20.0 111.963 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -74.87 -0.41 18.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.23 -0.441 . . . . 20.0 111.23 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.522 ' C ' HD13 ' A' ' 89' ' ' LEU . 21.7 tpt180 -73.68 117.19 15.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.334 -0.393 . . . . 20.0 110.57 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.62 ' N ' HD13 ' A' ' 89' ' ' LEU . 0.1 OUTLIER -98.5 135.16 40.46 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.045 -0.525 . . . . 20.0 110.834 -179.986 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -118.53 90.78 40.16 Favored Pre-proline 0 C--N 1.329 -0.29 0 N-CA-C 112.086 0.402 . . . . 20.0 112.086 -179.474 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.602 ' HB2' ' CE2' ' A' ' 100' ' ' TRP . 37.1 Cg_endo -64.94 108.56 1.12 Allowed 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 122.634 2.223 . . . . 20.0 111.0 178.659 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.616 ' O ' ' CH2' ' A' ' 99' ' ' TRP . 56.8 t-20 -98.93 142.91 29.84 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 111.873 0.323 . . . . 20.0 111.873 -179.01 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 1.16 ' CB ' HG22 ' A' ' 97' ' ' VAL . . . -100.32 -13.33 18.86 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.187 -0.461 . . . . 20.0 112.054 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.852 HD12 ' C ' ' A' ' 93' ' ' ALA . 0.1 OUTLIER 32.66 31.47 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-O 121.135 0.493 . . . . 20.0 111.836 -179.711 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLY . . . . . 0.542 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 121.25 -44.39 1.37 Allowed Glycine 0 C--N 1.314 -0.655 0 CA-C-N 115.53 -0.759 . . . . 20.0 113.023 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.473 ' N ' ' O ' ' A' ' 93' ' ' ALA . 82.3 mtt180 -109.15 131.64 54.87 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.718 0.259 . . . . 20.0 110.7 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 1.16 HG22 ' CB ' ' A' ' 93' ' ' ALA . 0.8 OUTLIER -129.89 129.65 66.05 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.651 0 CA-C-O 121.629 0.728 . . . . 20.0 111.584 178.877 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.48 ' HG2' ' C ' ' A' ' 97' ' ' VAL . 1.6 ptpt 164.72 -32.83 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.525 -1.216 . . . . 20.0 108.974 -178.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.835 ' HH2' HD11 ' A' ' 94' ' ' ILE . 43.8 p-90 -94.7 26.83 3.31 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 113.357 -1.747 . . . . 20.0 110.595 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' TRP . . . . . 1.128 ' CZ3' HG13 ' A' ' 97' ' ' VAL . 0.0 OUTLIER -30.26 132.01 0.08 Allowed 'General case' 0 CA--C 1.5 -0.961 0 CA-C-O 122.15 0.976 . . . . 20.0 113.232 -177.093 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.43 ' HD2' ' CE3' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -119.47 74.87 16.97 Favored Pre-proline 0 N--CA 1.437 -1.087 0 CA-C-N 113.524 -1.671 . . . . 20.0 110.813 -179.131 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.549 ' O ' ' CB ' ' A' ' 89' ' ' LEU . 55.3 Cg_endo -68.95 -0.17 5.88 Favored 'Trans proline' 0 CA--C 1.527 0.169 0 C-N-CA 123.59 2.86 . . . . 20.0 112.239 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ASN . . . . . 0.465 ' O ' ' HG ' ' A' ' 89' ' ' LEU . 57.8 t30 -59.24 -34.64 72.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.384 -0.371 . . . . 20.0 110.737 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.511 ' HA3' HD12 ' A' ' 89' ' ' LEU . . . 76.32 -178.09 50.08 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.646 -0.787 . . . . 20.0 112.45 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.589 ' HB2' ' CZ ' ' A' ' 107' ' ' PHE . 22.6 Cg_exo -63.24 153.85 71.55 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.803 2.335 . . . . 20.0 112.293 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.404 ' OD2' ' NH2' ' A' ' 108' ' ' ARG . 54.3 t0 -79.32 115.53 19.02 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.262 -0.426 . . . . 20.0 110.991 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.589 ' CZ ' ' HB2' ' A' ' 105' ' ' PRO . 63.9 m-85 -117.89 138.28 52.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.049 -0.523 . . . . 20.0 110.783 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.576 ' HA ' ' CB ' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -151.2 -162.73 1.6 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.944 0.402 . . . . 20.0 111.354 179.327 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.591 ' O ' ' N ' ' A' ' 82' ' ' GLY . 1.5 m -82.86 122.6 28.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.957 -0.565 . . . . 20.0 111.603 -179.133 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.553 ' O ' HG23 ' A' ' 110' ' ' ILE . 0.1 OUTLIER -100.56 116.13 64.62 Favored Pre-proline 0 C--N 1.329 -0.3 0 C-N-CA 120.597 -0.441 . . . . 20.0 110.274 178.596 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.544 ' CB ' HG11 ' A' ' 137' ' ' VAL . 18.6 Cg_endo -60.16 147.07 94.75 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.763 2.309 . . . . 20.0 111.67 -179.759 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -119.83 -66.59 1.05 Allowed 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 112.989 0.737 . . . . 20.0 112.989 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.496 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 41.0 ttm180 -119.82 149.05 42.69 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.245 0.461 . . . . 20.0 112.245 -178.356 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 1.021 ' CE2' HG13 ' A' ' 137' ' ' VAL . 1.3 m-85 -124.01 159.01 30.79 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.551 -0.75 . . . . 20.0 111.602 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.491 HH21 ' HB1' ' A' ' 138' ' ' ALA . 43.9 ttm-85 -95.43 148.31 22.61 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.467 -0.938 . . . . 20.0 108.467 177.738 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -83.33 137.94 33.75 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.137 0.494 . . . . 20.0 111.421 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.452 ' O ' ' HA ' ' A' ' 133' ' ' LYS . 28.4 mm100 -137.18 109.81 7.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.811 -0.632 . . . . 20.0 110.867 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.482 ' HA ' ' O ' ' A' ' 132' ' ' ARG . 93.8 mtt180 -125.42 98.25 5.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.059 -0.519 . . . . 20.0 110.739 179.394 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 1.008 HG13 HD11 ' A' ' 64' ' ' LEU . 14.7 p -133.72 152.12 34.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.877 -0.601 . . . . 20.0 110.857 -179.728 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.52 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 27.1 mp0 -77.92 135.73 37.9 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.932 0.396 . . . . 20.0 111.493 -179.234 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.889 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.2 OUTLIER -79.22 127.71 32.39 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.345 -0.613 . . . . 20.0 109.345 179.103 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.62 131.86 34.56 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.861 -0.608 . . . . 20.0 111.446 -178.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' CYS . . . . . 0.597 ' CB ' ' HB3' ' A' ' 128' ' ' ALA . 0.5 OUTLIER -112.53 151.89 44.21 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 115.438 -0.801 . . . . 20.0 109.881 179.71 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.517 ' HD2' ' SG ' ' A' ' 123' ' ' CYS . 78.1 Cg_exo -48.27 111.91 0.52 Allowed 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 121.766 1.644 . . . . 20.0 111.351 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 100.86 -9.87 58.53 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.969 -0.634 . . . . 20.0 112.036 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 65.26 27.13 72.05 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 120.767 -0.73 . . . . 20.0 112.389 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -101.79 -7.27 22.7 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.384 0.512 . . . . 20.0 112.384 -178.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.597 ' HB3' ' CB ' ' A' ' 123' ' ' CYS . . . -129.63 56.26 23.21 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 112.388 0.514 . . . . 20.0 112.388 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' PRO . . . . . 0.518 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 62.3 Cg_endo -73.74 136.32 23.02 Favored 'Trans proline' 0 CA--C 1.528 0.182 0 C-N-CA 122.529 2.153 . . . . 20.0 112.055 179.078 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.889 ' HB2' HD12 ' A' ' 121' ' ' LEU . 89.1 mtt180 -140.27 133.94 30.32 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.62 0.248 . . . . 20.0 111.271 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.417 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 23.3 t -85.51 136.71 33.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.952 0.406 . . . . 20.0 111.657 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' ARG . . . . . 0.691 HH12 HG13 ' A' ' 134' ' ' VAL . 56.6 ttt-85 -140.52 143.54 35.46 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.803 -0.635 . . . . 20.0 111.26 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.452 ' HA ' ' O ' ' A' ' 117' ' ' GLN . 19.7 pttp -100.93 144.61 29.66 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.09 -0.504 . . . . 20.0 110.66 179.473 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.691 HG13 HH12 ' A' ' 132' ' ' ARG . 0.0 OUTLIER -147.99 123.17 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 120.946 0.403 . . . . 20.0 111.721 -179.618 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.596 ' O ' HD23 ' A' ' 136' ' ' LEU . 90.5 mtm-85 -90.85 110.89 22.11 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.855 -0.612 . . . . 20.0 110.213 178.423 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.61 ' N ' ' HB3' ' A' ' 114' ' ' TYR . 5.0 mt -114.04 126.85 55.58 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.255 0.55 . . . . 20.0 112.047 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 1.021 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.2 OUTLIER -57.83 83.22 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.569 -0.741 . . . . 20.0 111.405 -179.704 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.491 ' HB1' HH21 ' A' ' 115' ' ' ARG . . . -72.95 -6.98 48.94 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.053 0.454 . . . . 20.0 110.428 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 47.2 t -163.6 115.14 1.41 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.787 -0.642 . . . . 20.0 110.169 179.171 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' CYS . . . . . . . . . . . . . 10.0 p -132.09 159.78 37.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.972 0.415 . . . . 20.0 111.037 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -131.21 149.07 52.74 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.909 -0.587 . . . . 20.0 110.596 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 142' ' ' CYS . . . . . 0.565 ' SG ' ' CE2' ' A' ' 53' ' ' TYR . 0.5 OUTLIER -71.09 98.71 1.71 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.862 0.363 . . . . 20.0 110.481 179.86 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.52 ' HB2' ' CG2' ' A' ' 110' ' ' ILE . 25.1 mmtt -134.1 152.61 51.91 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.976 -0.556 . . . . 20.0 111.183 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.503 ' N ' ' CD ' ' A' ' 144' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.221 -0.895 . . . . 20.0 110.946 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.4 mttt . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.724 0.297 . . . . 20.0 111.149 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.493 ' HA ' ' OE1' ' A' ' 52' ' ' GLU . 85.1 m-20 -86.4 15.91 4.98 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.272 -0.422 . . . . 20.0 111.96 -179.48 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 70.3 t -65.03 -38.11 81.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.541 -0.299 . . . . 20.0 111.522 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.481 ' O ' ' CE1' ' A' ' 53' ' ' TYR . 45.5 m -89.67 -16.48 30.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.511 -0.313 . . . . 20.0 111.703 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.493 ' OE1' ' HA ' ' A' ' 49' ' ' ASP . 56.5 mp0 -90.51 15.44 10.8 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.352 -0.385 . . . . 20.0 111.493 -179.85 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.597 ' N ' ' CD1' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -45.53 -83.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.716 0.293 . . . . 20.0 111.025 -179.286 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.508 ' HB3' ' HB2' ' A' ' 109' ' ' CYS . 7.9 t -142.12 -163.1 1.52 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.975 0.417 . . . . 20.0 110.513 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.477 ' CB ' ' O ' ' A' ' 54' ' ' SER . 2.7 m 82.33 17.03 0.37 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.052 -0.522 . . . . 20.0 110.83 179.656 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.511 ' HG2' ' N ' ' A' ' 57' ' ' GLU . 0.0 OUTLIER -55.77 -156.65 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.435 -0.348 . . . . 20.0 110.547 179.874 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.511 ' N ' ' HG2' ' A' ' 56' ' ' ARG . 80.1 tt0 -86.22 118.6 25.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.824 0.345 . . . . 20.0 110.9 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.773 ' H ' HD12 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -150.18 131.8 14.89 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.126 -0.488 . . . . 20.0 111.465 -179.917 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.441 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 2.5 m-70 -139.58 122.26 16.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.895 0.379 . . . . 20.0 110.792 178.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.89 ' CD1' HG13 ' A' ' 79' ' ' VAL . 14.9 m-85 -128.16 156.14 43.35 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.027 -0.533 . . . . 20.0 111.589 -179.124 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 40.1 p -111.05 88.41 2.78 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 112.325 0.491 . . . . 20.0 112.325 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.797 ' O ' HG21 ' A' ' 75' ' ' VAL . 51.4 mtm180 -117.33 123.36 46.32 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.291 -1.003 . . . . 20.0 108.291 177.151 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.907 ' O ' HD23 ' A' ' 64' ' ' LEU . 1.7 m-85 -103.21 -79.29 0.54 Allowed 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 112.34 0.496 . . . . 20.0 112.34 -177.448 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.907 HD23 ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -177.46 142.16 0.32 Allowed 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.581 -0.448 . . . . 20.0 111.44 -178.76 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.733 HG22 ' HG3' ' A' ' 70' ' ' ARG . 30.0 p -138.9 132.71 30.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.058 -0.519 . . . . 20.0 110.081 178.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.558 ' O ' ' C ' ' A' ' 67' ' ' GLY . 5.1 t0 -150.29 -155.71 0.65 Allowed 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.701 -0.227 . . . . 20.0 110.397 -179.417 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.789 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -26.38 137.77 0.01 OUTLIER Glycine 0 C--N 1.347 1.171 0 N-CA-C 110.26 -1.136 . . . . 20.0 110.26 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.565 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 36.7 Cg_exo -17.09 59.74 0.0 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.97 0 C-N-CA 125.136 3.891 . . . . 20.0 115.387 -177.85 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.789 ' N ' ' O ' ' A' ' 67' ' ' GLY . 74.1 m -165.33 162.87 19.91 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 108.7 -0.852 . . . . 20.0 108.7 178.051 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.733 ' HG3' HG22 ' A' ' 65' ' ' THR . 54.9 ttt180 -147.09 140.82 25.73 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 112.555 0.576 . . . . 20.0 112.555 -179.321 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.674 ' CA ' ' HA ' ' A' ' 121' ' ' LEU . 1.4 t -87.98 158.36 18.67 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-N 115.896 -0.593 . . . . 20.0 110.253 178.519 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.427 ' HA ' ' CD2' ' A' ' 63' ' ' PHE . . . -146.93 27.37 1.07 Allowed 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 114.427 1.269 . . . . 20.0 114.427 -179.119 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.705 ' HB3' HG21 ' A' ' 119' ' ' VAL . 19.5 tttt -76.62 136.57 67.48 Favored Pre-proline 0 C--N 1.327 -0.411 0 C-N-CA 120.054 -0.658 . . . . 20.0 109.493 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -51.35 129.03 27.54 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.926 2.417 . . . . 20.0 113.172 -178.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.797 HG21 ' O ' ' A' ' 62' ' ' ARG . 17.4 m -142.3 147.79 20.91 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 CA-C-N 115.886 -0.597 . . . . 20.0 111.472 179.638 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 18.9 m -116.83 126.15 52.62 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.526 -0.546 . . . . 20.0 109.526 178.518 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.719 ' OE1' HD12 ' A' ' 136' ' ' LEU . 15.9 pt-20 -143.09 155.49 44.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.971 0.415 . . . . 20.0 111.554 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.618 ' HB3' HD13 ' A' ' 58' ' ' LEU . 6.3 mp -105.39 143.59 33.34 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.757 -0.656 . . . . 20.0 110.272 178.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.89 HG13 ' CD1' ' A' ' 60' ' ' TYR . 32.8 m -99.72 81.94 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.037 0.446 . . . . 20.0 110.632 179.818 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.424 ' SG ' ' O ' ' A' ' 80' ' ' CYS . 27.2 p -131.51 109.09 10.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.914 -0.585 . . . . 20.0 110.996 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -142.55 104.81 4.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.191 -0.459 . . . . 20.0 110.941 179.477 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.46 ' HA3' ' HD3' ' A' ' 108' ' ' ARG . . . -162.12 -172.95 30.2 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.632 -0.794 . . . . 20.0 112.317 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -131.29 146.23 52.21 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.624 0.25 . . . . 20.0 110.338 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.543 ' HA ' ' HA ' ' A' ' 107' ' ' PHE . 68.4 m -106.32 146.99 29.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.738 0.304 . . . . 20.0 110.467 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLY . . . . . 0.583 ' O ' ' CE1' ' A' ' 107' ' ' PHE . . . -156.91 173.32 34.56 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.856 -0.688 . . . . 20.0 112.267 -179.665 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -53.31 152.7 19.04 Favored 'Trans proline' 0 C--O 1.231 0.136 0 C-N-CA 122.844 2.362 . . . . 20.0 112.369 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.425 ' HB2' ' HE2' ' A' ' 107' ' ' PHE . . . -76.23 -1.17 25.13 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.154 -0.475 . . . . 20.0 111.498 -179.659 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.581 ' C ' HD13 ' A' ' 89' ' ' LEU . 27.4 tpt180 -71.61 133.83 45.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.944 0.402 . . . . 20.0 110.743 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.709 ' HB3' HG21 ' A' ' 97' ' ' VAL . 0.4 OUTLIER -113.01 124.23 52.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.934 -0.576 . . . . 20.0 110.119 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.605 ' O ' ' CH2' ' A' ' 100' ' ' TRP . 0.2 OUTLIER -119.45 85.16 31.08 Favored Pre-proline 0 C--N 1.33 -0.261 0 N-CA-C 111.866 0.321 . . . . 20.0 111.866 -179.485 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.478 ' HA ' ' CH2' ' A' ' 100' ' ' TRP . 88.7 Cg_endo -91.39 138.53 2.23 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 123.095 2.53 . . . . 20.0 112.002 179.216 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.46 ' OD1' ' O ' ' A' ' 91' ' ' PRO . 75.7 m-20 -138.87 13.13 2.68 Favored 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 120.825 -0.35 . . . . 20.0 111.387 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.518 ' HB3' ' CH2' ' A' ' 99' ' ' TRP . . . -119.22 -81.74 0.63 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.23 0.538 . . . . 20.0 110.916 179.137 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.429 ' H ' HD12 ' A' ' 94' ' ' ILE . 2.8 mp -97.11 -4.92 9.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.369 -0.832 . . . . 20.0 111.105 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 94.72 -1.48 65.97 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.927 -0.654 . . . . 20.0 111.652 -179.095 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.561 ' NE ' ' HD2' ' A' ' 98' ' ' LYS . 2.7 ptm180 -116.52 139.02 50.94 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.872 0.368 . . . . 20.0 110.934 -179.783 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.917 HG12 ' HD2' ' A' ' 101' ' ' ARG . 0.2 OUTLIER -106.48 110.47 31.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.982 -0.554 . . . . 20.0 109.739 179.702 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.589 ' HG3' ' CD1' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -161.74 20.65 0.11 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.217 -0.901 . . . . 20.0 111.112 -177.123 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.711 ' CZ3' ' CE3' ' A' ' 100' ' ' TRP . 0.0 OUTLIER -148.6 -83.6 0.11 Allowed 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.117 -0.697 . . . . 20.0 109.117 -177.302 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 100' ' ' TRP . . . . . 0.711 ' CE3' ' CZ3' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -90.84 134.58 34.34 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.369 -0.975 . . . . 20.0 108.369 177.67 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.917 ' HD2' HG12 ' A' ' 97' ' ' VAL . 0.1 OUTLIER -139.52 97.58 8.3 Favored Pre-proline 0 C--N 1.32 -0.716 0 C-N-CA 120.662 -0.415 . . . . 20.0 110.981 -179.061 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.436 ' HG3' ' NE1' ' A' ' 100' ' ' TRP . 38.5 Cg_exo -58.41 -36.55 97.41 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.709 2.272 . . . . 20.0 112.552 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -94.58 5.65 51.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.252 -0.431 . . . . 20.0 110.748 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.448 ' HA2' ' HD3' ' A' ' 105' ' ' PRO . . . 93.44 145.38 17.19 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.925 -0.655 . . . . 20.0 112.061 -179.586 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.448 ' HD3' ' HA2' ' A' ' 104' ' ' GLY . 20.5 Cg_exo -65.81 163.85 29.17 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.845 2.363 . . . . 20.0 112.281 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 57.0 p30 -60.85 170.74 1.4 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.224 -0.444 . . . . 20.0 111.255 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.583 ' CE1' ' O ' ' A' ' 85' ' ' GLY . 59.5 m-85 -66.32 140.37 58.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.053 -0.522 . . . . 20.0 110.675 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 142' ' ' CYS . 62.2 ttt-85 -143.66 -116.57 0.1 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 120.986 -0.286 . . . . 20.0 111.271 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.508 ' HB2' ' HB3' ' A' ' 54' ' ' SER . 1.3 t -138.4 130.68 28.76 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.995 0.426 . . . . 20.0 111.547 -179.32 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.67 HD12 ' O ' ' A' ' 143' ' ' LYS . 2.0 mt -123.69 119.51 26.99 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.939 -0.573 . . . . 20.0 110.259 178.728 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.709 ' HB3' HG11 ' A' ' 137' ' ' VAL . 9.2 Cg_endo -53.07 138.03 62.56 Favored 'Trans proline' 0 N--CA 1.464 -0.256 0 C-N-CA 122.455 2.103 . . . . 20.0 111.549 -179.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 46.6 t0 -120.51 -60.14 1.7 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.511 -0.313 . . . . 20.0 111.538 -179.272 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.441 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 53.2 ttt85 -126.38 143.59 51.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.286 -0.415 . . . . 20.0 111.519 -179.678 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.818 ' CD1' HG13 ' A' ' 137' ' ' VAL . 2.3 m-85 -118.66 157.39 27.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.908 -0.587 . . . . 20.0 110.6 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.652 ' HB2' ' HB2' ' A' ' 138' ' ' ALA . 55.5 ttm-85 -93.74 139.84 30.36 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 108.602 -0.888 . . . . 20.0 108.602 178.024 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -77.01 131.68 38.58 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 120.302 -0.559 . . . . 20.0 110.684 -178.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.673 ' CD ' HD23 ' A' ' 136' ' ' LEU . 13.4 mt-30 -133.46 101.87 5.31 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.961 -0.563 . . . . 20.0 110.57 -179.683 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 43.2 ttt85 -109.21 99.54 8.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.967 0.413 . . . . 20.0 110.28 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.721 ' HB ' HD21 ' A' ' 64' ' ' LEU . 45.3 t -129.33 148.92 33.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 115.895 -0.593 . . . . 20.0 110.976 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.565 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 13.1 pt20 -92.21 134.82 34.52 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.391 -0.368 . . . . 20.0 110.223 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.697 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.2 OUTLIER -74.48 120.85 20.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.137 0.494 . . . . 20.0 111.134 -179.27 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.509 ' N ' ' O ' ' A' ' 70' ' ' ARG . 0.2 OUTLIER -89.69 138.77 31.19 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.469 -0.787 . . . . 20.0 111.114 -179.242 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 123' ' ' CYS . . . . . 0.565 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -106.64 119.39 51.74 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 116.06 -0.518 . . . . 20.0 111.02 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.8 103.11 0.81 Allowed 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.023 1.815 . . . . 20.0 111.147 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 87.28 13.81 65.19 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.635 -0.793 . . . . 20.0 111.503 -179.123 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' GLY . . . . . 0.54 ' O ' ' HB3' ' A' ' 123' ' ' CYS . . . -145.4 116.95 0.95 Allowed Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.543 -0.623 . . . . 20.0 111.543 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.489 ' O ' ' HD2' ' A' ' 129' ' ' PRO . . . -83.46 42.95 0.86 Allowed 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 112.057 0.391 . . . . 20.0 112.057 -178.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.447 ' N ' ' CD ' ' A' ' 129' ' ' PRO . . . -113.44 53.89 0.56 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.125 0.488 . . . . 20.0 110.648 179.314 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' PRO . . . . . 0.49 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 36.9 Cg_endo -65.86 151.58 83.83 Favored 'Trans proline' 0 N--CA 1.464 -0.251 0 C-N-CA 122.977 2.451 . . . . 20.0 112.767 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.697 ' HB2' HD12 ' A' ' 121' ' ' LEU . 80.8 mtt85 -134.98 155.76 50.19 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 116.004 -0.544 . . . . 20.0 110.634 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.45 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 13.2 p -103.52 133.46 48.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.86 0.362 . . . . 20.0 111.23 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 60.6 ttt85 -140.37 143.57 35.79 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.094 -0.503 . . . . 20.0 111.593 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -97.02 149.31 22.06 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 115.884 -0.598 . . . . 20.0 110.44 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.722 HG12 HD21 ' A' ' 136' ' ' LEU . 3.2 t -147.68 123.92 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-O 121.118 0.485 . . . . 20.0 111.768 -179.607 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.681 ' C ' HD22 ' A' ' 136' ' ' LEU . 93.9 mtt-85 -100.45 109.73 21.89 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.516 -0.765 . . . . 20.0 109.526 178.351 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.735 HD22 ' N ' ' A' ' 136' ' ' LEU . 1.1 mm? -111.57 125.69 54.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.1 0.476 . . . . 20.0 112.224 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.818 HG13 ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -52.83 83.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.1 -0.5 . . . . 20.0 111.393 179.853 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.652 ' HB2' ' HB2' ' A' ' 115' ' ' ARG . . . -74.36 -8.83 57.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.082 0.468 . . . . 20.0 110.039 178.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.7 p -163.09 121.33 2.01 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.653 -0.703 . . . . 20.0 109.68 179.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' CYS . . . . . . . . . . . . . 12.5 p -137.01 162.46 33.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.979 0.418 . . . . 20.0 111.631 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 75.6 mttt -143.67 159.68 42.03 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.924 -0.58 . . . . 20.0 111.198 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 142' ' ' CYS . . . . . 0.543 ' SG ' ' CE2' ' A' ' 53' ' ' TYR . 36.1 t -73.02 109.17 6.35 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.021 0.439 . . . . 20.0 110.208 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.67 ' O ' HD12 ' A' ' 110' ' ' ILE . 3.3 tmtm? -113.2 124.7 53.14 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.685 -0.689 . . . . 20.0 110.961 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.549 ' N ' ' HD3' ' A' ' 143' ' ' LYS . 3.4 mpt_? . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.315 -0.85 . . . . 20.0 110.874 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 92.1 mttt . . . . . 0 N--CA 1.485 1.32 0 CA-C-O 120.957 0.408 . . . . 20.0 111.025 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.484 ' HB2' ' CD ' ' A' ' 52' ' ' GLU . 39.8 p30 -84.84 16.22 3.47 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.892 -0.595 . . . . 20.0 111.691 -179.598 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 71.8 t -66.5 -31.12 52.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 116.229 -0.441 . . . . 20.0 111.344 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.1 p -87.39 -1.54 57.99 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.265 0.469 . . . . 20.0 112.265 -178.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.484 ' CD ' ' HB2' ' A' ' 49' ' ' ASP . 96.8 mt-10 -64.62 -35.5 81.22 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.867 0.365 . . . . 20.0 111.031 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.557 ' CE2' ' O ' ' A' ' 140' ' ' CYS . 40.0 p90 -101.3 -1.36 33.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.325 -0.398 . . . . 20.0 111.221 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 73.9 m -80.42 141.31 35.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.294 0.569 . . . . 20.0 111.46 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.518 ' HB3' ' HA3' ' A' ' 82' ' ' GLY . 0.0 OUTLIER -93.26 -36.85 12.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.149 -0.932 . . . . 20.0 110.977 -179.297 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.514 ' HD2' ' N ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -162.5 164.39 27.01 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.436 -0.347 . . . . 20.0 110.882 -179.875 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -56.22 85.35 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.155 0 N-CA-C 109.588 -0.523 . . . . 20.0 109.588 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 1.117 HD22 ' N ' ' A' ' 59' ' ' HIS . 0.0 OUTLIER -108.43 132.7 53.52 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.671 -0.695 . . . . 20.0 112.813 -178.133 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 1.117 ' N ' HD22 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -169.29 101.39 0.35 Allowed 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 116.021 -0.536 . . . . 20.0 111.439 177.294 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.602 ' CD2' HG11 ' A' ' 79' ' ' VAL . 20.6 m-30 -110.67 150.06 29.57 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.698 0.629 . . . . 20.0 112.698 -179.018 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 24.0 p -118.88 84.99 2.28 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 115.051 -0.977 . . . . 20.0 110.293 178.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.876 ' O ' HG21 ' A' ' 75' ' ' VAL . 57.1 ttt85 -112.43 125.64 54.44 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 108.473 -0.936 . . . . 20.0 108.473 178.44 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.851 ' CD1' HG22 ' A' ' 75' ' ' VAL . 0.1 OUTLIER -110.01 -84.75 0.55 Allowed 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.555 0.576 . . . . 20.0 112.555 -177.935 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.916 HD21 ' CG2' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -164.5 132.55 3.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.888 0.375 . . . . 20.0 111.448 -178.68 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.977 HG22 ' HG3' ' A' ' 70' ' ' ARG . 44.2 p -131.44 132.92 44.69 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.95 -0.568 . . . . 20.0 110.603 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.762 ' CG ' HD13 ' A' ' 121' ' ' LEU . 20.1 p-10 -145.01 -161.36 1.28 Allowed 'General case' 0 C--O 1.237 0.426 0 N-CA-C 110.355 -0.239 . . . . 20.0 110.355 179.377 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.837 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -30.51 149.09 0.01 OUTLIER Glycine 0 C--N 1.342 0.902 0 CA-C-O 118.784 -1.009 . . . . 20.0 110.688 179.183 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.502 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 57.0 Cg_exo -16.67 53.42 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.657 1 C-N-CA 125.852 4.368 . . . . 20.0 115.613 -178.476 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.837 ' N ' ' O ' ' A' ' 67' ' ' GLY . 18.3 m -164.56 160.28 20.1 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 108.344 -0.984 . . . . 20.0 108.344 178.412 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.977 ' HG3' HG22 ' A' ' 65' ' ' THR . 71.5 ttt180 -153.58 140.46 19.16 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.865 0.364 . . . . 20.0 111.414 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.654 ' HA ' HD12 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -81.15 165.19 21.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.923 -0.581 . . . . 20.0 110.324 179.279 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -148.26 24.03 1.03 Allowed 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.672 0.619 . . . . 20.0 112.672 178.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.67 ' O ' HG13 ' A' ' 75' ' ' VAL . 1.8 mmpt? -67.3 128.97 93.84 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 109.786 -0.45 . . . . 20.0 109.786 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -46.69 117.72 2.24 Favored 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 122.411 2.074 . . . . 20.0 112.693 -179.44 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.876 HG21 ' O ' ' A' ' 62' ' ' ARG . 28.8 m -133.24 155.69 41.09 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.244 0 CA-C-N 116.14 -0.482 . . . . 20.0 110.893 179.484 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.424 HG22 HD11 ' A' ' 78' ' ' LEU . 14.3 m -116.54 121.24 41.21 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.786 -0.45 . . . . 20.0 109.786 177.847 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.569 ' C ' HD12 ' A' ' 78' ' ' LEU . 78.6 tt0 -120.53 124.07 44.45 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.945 -0.57 . . . . 20.0 110.414 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.873 ' HA ' HD11 ' A' ' 58' ' ' LEU . 3.9 mp -111.47 120.59 42.67 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 121.646 0.736 . . . . 20.0 111.61 -179.694 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.842 HG23 ' O ' ' A' ' 79' ' ' VAL . 3.9 m -106.12 79.87 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.068 0 CA-C-N 114.544 -1.207 . . . . 20.0 109.509 178.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.478 ' O ' ' O ' ' A' ' 109' ' ' CYS . 0.8 OUTLIER -82.54 113.49 20.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.939 -0.573 . . . . 20.0 110.85 -179.071 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.494 ' O ' ' NH1' ' A' ' 56' ' ' ARG . 3.1 m -146.56 98.87 3.13 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.048 -0.523 . . . . 20.0 110.833 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.528 ' CA ' ' SG ' ' A' ' 109' ' ' CYS . . . -166.19 -146.53 4.86 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.633 -0.794 . . . . 20.0 112.051 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.478 ' HA ' ' HA ' ' A' ' 108' ' ' ARG . 88.1 mt-30 -126.18 145.98 50.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.709 0.29 . . . . 20.0 110.607 179.377 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.519 ' N ' ' O ' ' A' ' 107' ' ' PHE . 0.0 OUTLIER -131.3 160.6 34.47 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.334 -0.393 . . . . 20.0 111.454 179.498 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -129.12 70.51 0.51 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.578 -0.82 . . . . 20.0 112.408 179.093 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' PRO . . . . . 0.516 ' HG2' ' CD2' ' A' ' 107' ' ' PHE . 53.3 Cg_exo -56.21 145.26 77.72 Favored 'Trans proline' 0 N--CA 1.471 0.165 0 C-N-CA 123.42 2.747 . . . . 20.0 112.426 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.515 ' O ' HD22 ' A' ' 89' ' ' LEU . . . -70.39 -8.39 50.36 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.374 -0.376 . . . . 20.0 110.438 179.095 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.515 ' C ' HD13 ' A' ' 89' ' ' LEU . 16.0 tpt180 -85.35 109.54 18.47 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.244 -0.434 . . . . 20.0 110.014 179.339 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.602 HD12 ' O ' ' A' ' 103' ' ' ASN . 0.4 OUTLIER -102.85 110.12 21.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.141 -0.482 . . . . 20.0 111.179 -179.457 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.482 ' HA ' HD23 ' A' ' 90' ' ' LEU . 0.8 OUTLIER -125.71 95.69 39.68 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 112.357 0.502 . . . . 20.0 112.357 179.948 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.6 ' HB2' ' NE1' ' A' ' 100' ' ' TRP . 69.2 Cg_exo -41.81 112.89 0.25 Allowed 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 122.117 1.878 . . . . 20.0 111.299 178.319 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.492 ' O ' ' CH2' ' A' ' 99' ' ' TRP . 52.9 t-20 -100.43 134.73 42.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.37 0.605 . . . . 20.0 112.244 -179.063 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.649 ' CB ' HG22 ' A' ' 97' ' ' VAL . . . -68.04 -20.37 64.97 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.998 -1.001 . . . . 20.0 111.735 179.19 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.875 HD12 ' CH2' ' A' ' 99' ' ' TRP . 6.4 mt 29.8 35.0 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-O 121.438 0.637 . . . . 20.0 111.265 -179.242 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLY . . . . . 0.556 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 111.3 -50.98 0.73 Allowed Glycine 0 CA--C 1.523 0.579 0 CA-C-N 114.998 -1.001 . . . . 20.0 113.611 179.221 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.501 ' O ' ' CZ2' ' A' ' 99' ' ' TRP . 13.5 tpt180 -126.3 143.69 51.07 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 117.08 0.44 . . . . 20.0 110.352 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 1.018 HG13 ' CZ3' ' A' ' 100' ' ' TRP . 5.8 t -119.94 136.33 57.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 CA-C-O 122.064 0.935 . . . . 20.0 112.805 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.447 ' HG3' ' HD1' ' A' ' 99' ' ' TRP . 0.2 OUTLIER 164.77 -32.9 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 113.672 -1.604 . . . . 20.0 108.791 -179.933 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.875 ' CH2' HD12 ' A' ' 94' ' ' ILE . 24.6 p-90 -95.57 39.66 1.12 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 113.336 -1.756 . . . . 20.0 109.732 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' TRP . . . . . 1.018 ' CZ3' HG13 ' A' ' 97' ' ' VAL . 0.0 OUTLIER -45.85 140.96 3.28 Favored 'General case' 0 CA--C 1.501 -0.907 0 N-CA-C 113.53 0.937 . . . . 20.0 113.53 -177.613 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.88 79.35 24.35 Favored Pre-proline 0 N--CA 1.44 -0.972 0 CA-C-N 113.974 -1.466 . . . . 20.0 110.173 179.201 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.559 ' HA ' ' HG3' ' A' ' 91' ' ' PRO . 9.5 Cg_endo -52.47 -18.12 7.72 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.774 2.316 . . . . 20.0 111.736 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ASN . . . . . 0.602 ' O ' HD12 ' A' ' 89' ' ' LEU . 80.0 m-20 -83.83 2.34 38.73 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.21 -0.45 . . . . 20.0 111.197 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.489 ' HA3' ' HA ' ' A' ' 89' ' ' LEU . . . 62.33 147.71 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.906 -0.664 . . . . 20.0 112.729 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -83.13 157.02 15.04 Favored 'Trans proline' 0 N--CA 1.458 -0.612 0 C-N-CA 122.994 2.463 . . . . 20.0 112.515 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -74.01 135.93 43.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.239 -0.437 . . . . 20.0 109.938 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.519 ' O ' ' N ' ' A' ' 84' ' ' CYS . 86.8 m-85 -109.24 130.57 55.49 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.904 0.383 . . . . 20.0 111.758 -178.496 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.518 ' HA ' ' O ' ' A' ' 82' ' ' GLY . 93.6 mtm-85 -69.0 143.91 54.25 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 116.059 -0.519 . . . . 20.0 111.844 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.667 ' HA ' ' HA ' ' A' ' 142' ' ' CYS . 0.6 OUTLIER -80.26 102.15 9.32 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 109.31 -0.626 . . . . 20.0 109.31 178.26 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 1.2 pt -121.62 160.61 45.65 Favored Pre-proline 0 N--CA 1.463 0.211 0 CA-C-O 120.727 0.299 . . . . 20.0 111.784 -178.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.996 ' HB3' HG11 ' A' ' 137' ' ' VAL . 14.5 Cg_exo -66.6 157.31 61.43 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.792 2.328 . . . . 20.0 112.112 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -137.2 -57.41 0.71 Allowed 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.508 0.558 . . . . 20.0 112.508 -179.287 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.539 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 57.5 ttt180 -117.63 154.15 32.07 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.542 0.211 . . . . 20.0 111.444 -179.159 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 1.01 ' CE2' HG13 ' A' ' 137' ' ' VAL . 2.3 m-85 -127.81 155.3 44.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.488 0.661 . . . . 20.0 111.82 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.529 ' NH2' ' HB1' ' A' ' 138' ' ' ALA . 27.3 ttm-85 -94.29 146.27 24.15 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.968 -1.014 . . . . 20.0 108.959 178.715 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -94.74 116.39 28.68 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.29 0.567 . . . . 20.0 110.65 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -130.63 111.62 12.38 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.531 -0.759 . . . . 20.0 109.684 179.958 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 59.9 ttp180 -110.49 101.3 10.0 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.877 -0.601 . . . . 20.0 110.356 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.916 ' CG2' HD21 ' A' ' 64' ' ' LEU . 35.4 m -125.42 162.95 27.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 120.872 0.368 . . . . 20.0 111.264 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.564 ' HA ' ' HA ' ' A' ' 131' ' ' SER . 14.4 pt20 -95.99 137.84 34.48 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-O 121.53 0.681 . . . . 20.0 112.17 -178.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.764 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -74.79 133.9 41.88 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 115.218 -0.901 . . . . 20.0 109.557 179.094 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.655 HD12 ' N ' ' A' ' 122' ' ' LEU . 2.3 mp -94.72 140.34 30.02 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.404 0.621 . . . . 20.0 111.638 -178.55 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 123' ' ' CYS . . . . . 0.531 ' SG ' ' HD2' ' A' ' 124' ' ' PRO . 0.3 OUTLIER -117.85 154.8 51.3 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 115.27 -0.877 . . . . 20.0 109.455 178.957 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.531 ' HD2' ' SG ' ' A' ' 123' ' ' CYS . 51.3 Cg_exo -53.32 114.1 1.59 Allowed 'Trans proline' 0 N--CA 1.463 -0.283 0 C-N-CA 121.958 1.772 . . . . 20.0 112.083 -179.519 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.423 ' O ' ' C ' ' A' ' 126' ' ' GLY . . . 100.64 2.64 55.35 Favored Glycine 0 N--CA 1.451 -0.349 0 CA-C-N 115.768 -0.651 . . . . 20.0 112.628 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' GLY . . . . . 0.423 ' C ' ' O ' ' A' ' 125' ' ' GLY . . . 36.38 61.93 0.8 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.667 -0.777 . . . . 20.0 111.811 -179.861 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -103.0 -56.62 2.19 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.519 0.563 . . . . 20.0 112.519 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -125.28 58.3 19.73 Favored Pre-proline 0 C--N 1.325 -0.484 0 C-N-CA 120.886 -0.326 . . . . 20.0 111.819 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -48.87 150.15 6.92 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.477 2.118 . . . . 20.0 111.295 178.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.764 ' HB2' HD12 ' A' ' 121' ' ' LEU . 98.3 mtt180 -123.75 148.43 46.63 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 121.054 -0.258 . . . . 20.0 110.86 -179.609 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.564 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 22.9 t -100.46 134.61 43.16 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.004 0.431 . . . . 20.0 111.705 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' ARG . . . . . 0.542 ' HD3' ' CB ' ' A' ' 64' ' ' LEU . 47.4 ttt85 -141.2 141.77 34.04 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.854 -0.612 . . . . 20.0 111.194 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 16.7 pttm -92.91 145.2 24.56 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.783 0.325 . . . . 20.0 111.067 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.497 HG21 ' O ' ' A' ' 63' ' ' PHE . 41.2 t -147.66 130.62 8.0 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.799 0 CA-C-O 121.529 0.681 . . . . 20.0 112.295 -179.058 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.625 ' O ' HD23 ' A' ' 136' ' ' LEU . 36.5 ptt-85 -113.52 111.85 22.59 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.868 -1.06 . . . . 20.0 109.652 178.411 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.625 HD23 ' O ' ' A' ' 135' ' ' ARG . 8.7 mt -119.05 143.05 47.32 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.372 0.508 . . . . 20.0 112.372 -179.315 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 1.01 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -63.32 83.76 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.989 -0.551 . . . . 20.0 111.028 179.192 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.529 ' HB1' ' NH2' ' A' ' 115' ' ' ARG . . . -65.98 -19.82 65.99 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.881 0.372 . . . . 20.0 110.672 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 38.6 t -161.82 133.45 5.46 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.06 -0.518 . . . . 20.0 110.372 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' CYS . . . . . 0.565 ' CB ' ' HA ' ' A' ' 111' ' ' PRO . 26.6 p -133.81 165.49 24.86 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.211 0.529 . . . . 20.0 112.09 -179.432 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 28.2 mttp -120.81 138.29 54.11 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.357 -0.838 . . . . 20.0 109.226 178.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' CYS . . . . . 0.667 ' HA ' ' HA ' ' A' ' 109' ' ' CYS . 24.5 p -80.38 92.39 5.81 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.475 -0.49 . . . . 20.0 111.15 -178.864 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 11.3 tptp -138.38 157.9 45.32 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.116 -0.493 . . . . 20.0 111.069 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 39.0 mtp85 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.352 -0.833 . . . . 20.0 110.717 -179.373 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.8 mttm . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.851 0.357 . . . . 20.0 111.086 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -84.75 14.51 4.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.199 -0.455 . . . . 20.0 111.436 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 70.3 t -66.2 -40.32 86.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.313 -0.403 . . . . 20.0 111.402 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.4 p -82.8 -7.94 59.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.378 -0.374 . . . . 20.0 110.951 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.483 ' HB3' ' HB2' ' A' ' 83' ' ' GLN . 71.9 mm-40 -79.96 4.84 15.61 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.307 -0.406 . . . . 20.0 110.707 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.567 ' CD2' ' SG ' ' A' ' 142' ' ' CYS . 3.3 m-85 -95.5 19.6 10.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.058 -0.519 . . . . 20.0 111.614 -179.445 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.79 107.35 0.39 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.377 0.608 . . . . 20.0 110.225 -179.546 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.493 ' HB3' ' SG ' ' A' ' 80' ' ' CYS . 3.2 m -155.06 22.01 0.43 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.057 -0.974 . . . . 20.0 109.83 -179.669 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.755 HH11 HD23 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -48.33 -173.99 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.384 -0.826 . . . . 20.0 111.388 -179.195 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -78.15 91.96 4.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.79 -0.641 . . . . 20.0 110.751 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 1.076 HD22 HG23 ' A' ' 79' ' ' VAL . 0.0 OUTLIER -104.67 140.7 37.67 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.376 -0.829 . . . . 20.0 110.013 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.602 ' CG ' HG22 ' A' ' 76' ' ' THR . 3.0 m-70 -125.52 130.75 52.38 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.546 -0.462 . . . . 20.0 111.486 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.634 ' CD1' HG13 ' A' ' 79' ' ' VAL . 0.2 OUTLIER -147.9 161.8 40.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.988 0.423 . . . . 20.0 111.28 179.483 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.555 HG23 ' CE1' ' A' ' 63' ' ' PHE . 52.8 m -76.11 136.22 39.85 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.609 0.719 . . . . 20.0 112.128 -178.67 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.893 ' O ' HG21 ' A' ' 75' ' ' VAL . 47.4 tpt85 174.86 109.61 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.59 -1.186 . . . . 20.0 108.799 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.584 ' HD1' HG13 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -116.41 -80.95 0.61 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.551 0.575 . . . . 20.0 112.551 -178.343 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.635 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -164.57 132.45 3.32 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 112.109 0.411 . . . . 20.0 112.109 -178.786 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.491 ' O ' ' NH1' ' A' ' 132' ' ' ARG . 72.6 p -129.12 136.62 50.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.067 -0.515 . . . . 20.0 110.232 178.517 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.868 ' OD2' HD13 ' A' ' 121' ' ' LEU . 31.4 p-10 -145.34 -164.33 1.92 Allowed 'General case' 0 C--O 1.237 0.426 0 CA-C-N 116.454 -0.339 . . . . 20.0 110.361 -179.789 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.845 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -31.72 147.99 0.01 OUTLIER Glycine 0 C--N 1.345 1.028 0 CA-C-O 118.453 -1.193 . . . . 20.0 110.152 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.547 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 56.3 Cg_exo -16.99 56.07 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.689 0 C-N-CA 125.167 3.911 . . . . 20.0 115.103 -178.388 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.845 ' N ' ' O ' ' A' ' 67' ' ' GLY . 34.4 m -163.22 157.68 20.69 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 108.272 -1.01 . . . . 20.0 108.272 178.603 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.517 ' O ' ' N ' ' A' ' 122' ' ' LEU . 80.6 mtt180 -149.26 143.95 26.2 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.679 0.622 . . . . 20.0 112.679 -179.448 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.635 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -89.02 159.01 17.8 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.478 -0.783 . . . . 20.0 109.521 177.938 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.578 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . . . -145.85 22.7 1.41 Allowed 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 113.68 0.992 . . . . 20.0 113.68 -179.354 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.751 ' CB ' HG11 ' A' ' 119' ' ' VAL . 0.1 OUTLIER -67.11 139.74 95.41 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 109.433 -0.58 . . . . 20.0 109.433 178.999 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.46 ' HD2' ' HG3' ' A' ' 73' ' ' LYS . 54.1 Cg_exo -51.87 125.94 18.53 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.353 2.035 . . . . 20.0 112.333 -179.127 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.893 HG21 ' O ' ' A' ' 62' ' ' ARG . 19.0 m -131.41 161.07 41.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.001 0.429 . . . . 20.0 111.248 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.602 HG22 ' CG ' ' A' ' 59' ' ' HIS . 0.0 OUTLIER -134.97 97.08 3.65 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.849 -0.614 . . . . 20.0 109.983 178.749 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.634 ' OE2' HD22 ' A' ' 136' ' ' LEU . 67.8 mt-10 -110.99 161.27 16.03 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.738 -0.664 . . . . 20.0 110.23 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.522 ' HA ' ' O ' ' A' ' 58' ' ' LEU . 8.7 mp -111.02 132.98 53.76 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.404 0.621 . . . . 20.0 111.494 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 1.076 HG23 HD22 ' A' ' 58' ' ' LEU . 23.4 m -87.05 78.16 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 CA-C-N 115.023 -0.989 . . . . 20.0 110.073 -179.446 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.493 ' SG ' ' HB3' ' A' ' 55' ' ' CYS . 0.1 OUTLIER -81.54 102.97 10.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.801 -0.636 . . . . 20.0 110.99 -179.084 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.0 m -146.3 104.91 3.83 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.866 -0.606 . . . . 20.0 111.045 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -161.43 -176.09 33.16 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.513 -0.851 . . . . 20.0 112.7 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.483 ' HB2' ' HB3' ' A' ' 52' ' ' GLU . 93.3 mt-30 -120.27 117.05 26.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.86 0.362 . . . . 20.0 110.299 179.444 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.516 ' HA ' ' CE1' ' A' ' 53' ' ' TYR . 86.3 m -84.26 -16.06 44.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.969 -0.56 . . . . 20.0 111.444 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLY . . . . . 0.537 ' N ' ' HB2' ' A' ' 107' ' ' PHE . . . -141.96 172.07 24.25 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.622 -0.799 . . . . 20.0 112.651 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -52.66 -166.53 0.01 OUTLIER 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.804 2.336 . . . . 20.0 112.321 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -86.98 34.11 0.67 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.068 -0.514 . . . . 20.0 111.174 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.548 ' NH2' ' CD1' ' A' ' 100' ' ' TRP . 25.5 tpt180 -56.25 131.91 49.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.085 0.469 . . . . 20.0 111.292 -179.284 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.718 HD22 ' N ' ' A' ' 89' ' ' LEU . 1.1 mm? -97.19 156.08 16.56 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.631 -0.713 . . . . 20.0 111.569 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.511 ' CD1' ' HD2' ' A' ' 91' ' ' PRO . 4.5 mm? -68.23 165.15 36.28 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.934 -0.575 . . . . 20.0 110.636 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.61 ' HA ' ' CZ2' ' A' ' 100' ' ' TRP . 16.2 Cg_endo -57.44 107.93 0.33 Allowed 'Trans proline' 0 CA--C 1.528 0.223 0 C-N-CA 123.014 2.476 . . . . 20.0 113.375 -179.403 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.422 ' N ' ' CZ2' ' A' ' 100' ' ' TRP . 90.5 m-20 -126.04 59.68 1.31 Allowed 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.29 -0.414 . . . . 20.0 111.642 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.614 ' HA ' ' CZ3' ' A' ' 100' ' ' TRP . . . -59.87 -28.48 67.57 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.692 0.627 . . . . 20.0 112.692 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.444 ' C ' ' O ' ' A' ' 93' ' ' ALA . 1.0 OUTLIER 36.7 29.95 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.122 0.487 . . . . 20.0 110.608 -178.74 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLY . . . . . 0.507 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 98.7 -34.34 5.4 Favored Glycine 0 CA--C 1.522 0.484 0 CA-C-N 115.647 -0.706 . . . . 20.0 113.302 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.529 ' N ' ' O ' ' A' ' 93' ' ' ALA . 40.8 ttp180 -112.95 146.82 38.33 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.888 0.375 . . . . 20.0 111.869 -179.362 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 1.018 HG12 ' HD2' ' A' ' 101' ' ' ARG . 11.3 t -146.59 121.91 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.125 0 CA-C-N 116.078 -0.51 . . . . 20.0 110.477 178.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.691 ' HG3' ' CD1' ' A' ' 99' ' ' TRP . 3.1 ptpt 178.92 33.33 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.445 0.64 . . . . 20.0 110.747 -178.592 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.691 ' CD1' ' HG3' ' A' ' 98' ' ' LYS . 0.0 OUTLIER -151.11 -66.91 0.19 Allowed 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 107.647 -1.242 . . . . 20.0 107.647 -178.0 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 100' ' ' TRP . . . . . 0.639 ' O ' ' CE3' ' A' ' 100' ' ' TRP . 0.0 OUTLIER -99.39 129.06 45.56 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 107.146 -1.427 . . . . 20.0 107.146 176.34 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 1.018 ' HD2' HG12 ' A' ' 97' ' ' VAL . 0.2 OUTLIER -137.17 127.46 15.89 Favored Pre-proline 0 C--N 1.318 -0.793 0 C-N-CA 119.412 -0.915 . . . . 20.0 111.728 179.963 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.461 ' HD2' ' HA ' ' A' ' 101' ' ' ARG . 84.1 Cg_exo -26.75 61.3 0.0 OUTLIER 'Trans proline' 0 C--N 1.355 0.896 1 C-N-CA 126.092 4.528 . . . . 20.0 116.204 -179.01 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ASN . . . . . 0.657 ' N ' ' O ' ' A' ' 101' ' ' ARG . 79.3 m-20 -86.97 7.4 27.68 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.013 0.435 . . . . 20.0 110.254 178.71 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 129.18 147.48 6.36 Favored Glycine 0 N--CA 1.449 -0.488 0 CA-C-N 115.892 -0.595 . . . . 20.0 112.269 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -65.38 156.85 61.11 Favored 'Trans proline' 0 CA--C 1.528 0.176 0 C-N-CA 122.755 2.303 . . . . 20.0 112.562 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 57.1 p30 -52.88 164.65 0.36 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.052 -0.522 . . . . 20.0 111.015 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.537 ' HB2' ' N ' ' A' ' 85' ' ' GLY . 23.3 m-85 -120.06 148.51 43.49 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.21 -0.45 . . . . 20.0 111.544 -179.275 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.471 ' HA ' ' HA ' ' A' ' 83' ' ' GLN . 36.6 ttm180 -169.02 131.56 1.27 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.943 -0.571 . . . . 20.0 111.026 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.453 ' HB2' ' HB2' ' A' ' 142' ' ' CYS . 23.4 t -61.97 112.66 2.42 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.049 -0.723 . . . . 20.0 109.049 179.376 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.561 ' CG1' ' HD2' ' A' ' 111' ' ' PRO . 10.8 tt -127.3 144.82 52.08 Favored Pre-proline 0 C--N 1.33 -0.273 0 N-CA-C 112.403 0.52 . . . . 20.0 112.403 -178.529 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 1.038 ' HB3' HG11 ' A' ' 137' ' ' VAL . 47.1 Cg_exo -56.61 154.71 29.55 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 123.126 2.551 . . . . 20.0 111.85 179.609 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -124.67 -60.74 1.36 Allowed 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.539 0.57 . . . . 20.0 112.539 -179.13 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.813 ' O ' HG12 ' A' ' 137' ' ' VAL . 56.9 ttm-85 -111.98 156.66 21.78 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.104 0.409 . . . . 20.0 112.104 -178.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.979 ' CE2' HG13 ' A' ' 137' ' ' VAL . 4.4 m-85 -134.51 165.49 25.08 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.681 -0.69 . . . . 20.0 112.188 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.514 ' N ' ' O ' ' A' ' 136' ' ' LEU . 14.2 ttm180 -103.3 151.31 22.86 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.611 -1.177 . . . . 20.0 108.358 177.739 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -90.52 124.84 35.33 Favored 'General case' 0 C--N 1.319 -0.761 0 C-N-CA 120.482 -0.487 . . . . 20.0 111.597 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.413 ' O ' ' HA ' ' A' ' 133' ' ' LYS . 23.6 mm100 -131.44 131.3 43.44 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.889 -0.596 . . . . 20.0 110.71 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.414 ' HA ' ' O ' ' A' ' 132' ' ' ARG . 50.9 mtm180 -127.35 95.68 4.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.203 -0.453 . . . . 20.0 110.156 178.776 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.751 HG11 ' CB ' ' A' ' 73' ' ' LYS . 41.5 t -119.22 145.44 25.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.813 -0.631 . . . . 20.0 111.2 -179.45 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.524 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 8.1 pt20 -79.27 131.23 36.09 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.174 -0.467 . . . . 20.0 109.803 179.53 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.9 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -78.46 125.49 29.44 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.088 0.471 . . . . 20.0 109.785 179.91 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.517 ' N ' ' O ' ' A' ' 70' ' ' ARG . 0.3 OUTLIER -85.77 131.96 34.22 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.435 -0.802 . . . . 20.0 111.665 -178.35 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 123' ' ' CYS . . . . . 0.566 ' CB ' ' HB3' ' A' ' 128' ' ' ALA . 0.5 OUTLIER -108.71 159.96 29.03 Favored Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 115.16 -0.927 . . . . 20.0 109.035 179.028 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.556 ' HD2' ' SG ' ' A' ' 123' ' ' CYS . 73.8 Cg_exo -50.71 111.11 0.48 Allowed 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 121.605 1.537 . . . . 20.0 111.913 -179.144 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 96.41 -11.11 67.14 Favored Glycine 0 N--CA 1.448 -0.501 0 CA-C-N 115.715 -0.675 . . . . 20.0 112.232 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 72.26 23.39 78.03 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 120.751 -0.737 . . . . 20.0 112.298 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -92.9 -5.86 49.92 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.333 0.494 . . . . 20.0 112.333 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.566 ' HB3' ' CB ' ' A' ' 123' ' ' CYS . . . -133.12 51.02 6.25 Favored Pre-proline 0 C--N 1.331 -0.23 0 N-CA-C 112.727 0.64 . . . . 20.0 112.727 -179.413 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' PRO . . . . . 0.47 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 45.6 Cg_endo -68.97 140.16 44.9 Favored 'Trans proline' 0 CA--C 1.528 0.177 0 C-N-CA 122.421 2.081 . . . . 20.0 112.528 179.277 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.9 ' HB2' HD12 ' A' ' 121' ' ' LEU . 70.1 mtp85 -142.11 134.22 27.54 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.406 -0.361 . . . . 20.0 110.659 179.34 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 22.3 t -85.02 135.46 34.01 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.791 0.329 . . . . 20.0 110.701 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' ARG . . . . . 0.491 ' NH1' ' O ' ' A' ' 65' ' ' THR . 66.8 ttt180 -143.53 140.9 30.49 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.158 0.429 . . . . 20.0 112.158 -179.082 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.413 ' HA ' ' O ' ' A' ' 117' ' ' GLN . 2.5 pttp -98.41 139.13 34.62 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.473 -0.566 . . . . 20.0 109.473 178.246 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.411 HG21 ' O ' ' A' ' 63' ' ' PHE . 13.1 m -145.33 128.57 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 CA-C-O 121.401 0.619 . . . . 20.0 111.364 -179.529 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.724 ' C ' HD23 ' A' ' 136' ' ' LEU . 55.9 mtm180 -81.59 122.15 27.23 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.939 -1.028 . . . . 20.0 110.007 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.724 HD23 ' C ' ' A' ' 135' ' ' ARG . 9.2 mt -117.5 126.19 52.17 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.878 0.37 . . . . 20.0 111.998 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 1.038 HG11 ' HB3' ' A' ' 111' ' ' PRO . 0.2 OUTLIER -71.33 89.48 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.403 -0.362 . . . . 20.0 111.909 179.692 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -78.44 -9.38 59.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.176 0.512 . . . . 20.0 109.809 178.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.3 p -158.35 120.0 3.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.575 -0.739 . . . . 20.0 110.353 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' CYS . . . . . 0.527 ' CB ' ' HA ' ' A' ' 111' ' ' PRO . 4.0 p -134.46 157.54 46.22 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.999 0.428 . . . . 20.0 111.746 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 42.6 mttt -125.43 146.69 49.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.716 -0.675 . . . . 20.0 110.046 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' CYS . . . . . 0.567 ' SG ' ' CD2' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -75.87 99.64 4.55 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.093 0.473 . . . . 20.0 110.462 179.995 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.521 ' O ' ' HB2' ' A' ' 144' ' ' ARG . 17.8 mmtm -138.04 158.83 43.52 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.68 -0.691 . . . . 20.0 111.027 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.521 ' HB2' ' O ' ' A' ' 143' ' ' LYS . 72.3 mtt180 . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.23 -0.89 . . . . 20.0 110.925 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 72.3 mttt . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.797 0.332 . . . . 20.0 111.301 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -85.9 17.24 3.56 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.371 -0.377 . . . . 20.0 111.258 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 78.1 t -66.09 -30.01 48.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.139 -0.482 . . . . 20.0 111.895 -179.657 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 37.8 p -82.11 -4.06 56.09 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.609 -0.268 . . . . 20.0 111.558 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -65.73 -37.0 85.17 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 111.728 0.269 . . . . 20.0 111.728 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.59 ' CD1' ' SG ' ' A' ' 142' ' ' CYS . 0.0 OUTLIER -104.27 -68.67 0.84 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.223 0.535 . . . . 20.0 110.826 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.48 ' HB2' ' HA3' ' A' ' 82' ' ' GLY . 0.1 OUTLIER -139.93 -155.91 0.63 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.391 -0.822 . . . . 20.0 110.588 -179.253 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.403 ' SG ' ' C ' ' A' ' 54' ' ' SER . 0.0 OUTLIER 48.57 93.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.22 -0.445 . . . . 20.0 109.831 179.751 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.574 ' HB2' HD22 ' A' ' 58' ' ' LEU . 3.5 mtt180 -120.64 -157.06 0.7 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.272 -0.422 . . . . 20.0 111.463 -178.66 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -89.64 5.23 46.68 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.868 -0.606 . . . . 20.0 111.563 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.661 ' CG ' HG22 ' A' ' 79' ' ' VAL . 0.9 OUTLIER -81.49 123.83 28.95 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.031 0.443 . . . . 20.0 110.34 179.985 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.611 ' CD2' ' HG ' ' A' ' 78' ' ' LEU . 56.1 m80 -117.91 160.12 21.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.064 -0.516 . . . . 20.0 111.631 -178.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.613 ' CE1' HG11 ' A' ' 79' ' ' VAL . 13.3 m-30 -120.22 154.92 34.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.193 0.52 . . . . 20.0 111.519 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.406 ' O ' ' OG1' ' A' ' 61' ' ' THR . 0.2 OUTLIER -100.81 86.43 3.09 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.511 -0.768 . . . . 20.0 111.435 -179.298 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.99 ' O ' HG21 ' A' ' 75' ' ' VAL . 37.4 ttp180 -117.66 119.73 35.85 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.606 -0.887 . . . . 20.0 108.606 178.373 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.779 ' O ' HD23 ' A' ' 64' ' ' LEU . 0.1 OUTLIER -106.75 -80.03 0.57 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.851 0.685 . . . . 20.0 112.851 -177.755 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.862 HD21 ' HB ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -174.37 146.21 1.05 Allowed 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 120.692 -0.403 . . . . 20.0 112.035 -178.479 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 71.0 p -137.97 148.57 45.34 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.084 -0.507 . . . . 20.0 111.379 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.518 ' O ' ' C ' ' A' ' 67' ' ' GLY . 7.9 t0 -154.13 -167.5 2.66 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.108 -0.496 . . . . 20.0 109.835 179.051 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.835 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -32.56 149.17 0.01 OUTLIER Glycine 0 C--N 1.345 1.036 0 CA-C-O 118.171 -1.349 . . . . 20.0 110.197 179.093 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.503 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 77.6 Cg_exo -18.27 57.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 124.742 3.628 . . . . 20.0 114.949 -178.353 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.835 ' N ' ' O ' ' A' ' 67' ' ' GLY . 55.7 m -163.82 154.24 15.43 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 108.164 -1.05 . . . . 20.0 108.164 178.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.604 ' O ' HD12 ' A' ' 122' ' ' LEU . 74.1 mtt85 -151.84 144.3 24.14 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.61 0.596 . . . . 20.0 112.61 -179.409 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.621 ' CA ' ' HA ' ' A' ' 121' ' ' LEU . 0.3 OUTLIER -83.17 164.39 20.22 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.318 -0.856 . . . . 20.0 110.14 178.659 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -152.16 34.52 0.52 Allowed 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.309 0.855 . . . . 20.0 113.309 -179.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.719 ' HB2' HG11 ' A' ' 119' ' ' VAL . 21.8 mttm -82.35 148.55 59.52 Favored Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 109.193 -0.669 . . . . 20.0 109.193 178.723 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_endo -58.42 120.11 7.78 Favored 'Trans proline' 0 CA--C 1.525 0.072 0 C-N-CA 122.314 2.009 . . . . 20.0 112.871 -178.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.99 HG21 ' O ' ' A' ' 62' ' ' ARG . 16.4 m -133.99 143.74 37.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.672 -0.695 . . . . 20.0 110.813 179.531 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 73.4 m -125.29 129.56 50.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.955 0.407 . . . . 20.0 111.55 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.525 ' O ' ' HA ' ' A' ' 59' ' ' HIS . 15.0 pt-20 -144.23 154.92 43.6 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.91 -0.586 . . . . 20.0 109.633 178.466 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.611 ' HG ' ' CD2' ' A' ' 59' ' ' HIS . 6.4 mp -88.18 148.38 24.43 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.377 0.608 . . . . 20.0 112.095 -179.425 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.668 ' O ' ' CG2' ' A' ' 79' ' ' VAL . 0.8 OUTLIER -109.08 84.63 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.762 0 CA-C-N 114.909 -1.041 . . . . 20.0 109.119 179.082 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.455 ' HB3' ' SG ' ' A' ' 109' ' ' CYS . 0.0 OUTLIER -93.92 108.96 20.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.581 -0.736 . . . . 20.0 111.026 -178.729 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.466 ' C ' ' OG ' ' A' ' 54' ' ' SER . 29.2 t -147.45 98.05 2.94 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.917 -0.583 . . . . 20.0 110.695 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.48 ' HA3' ' HB2' ' A' ' 54' ' ' SER . . . -161.02 -153.44 7.0 Favored Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.696 -0.764 . . . . 20.0 112.68 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.535 ' HA ' ' HA ' ' A' ' 108' ' ' ARG . 97.5 mt-30 -122.44 147.22 46.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.892 0.377 . . . . 20.0 111.033 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.461 ' O ' ' HB3' ' A' ' 107' ' ' PHE . 84.6 m -118.63 154.84 32.0 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.149 -0.478 . . . . 20.0 110.704 179.63 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLY . . . . . 0.441 ' O ' ' O ' ' A' ' 84' ' ' CYS . . . 51.78 173.76 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.366 -0.921 . . . . 20.0 111.554 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -52.99 140.07 59.86 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.194 1.929 . . . . 20.0 111.431 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -77.53 0.55 22.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.417 -0.356 . . . . 20.0 111.581 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.648 ' C ' HD13 ' A' ' 89' ' ' LEU . 19.7 mmm180 -70.15 138.29 51.74 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.962 0.41 . . . . 20.0 110.26 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.648 HD13 ' C ' ' A' ' 88' ' ' ARG . 0.3 OUTLIER -108.93 119.03 38.36 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.88 -0.6 . . . . 20.0 111.401 -179.177 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 10.8 mt -107.2 121.35 44.88 Favored Pre-proline 0 N--CA 1.462 0.15 0 CA-C-O 120.849 0.357 . . . . 20.0 111.258 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.566 ' HG2' ' NE1' ' A' ' 100' ' ' TRP . 58.0 Cg_endo -70.35 96.39 0.64 Allowed 'Trans proline' 0 CA--C 1.532 0.415 0 C-N-CA 122.784 2.322 . . . . 20.0 111.603 179.218 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -158.6 78.1 0.78 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 120.991 0.424 . . . . 20.0 110.74 -179.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.5 ' HB3' ' CZ3' ' A' ' 99' ' ' TRP . . . -66.67 -46.83 74.4 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.901 -0.59 . . . . 20.0 112.515 -179.161 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.48 HD12 ' CZ2' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -138.15 -16.73 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 N-CA-C 113.253 0.834 . . . . 20.0 113.253 -178.452 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 126.58 -30.68 4.17 Favored Glycine 0 N--CA 1.453 -0.191 0 C-N-CA 120.592 -0.813 . . . . 20.0 112.039 -178.756 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.591 ' O ' ' CZ3' ' A' ' 100' ' ' TRP . 73.0 mtt180 -67.17 -161.59 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.208 -0.664 . . . . 20.0 109.208 178.493 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 1.005 ' O ' ' CD1' ' A' ' 99' ' ' TRP . 2.1 t -146.52 -138.74 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.198 -1.637 0 CA-C-N 117.73 0.241 . . . . 20.0 111.525 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.569 ' CG ' ' O ' ' A' ' 97' ' ' VAL . 1.4 ptpt 42.51 18.41 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 113.851 1.056 . . . . 20.0 113.851 179.097 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 1.005 ' CD1' ' O ' ' A' ' 97' ' ' VAL . 18.7 p-90 -157.0 14.68 0.27 Allowed 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 109.959 -0.385 . . . . 20.0 109.959 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' TRP . . . . . 0.745 ' HA ' ' CE3' ' A' ' 100' ' ' TRP . 0.0 OUTLIER -33.09 138.79 0.06 Allowed 'General case' 0 CA--C 1.493 -1.222 0 CA-C-O 122.702 1.239 . . . . 20.0 114.038 -177.552 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.474 ' CZ ' ' CB ' ' A' ' 93' ' ' ALA . 1.6 mpp_? -127.45 82.98 67.24 Favored Pre-proline 0 N--CA 1.431 -1.387 0 CA-C-N 112.572 -2.104 . . . . 20.0 109.289 179.222 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -57.08 -10.21 5.62 Favored 'Trans proline' 0 N--CA 1.464 -0.226 0 C-N-CA 123.202 2.601 . . . . 20.0 112.611 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -57.35 -35.74 70.32 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.98 0.419 . . . . 20.0 110.005 179.154 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.447 ' HA3' ' HB3' ' A' ' 89' ' ' LEU . . . 64.22 173.67 3.23 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.907 -0.664 . . . . 20.0 112.825 179.37 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -73.48 135.74 22.67 Favored 'Trans proline' 0 N--CA 1.464 -0.25 0 C-N-CA 122.794 2.33 . . . . 20.0 111.857 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -80.16 138.52 36.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.833 0.349 . . . . 20.0 111.102 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.461 ' HB3' ' O ' ' A' ' 84' ' ' CYS . 94.2 m-85 -120.83 147.09 45.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 20.0 110.746 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.535 ' HA ' ' HA ' ' A' ' 83' ' ' GLN . 35.2 ptt180 -178.42 163.22 1.56 Allowed 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.266 -0.425 . . . . 20.0 110.981 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.54 ' HA ' ' HA ' ' A' ' 142' ' ' CYS . 42.5 t -80.88 129.41 34.52 Favored 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 109.266 -0.642 . . . . 20.0 109.266 179.174 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.558 HG21 ' HD2' ' A' ' 144' ' ' ARG . 5.6 tt -123.09 140.45 33.6 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-O 120.837 0.351 . . . . 20.0 111.54 -179.178 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.994 ' HB3' HG11 ' A' ' 137' ' ' VAL . 17.9 Cg_endo -56.2 152.58 37.51 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.394 2.063 . . . . 20.0 110.948 178.772 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 48.8 t0 -120.21 -61.26 1.61 Allowed 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.798 -0.361 . . . . 20.0 111.468 -179.177 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.477 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 57.9 ttp180 -127.22 146.12 50.53 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.881 0.372 . . . . 20.0 111.393 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 1.166 ' CE2' HG13 ' A' ' 137' ' ' VAL . 2.9 m-85 -120.89 154.68 35.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.842 -0.617 . . . . 20.0 111.562 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.63 ' HB2' ' HB2' ' A' ' 138' ' ' ALA . 58.9 ttm-85 -92.13 147.44 22.93 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 108.646 -0.872 . . . . 20.0 108.646 178.338 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -82.41 123.0 28.73 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 120.814 -0.355 . . . . 20.0 111.206 -179.132 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.586 ' HG2' HD23 ' A' ' 136' ' ' LEU . 24.6 mm100 -126.4 125.44 42.19 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 116.308 -0.405 . . . . 20.0 110.352 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 67.2 ttp85 -124.34 100.17 6.56 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.248 0.547 . . . . 20.0 110.553 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.862 ' HB ' HD21 ' A' ' 64' ' ' LEU . 86.2 t -125.1 147.66 29.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.372 -0.831 . . . . 20.0 111.093 -179.481 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.586 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 10.8 pt20 -92.12 133.87 35.37 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.858 -0.423 . . . . 20.0 109.858 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.902 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -78.24 135.16 37.52 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.25 0.547 . . . . 20.0 111.759 -178.82 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.604 HD12 ' O ' ' A' ' 70' ' ' ARG . 0.3 OUTLIER -82.39 146.84 29.12 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.248 -0.887 . . . . 20.0 110.282 179.801 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 123' ' ' CYS . . . . . 0.573 ' HB2' ' O ' ' A' ' 126' ' ' GLY . 3.5 m -106.64 104.91 53.09 Favored Pre-proline 0 N--CA 1.45 -0.428 0 CA-C-O 120.975 0.417 . . . . 20.0 110.768 -178.483 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.547 ' CD ' ' HA ' ' A' ' 69' ' ' CYS . 23.4 Cg_exo -60.06 104.41 0.24 Allowed 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.45 2.1 . . . . 20.0 111.913 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 84.69 21.08 56.98 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.645 -0.788 . . . . 20.0 111.955 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' GLY . . . . . 0.573 ' O ' ' HB2' ' A' ' 123' ' ' CYS . . . -159.07 127.85 1.92 Allowed Glycine 0 N--CA 1.442 -0.915 0 N-CA-C 111.051 -0.82 . . . . 20.0 111.051 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -85.9 46.42 1.32 Allowed 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 111.872 0.323 . . . . 20.0 111.872 -178.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ALA . . . . . 0.426 ' O ' ' SG ' ' A' ' 123' ' ' CYS . . . -120.85 63.89 11.54 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 121.117 0.484 . . . . 20.0 110.624 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -57.93 151.01 60.13 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.98 2.453 . . . . 20.0 112.015 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.902 ' HB2' HD12 ' A' ' 121' ' ' LEU . 73.8 mtp85 -124.12 154.75 39.55 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 116.3 -0.409 . . . . 20.0 110.915 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.445 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 47.0 t -106.2 133.12 51.4 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.786 0.327 . . . . 20.0 111.789 -179.357 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 58.0 ttt85 -147.8 138.3 23.08 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 112.223 0.453 . . . . 20.0 112.223 179.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 12.5 pttp -94.45 146.84 23.8 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.08 -0.509 . . . . 20.0 109.706 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.603 HG21 ' O ' ' A' ' 63' ' ' PHE . 4.9 t -147.28 127.84 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.71 0 CA-C-O 121.485 0.659 . . . . 20.0 111.95 -179.206 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.777 ' C ' HD22 ' A' ' 136' ' ' LEU . 31.4 ptt180 -93.13 121.2 34.24 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.87 -1.059 . . . . 20.0 109.966 179.193 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.777 HD22 ' C ' ' A' ' 135' ' ' ARG . 0.7 OUTLIER -114.45 126.55 55.09 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.395 0.517 . . . . 20.0 112.395 -178.497 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 1.166 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -53.43 84.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.551 -0.295 . . . . 20.0 111.713 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.63 ' HB2' ' HB2' ' A' ' 115' ' ' ARG . . . -64.72 -20.32 66.26 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.303 0.573 . . . . 20.0 110.152 179.28 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 36.1 t -160.45 127.97 4.45 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.404 -0.816 . . . . 20.0 110.483 179.508 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' CYS . . . . . 0.517 ' HB2' ' HA ' ' A' ' 111' ' ' PRO . 27.9 p -134.66 156.22 49.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.833 0.349 . . . . 20.0 110.575 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -129.95 154.94 46.85 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.211 -0.449 . . . . 20.0 110.387 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 142' ' ' CYS . . . . . 0.59 ' SG ' ' CD1' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -83.84 99.69 10.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.254 0.549 . . . . 20.0 111.148 -179.131 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.566 ' O ' ' HB2' ' A' ' 144' ' ' ARG . 8.4 tptt -137.29 145.8 43.91 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.468 -0.787 . . . . 20.0 109.938 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.566 ' HB2' ' O ' ' A' ' 143' ' ' LYS . 83.9 mtt-85 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.311 -0.852 . . . . 20.0 110.88 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.2 mttt . . . . . 0 N--CA 1.485 1.297 0 CA-C-O 120.801 0.334 . . . . 20.0 110.799 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -85.9 17.51 3.43 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.208 -0.451 . . . . 20.0 111.465 -179.057 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 43.4 t -70.3 -26.69 29.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.265 -0.425 . . . . 20.0 111.022 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 96.8 p -80.7 -8.99 59.82 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.231 -0.44 . . . . 20.0 110.987 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 62.0 mm-40 -64.58 -31.45 72.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.256 -0.429 . . . . 20.0 111.517 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.604 ' CZ ' ' O ' ' A' ' 140' ' ' CYS . 21.1 p90 -108.96 -11.81 14.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.778 0.323 . . . . 20.0 111.174 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 44.7 m -72.97 150.63 42.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.131 0.491 . . . . 20.0 111.338 -179.017 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.462 ' CB ' ' HA3' ' A' ' 82' ' ' GLY . 0.0 OUTLIER -99.94 -29.23 12.68 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.628 -0.715 . . . . 20.0 109.14 179.03 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.539 ' HD2' ' N ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -155.21 160.21 40.69 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.16 -0.927 . . . . 20.0 110.179 179.76 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -70.62 98.02 1.43 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.602 -0.518 . . . . 20.0 109.602 179.233 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.887 ' O ' HD12 ' A' ' 58' ' ' LEU . 4.6 pp -109.0 127.1 53.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.428 0.632 . . . . 20.0 112.654 -178.721 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -163.58 100.44 0.92 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.89 -1.05 . . . . 20.0 109.014 178.119 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 1.033 ' CE1' HG13 ' A' ' 79' ' ' VAL . 5.7 p90 -126.64 157.69 38.31 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.948 0.404 . . . . 20.0 111.711 -177.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.0 p -105.1 95.11 5.62 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.941 -0.572 . . . . 20.0 111.981 -179.101 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.733 ' O ' HG21 ' A' ' 75' ' ' VAL . 55.0 ttm-85 -116.98 125.11 50.9 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.263 -1.014 . . . . 20.0 108.263 177.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.712 ' C ' HD23 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -116.9 -79.81 0.59 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 113.442 0.904 . . . . 20.0 113.442 -177.13 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.914 HD21 ' HB ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -171.21 141.15 1.57 Allowed 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.443 -0.503 . . . . 20.0 112.293 -177.269 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.783 HG22 ' HG3' ' A' ' 70' ' ' ARG . 30.6 p -134.42 133.59 40.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.483 . . . . 20.0 110.395 178.248 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.507 ' O ' ' C ' ' A' ' 67' ' ' GLY . 15.0 t0 -148.86 -162.31 1.53 Allowed 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.365 -0.379 . . . . 20.0 110.056 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.841 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -31.2 148.25 0.01 OUTLIER Glycine 0 C--N 1.344 1.015 0 CA-C-O 118.343 -1.254 . . . . 20.0 110.485 179.563 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.488 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 19.5 Cg_exo -16.51 60.21 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 124.75 3.633 . . . . 20.0 113.993 -178.818 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.841 ' N ' ' O ' ' A' ' 67' ' ' GLY . 59.9 m -163.14 150.77 13.25 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 114.923 -1.035 . . . . 20.0 109.251 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.783 ' HG3' HG22 ' A' ' 65' ' ' THR . 57.3 ttt180 -145.68 124.55 12.69 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.84 0.352 . . . . 20.0 110.672 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.626 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -74.71 156.59 36.47 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 116.109 -0.496 . . . . 20.0 110.324 179.669 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -150.45 31.94 0.65 Allowed 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 113.305 0.854 . . . . 20.0 113.305 -179.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.655 ' O ' HG13 ' A' ' 75' ' ' VAL . 6.8 ttmt -75.24 144.97 79.46 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.985 -0.376 . . . . 20.0 109.985 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.459 ' HD2' ' CG ' ' A' ' 73' ' ' LYS . 50.2 Cg_exo -53.11 113.1 1.12 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.169 1.913 . . . . 20.0 112.002 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.733 HG21 ' O ' ' A' ' 62' ' ' ARG . 24.1 m -132.13 149.4 32.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.971 -0.559 . . . . 20.0 111.567 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 6.1 m -115.01 118.13 32.55 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.568 -0.53 . . . . 20.0 109.568 178.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.662 ' CD ' HD12 ' A' ' 136' ' ' LEU . 44.1 mm-40 -125.04 151.12 46.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.521 -0.308 . . . . 20.0 110.769 -179.528 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.683 ' HA ' HD13 ' A' ' 58' ' ' LEU . 6.0 mp -119.34 125.55 49.3 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 113.054 0.761 . . . . 20.0 113.054 -179.014 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 1.033 HG13 ' CE1' ' A' ' 60' ' ' TYR . 2.5 m -109.8 76.61 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-N 114.473 -1.24 . . . . 20.0 109.698 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.461 ' N ' HD22 ' A' ' 58' ' ' LEU . 1.0 OUTLIER -86.52 109.22 18.95 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.96 -0.564 . . . . 20.0 111.923 -178.794 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 30.1 t -148.32 103.62 3.45 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.799 -0.637 . . . . 20.0 110.507 179.121 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.499 ' O ' ' HB2' ' A' ' 108' ' ' ARG . . . -165.69 -160.87 13.56 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.516 -0.85 . . . . 20.0 112.838 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.52 ' HA ' ' HA ' ' A' ' 108' ' ' ARG . 94.9 mt-30 -114.92 140.34 49.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.693 0.282 . . . . 20.0 110.339 179.454 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.46 ' HB3' ' HD3' ' A' ' 86' ' ' PRO . 0.9 OUTLIER -109.14 152.61 24.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.393 -0.367 . . . . 20.0 110.455 179.703 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -129.79 61.2 0.66 Allowed Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.302 -0.951 . . . . 20.0 112.998 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' PRO . . . . . 0.46 ' HD3' ' HB3' ' A' ' 84' ' ' CYS . 21.6 Cg_endo -61.44 149.2 90.63 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.801 2.334 . . . . 20.0 111.988 179.545 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.477 ' O ' HD22 ' A' ' 89' ' ' LEU . . . -82.0 -3.11 53.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.27 -0.423 . . . . 20.0 111.607 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 54.0 mmm-85 -95.95 86.78 4.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.905 0.383 . . . . 20.0 110.359 179.35 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.562 HD22 ' N ' ' A' ' 89' ' ' LEU . 0.5 OUTLIER -96.87 124.48 40.86 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.014 -0.539 . . . . 20.0 110.407 -179.804 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.451 ' HA ' HD12 ' A' ' 90' ' ' LEU . 3.9 tp -110.96 112.0 55.95 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.269 -0.423 . . . . 20.0 111.705 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.608 ' HG2' ' CD1' ' A' ' 100' ' ' TRP . 3.0 Cg_exo -71.56 124.03 9.96 Favored 'Trans proline' 0 N--CA 1.464 -0.262 0 C-N-CA 122.963 2.442 . . . . 20.0 111.038 178.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -103.25 142.06 34.82 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.912 0.386 . . . . 20.0 111.416 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.733 ' HB2' ' CH2' ' A' ' 100' ' ' TRP . . . -83.71 -10.42 58.16 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.552 0.575 . . . . 20.0 112.552 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.934 HD12 ' CH2' ' A' ' 99' ' ' TRP . 1.0 OUTLIER 31.8 34.15 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.436 0.636 . . . . 20.0 111.513 179.583 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLY . . . . . 0.543 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 116.23 -52.76 0.65 Allowed Glycine 0 CA--C 1.521 0.424 0 CA-C-N 114.921 -1.036 . . . . 20.0 112.499 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.731 ' O ' ' HB1' ' A' ' 93' ' ' ALA . 83.6 mtt85 -108.97 169.53 8.62 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.12 -0.326 . . . . 20.0 110.12 179.225 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 1.096 HG13 ' CZ3' ' A' ' 100' ' ' TRP . 2.3 t -126.46 -134.28 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.199 -1.575 0 N-CA-C 112.818 0.673 . . . . 20.0 112.818 -179.616 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.62 ' CG ' ' O ' ' A' ' 97' ' ' VAL . 0.1 OUTLIER 54.71 -55.45 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 112.84 0.681 . . . . 20.0 112.84 -178.688 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.934 ' CH2' HD12 ' A' ' 94' ' ' ILE . 24.9 p-90 -75.44 45.69 0.31 Allowed 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 122.812 0.445 . . . . 20.0 110.6 179.014 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' TRP . . . . . 1.096 ' CZ3' HG13 ' A' ' 97' ' ' VAL . 0.0 OUTLIER -48.53 136.75 12.58 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-O 121.887 0.851 . . . . 20.0 112.943 -177.855 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.403 ' O ' ' HA ' ' A' ' 91' ' ' PRO . 0.0 OUTLIER -113.63 84.06 7.77 Favored Pre-proline 0 N--CA 1.438 -1.064 0 CA-C-N 113.96 -1.473 . . . . 20.0 110.948 -179.653 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.535 ' O ' ' CB ' ' A' ' 89' ' ' LEU . 44.7 Cg_endo -67.98 -1.93 7.85 Favored 'Trans proline' 0 C--N 1.34 0.125 0 C-N-CA 123.28 2.653 . . . . 20.0 112.326 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -59.18 -28.8 66.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.888 0.375 . . . . 20.0 110.727 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 84.19 159.45 29.48 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.701 -0.761 . . . . 20.0 112.677 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -67.78 160.23 49.23 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.937 2.424 . . . . 20.0 112.12 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -67.34 137.42 56.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.229 -0.442 . . . . 20.0 110.81 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.432 ' HB3' ' HB2' ' A' ' 84' ' ' CYS . 97.4 m-85 -120.54 160.82 22.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.127 -0.488 . . . . 20.0 110.942 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.52 ' HA ' ' HA ' ' A' ' 83' ' ' GLN . 39.7 ptt180 -172.56 161.18 4.91 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.013 0.435 . . . . 20.0 111.605 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 142' ' ' CYS . 3.9 m -77.97 120.59 23.03 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.727 -0.669 . . . . 20.0 110.048 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.468 HG22 ' O ' ' A' ' 143' ' ' LYS . 2.9 tt -137.46 126.57 15.03 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.063 0.459 . . . . 20.0 111.571 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 1.041 ' HB3' HG11 ' A' ' 137' ' ' VAL . 51.6 Cg_exo -54.29 157.11 12.04 Favored 'Trans proline' 0 C--O 1.231 0.139 0 C-N-CA 123.079 2.519 . . . . 20.0 111.967 179.624 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -131.02 -63.66 0.85 Allowed 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 112.69 0.626 . . . . 20.0 112.69 -179.057 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.475 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 39.2 ttm180 -119.31 151.0 39.18 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.732 0.301 . . . . 20.0 111.72 -178.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.836 ' CE2' HG13 ' A' ' 137' ' ' VAL . 4.4 m-85 -122.71 141.99 51.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.942 -0.572 . . . . 20.0 111.539 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.598 ' HB3' ' HB2' ' A' ' 138' ' ' ALA . 30.7 ttp180 -93.15 143.85 25.85 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 115.757 -0.656 . . . . 20.0 109.402 178.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -76.13 132.88 40.29 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.012 0.434 . . . . 20.0 111.198 -178.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.434 ' N ' ' O ' ' A' ' 134' ' ' VAL . 26.4 mm100 -125.31 137.39 54.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.829 -0.623 . . . . 20.0 110.723 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 70.6 ttt-85 -130.2 106.9 8.9 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.11 -0.495 . . . . 20.0 110.863 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.914 ' HB ' HD21 ' A' ' 64' ' ' LEU . 21.5 t -135.03 152.16 32.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.062 -0.517 . . . . 20.0 111.358 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.544 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 11.1 pt20 -92.24 130.27 37.98 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.512 -0.313 . . . . 20.0 110.406 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.619 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.2 OUTLIER -77.0 126.61 31.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.005 0.431 . . . . 20.0 110.8 -179.982 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.54 HD12 ' O ' ' A' ' 70' ' ' ARG . 0.3 OUTLIER -90.64 134.83 34.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.93 -0.577 . . . . 20.0 111.419 -179.388 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 123' ' ' CYS . . . . . 0.501 ' HB3' ' HD2' ' A' ' 124' ' ' PRO . 0.0 OUTLIER -109.87 166.0 11.6 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-N 115.849 -0.614 . . . . 20.0 109.981 179.367 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.501 ' HD2' ' HB3' ' A' ' 123' ' ' CYS . 11.8 Cg_endo -56.3 109.45 0.44 Allowed 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 122.012 1.808 . . . . 20.0 111.674 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 96.95 -9.73 65.83 Favored Glycine 0 CA--C 1.517 0.21 0 C-N-CA 120.914 -0.66 . . . . 20.0 112.512 -179.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 57.23 56.93 22.41 Favored Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.733 -0.746 . . . . 20.0 112.235 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.416 ' O ' ' HD2' ' A' ' 129' ' ' PRO . . . -92.69 -62.47 1.39 Allowed 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 111.896 0.332 . . . . 20.0 111.896 -179.358 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -116.61 62.48 2.62 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 112.232 0.456 . . . . 20.0 112.232 -179.02 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' PRO . . . . . 0.416 ' HD2' ' O ' ' A' ' 127' ' ' ALA . 9.7 Cg_endo -49.91 146.7 16.01 Favored 'Trans proline' 0 N--CA 1.463 -0.295 0 C-N-CA 122.511 2.14 . . . . 20.0 110.898 178.612 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.551 ' HB2' HD12 ' A' ' 121' ' ' LEU . 14.6 mtp-105 -127.84 154.3 45.62 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 121.01 -0.276 . . . . 20.0 111.467 -179.056 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 99.7 p -105.18 139.85 39.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.326 -0.397 . . . . 20.0 111.303 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 53.9 ttt85 -145.51 138.9 26.41 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.085 0.469 . . . . 20.0 112.045 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -91.38 141.93 28.23 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.696 -0.684 . . . . 20.0 109.404 178.459 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.456 HG21 ' HB3' ' A' ' 64' ' ' LEU . 2.8 t -145.47 125.72 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 CA-C-O 121.318 0.58 . . . . 20.0 111.812 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.64 ' O ' HD23 ' A' ' 136' ' ' LEU . 49.5 ptt85 -99.21 113.82 26.29 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.155 -0.929 . . . . 20.0 110.175 179.015 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.662 HD12 ' CD ' ' A' ' 77' ' ' GLU . 32.5 mt -127.61 148.99 50.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.067 0.46 . . . . 20.0 111.311 -179.801 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 1.041 HG11 ' HB3' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -57.55 92.75 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.728 -0.669 . . . . 20.0 112.397 -179.451 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.598 ' HB2' ' HB3' ' A' ' 115' ' ' ARG . . . -73.94 -13.06 60.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.142 0.496 . . . . 20.0 109.825 178.462 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 96.3 p -167.92 137.84 2.65 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.697 -0.683 . . . . 20.0 110.089 179.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' CYS . . . . . 0.604 ' O ' ' CZ ' ' A' ' 53' ' ' TYR . 24.4 p -144.18 166.42 25.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.834 0.349 . . . . 20.0 111.214 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 30.7 mttt -129.69 137.2 50.48 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.042 -0.526 . . . . 20.0 109.675 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 142' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 109' ' ' CYS . 9.0 t -80.65 94.86 6.41 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.839 0.352 . . . . 20.0 110.233 -179.631 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.522 ' O ' ' HB2' ' A' ' 144' ' ' ARG . 34.4 tptt -136.48 155.66 49.68 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.988 -0.551 . . . . 20.0 110.656 -179.374 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.522 ' HB2' ' O ' ' A' ' 143' ' ' LYS . 76.6 mtt-85 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.286 -0.864 . . . . 20.0 110.908 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 83.4 mttt . . . . . 0 N--CA 1.483 1.193 0 CA-C-O 121.149 0.499 . . . . 20.0 111.125 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.439 ' HB3' ' HG3' ' A' ' 52' ' ' GLU . 94.1 m-20 -86.6 20.38 2.52 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.636 -0.711 . . . . 20.0 111.587 -179.507 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 79.0 t -63.64 -29.95 48.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 CA-C-N 116.377 -0.374 . . . . 20.0 111.448 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 82.6 p -83.33 4.03 29.04 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.422 -0.354 . . . . 20.0 111.36 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.439 ' HG3' ' HB3' ' A' ' 49' ' ' ASP . 77.3 mm-40 -75.56 -1.73 25.76 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.029 0.381 . . . . 20.0 112.029 -179.655 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 -89.06 9.05 26.75 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.94 0.348 . . . . 20.0 111.94 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.8 m -74.77 119.79 19.44 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 110.055 -0.35 . . . . 20.0 110.055 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.525 ' HB2' ' HD2' ' A' ' 56' ' ' ARG . 2.0 m -67.89 -33.62 75.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.227 -0.442 . . . . 20.0 110.075 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.561 ' O ' ' N ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -162.68 171.57 16.65 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.717 -0.674 . . . . 20.0 110.083 179.738 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -53.76 82.59 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.102 0.477 . . . . 20.0 109.759 179.026 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 1.012 HD22 ' N ' ' A' ' 59' ' ' HIS . 0.1 OUTLIER -115.51 124.94 52.35 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.565 -0.743 . . . . 20.0 112.361 -178.061 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 1.012 ' N ' HD22 ' A' ' 58' ' ' LEU . 0.9 OUTLIER -164.02 115.83 1.36 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.879 -0.601 . . . . 20.0 110.991 178.108 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.688 ' HE1' HD23 ' A' ' 58' ' ' LEU . 79.5 m-85 -119.83 159.32 24.82 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 112.432 0.53 . . . . 20.0 112.432 -178.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 42.5 p -123.62 83.85 2.19 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-N 115.705 -0.679 . . . . 20.0 110.442 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.689 ' O ' HG21 ' A' ' 75' ' ' VAL . 63.9 mtm180 -118.55 123.84 46.05 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 107.857 -1.164 . . . . 20.0 107.857 178.092 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.732 ' CD2' HG22 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -108.07 -78.71 0.58 Allowed 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.609 0.596 . . . . 20.0 112.609 -177.189 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.734 HD21 ' HB ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -169.09 138.43 2.12 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.539 -0.464 . . . . 20.0 112.133 -178.246 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.67 HG22 ' HG3' ' A' ' 70' ' ' ARG . 40.6 p -129.26 143.57 50.9 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.514 -0.55 . . . . 20.0 109.514 177.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.552 ' O ' ' C ' ' A' ' 67' ' ' GLY . 5.9 t0 -153.0 -162.69 1.54 Allowed 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.94 -0.393 . . . . 20.0 109.94 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.872 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -29.05 141.64 0.01 OUTLIER Glycine 0 C--N 1.345 1.039 0 CA-C-O 118.424 -1.209 . . . . 20.0 110.301 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.513 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 56.2 Cg_exo -15.77 55.02 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 125.287 3.991 . . . . 20.0 114.514 -178.414 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.872 ' N ' ' O ' ' A' ' 67' ' ' GLY . 19.6 m -162.81 167.34 23.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.005 -0.998 . . . . 20.0 108.537 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.67 ' HG3' HG22 ' A' ' 65' ' ' THR . 65.0 ttt180 -161.35 143.86 12.2 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.965 -0.294 . . . . 20.0 111.523 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.824 ' HA ' HD12 ' A' ' 122' ' ' LEU . 0.9 OUTLIER -83.86 171.17 13.34 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 116.442 -0.345 . . . . 20.0 110.253 178.996 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -152.29 25.54 0.61 Allowed 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 113.44 0.904 . . . . 20.0 113.44 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.579 ' HB2' HG11 ' A' ' 119' ' ' VAL . 0.2 OUTLIER -68.49 144.19 96.13 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 109.165 -0.679 . . . . 20.0 109.165 178.901 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.92 114.64 1.99 Allowed 'Trans proline' 0 CA--C 1.527 0.17 0 C-N-CA 122.411 2.074 . . . . 20.0 112.329 -179.168 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.732 HG22 ' CD2' ' A' ' 63' ' ' PHE . 16.1 m -130.85 155.36 41.84 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.167 0 CA-C-O 120.955 0.407 . . . . 20.0 111.518 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.521 HG22 HD11 ' A' ' 78' ' ' LEU . 70.4 m -116.36 123.93 48.82 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.99 -0.55 . . . . 20.0 110.601 179.015 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.602 ' OE1' HD13 ' A' ' 136' ' ' LEU . 52.6 tp10 -121.73 127.51 50.77 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.193 -0.458 . . . . 20.0 110.4 179.255 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.872 ' HA ' HD11 ' A' ' 58' ' ' LEU . 1.7 mp -112.91 122.89 48.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.413 0.625 . . . . 20.0 111.551 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.816 HG23 ' O ' ' A' ' 79' ' ' VAL . 1.5 m -108.89 76.81 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 122.065 0.936 . . . . 20.0 108.891 178.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.481 ' O ' ' HA ' ' A' ' 110' ' ' ILE . 1.3 p -83.48 112.73 20.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.153 -0.93 . . . . 20.0 111.518 -178.137 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.422 ' HA ' ' O ' ' A' ' 109' ' ' CYS . 65.6 p -146.21 96.85 2.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.764 -0.653 . . . . 20.0 110.479 179.294 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.521 ' CA ' ' SG ' ' A' ' 109' ' ' CYS . . . -158.85 -157.35 8.46 Favored Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 115.752 -0.658 . . . . 20.0 112.171 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.477 ' HA ' ' HA ' ' A' ' 108' ' ' ARG . 91.9 mt-30 -116.15 148.19 40.59 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.59 0.233 . . . . 20.0 110.459 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -128.96 157.88 40.4 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.766 0.317 . . . . 20.0 111.161 -179.772 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -128.99 68.01 0.55 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.654 -0.784 . . . . 20.0 112.679 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' PRO . . . . . 0.502 ' HG2' ' CE2' ' A' ' 107' ' ' PHE . 25.4 Cg_endo -60.25 148.49 89.73 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.925 2.416 . . . . 20.0 112.356 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -72.46 -1.93 17.64 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.404 -0.362 . . . . 20.0 111.41 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.565 ' C ' HD13 ' A' ' 89' ' ' LEU . 20.1 tpt180 -73.33 120.88 19.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.882 0.372 . . . . 20.0 110.316 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.605 ' N ' HD13 ' A' ' 89' ' ' LEU . 0.1 OUTLIER -101.99 111.46 23.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.144 -0.48 . . . . 20.0 111.312 -179.414 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.469 ' HA ' HD22 ' A' ' 90' ' ' LEU . 0.2 OUTLIER -123.85 88.6 52.15 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.013 0.435 . . . . 20.0 110.983 179.511 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.647 ' HB2' ' CD2' ' A' ' 100' ' ' TRP . 61.0 Cg_endo -71.32 96.87 0.74 Allowed 'Trans proline' 0 CA--C 1.53 0.301 0 C-N-CA 122.708 2.272 . . . . 20.0 111.439 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 33.2 p-10 -147.31 44.16 1.13 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.049 0.452 . . . . 20.0 111.096 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.963 ' HB3' ' CH2' ' A' ' 99' ' ' TRP . . . -60.56 -55.76 29.55 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.895 -0.593 . . . . 20.0 112.481 -179.177 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.408 HD12 ' CZ2' ' A' ' 99' ' ' TRP . 0.8 OUTLIER -122.04 -28.02 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 N-CA-C 112.403 0.52 . . . . 20.0 112.403 -179.054 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 124.67 -43.67 1.36 Allowed Glycine 0 C--N 1.328 0.086 0 C-N-CA 120.696 -0.764 . . . . 20.0 111.796 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.518 ' O ' ' NE1' ' A' ' 99' ' ' TRP . 90.8 mtt180 -66.79 148.63 51.67 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 108.94 -0.763 . . . . 20.0 108.94 178.224 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.993 HG13 ' CD2' ' A' ' 100' ' ' TRP . 1.9 t -122.42 132.41 71.19 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.074 0 CA-C-O 122.279 1.038 . . . . 20.0 112.501 -179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.432 ' HG2' ' C ' ' A' ' 97' ' ' VAL . 0.8 OUTLIER 165.66 -36.57 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 113.159 -1.837 . . . . 20.0 107.136 -179.306 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.963 ' CH2' ' HB3' ' A' ' 93' ' ' ALA . 60.6 p-90 -98.19 8.45 44.78 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 112.668 -2.06 . . . . 20.0 110.129 178.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' TRP . . . . . 0.993 ' CD2' HG13 ' A' ' 97' ' ' VAL . 0.0 OUTLIER -22.97 137.77 0.01 OUTLIER 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 114.753 1.39 . . . . 20.0 114.753 -176.392 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.432 ' HD2' ' CE3' ' A' ' 99' ' ' TRP . 5.6 mtt85 -130.23 86.95 52.45 Favored Pre-proline 0 N--CA 1.444 -0.765 0 CA-C-N 113.354 -1.748 . . . . 20.0 111.552 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.422 ' HD2' ' HA ' ' A' ' 101' ' ' ARG . 33.5 Cg_endo -64.57 -0.75 3.26 Favored 'Trans proline' 0 CA--C 1.53 0.293 0 C-N-CA 123.581 2.854 . . . . 20.0 113.681 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 58.3 t-20 -56.35 -32.5 64.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.027 0.442 . . . . 20.0 110.375 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 85.27 161.44 34.35 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.827 -0.702 . . . . 20.0 112.472 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -66.39 167.5 18.52 Favored 'Trans proline' 0 N--CA 1.464 -0.263 0 C-N-CA 122.739 2.293 . . . . 20.0 112.209 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 57.7 t0 -75.09 123.12 24.64 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.985 -0.552 . . . . 20.0 110.262 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.502 ' CE2' ' HG2' ' A' ' 86' ' ' PRO . 96.4 m-85 -107.68 136.29 47.68 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.854 0.359 . . . . 20.0 111.355 -179.122 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.477 ' HA ' ' HA ' ' A' ' 83' ' ' GLN . 78.8 mtp180 -119.03 150.29 40.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.041 -0.527 . . . . 20.0 110.606 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.716 ' HA ' ' HA ' ' A' ' 142' ' ' CYS . 0.9 OUTLIER -90.67 103.27 15.98 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 120.319 -0.552 . . . . 20.0 110.893 179.231 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.793 HD12 ' O ' ' A' ' 111' ' ' PRO . 0.9 OUTLIER -126.07 155.74 72.99 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.809 -0.632 . . . . 20.0 110.633 179.419 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.888 ' CB ' HG11 ' A' ' 137' ' ' VAL . 19.0 Cg_endo -59.89 147.17 93.67 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.913 2.409 . . . . 20.0 112.438 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -130.75 -46.36 1.05 Allowed 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 111.957 0.354 . . . . 20.0 111.957 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.558 ' O ' HG12 ' A' ' 137' ' ' VAL . 40.9 ttm180 -124.61 151.8 44.37 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.968 0.358 . . . . 20.0 111.968 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.906 ' CZ ' HG13 ' A' ' 137' ' ' VAL . 0.9 OUTLIER -130.11 152.92 49.03 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.609 -0.723 . . . . 20.0 111.724 -179.693 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.585 ' O ' ' HA ' ' A' ' 135' ' ' ARG . 18.3 ttm-85 -93.98 137.61 33.0 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 115.868 -0.605 . . . . 20.0 109.7 178.625 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -82.1 120.86 25.84 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.756 0.312 . . . . 20.0 110.847 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.491 ' CG ' ' O ' ' A' ' 134' ' ' VAL . 4.5 pt20 -133.55 139.55 46.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.98 0.419 . . . . 20.0 111.269 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.411 ' HG2' ' CB ' ' A' ' 133' ' ' LYS . 71.7 mtp85 -123.14 108.81 13.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.926 -0.579 . . . . 20.0 110.841 179.374 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.734 ' HB ' HD21 ' A' ' 64' ' ' LEU . 74.8 t -120.36 145.06 27.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.786 -0.643 . . . . 20.0 110.773 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.565 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 26.9 mp0 -88.0 127.82 35.39 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.208 -0.451 . . . . 20.0 110.445 -179.748 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.78 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.2 OUTLIER -76.68 126.99 31.94 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.393 0.616 . . . . 20.0 111.589 -178.61 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.824 HD12 ' HA ' ' A' ' 71' ' ' SER . 3.1 mp -89.38 141.99 28.06 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.083 -0.962 . . . . 20.0 111.713 -179.149 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' CYS . . . . . 0.513 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.2 OUTLIER -118.06 153.81 51.37 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 115.563 -0.744 . . . . 20.0 109.248 178.271 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.494 ' HD2' ' SG ' ' A' ' 123' ' ' CYS . 88.9 Cg_exo -47.75 112.31 0.54 Allowed 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.046 1.831 . . . . 20.0 111.928 -179.442 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.429 ' O ' ' C ' ' A' ' 126' ' ' GLY . . . 91.85 6.31 65.54 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.552 -0.833 . . . . 20.0 112.268 -179.666 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' GLY . . . . . 0.429 ' C ' ' O ' ' A' ' 125' ' ' GLY . . . 34.23 73.13 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 121.041 -0.6 . . . . 20.0 112.858 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -111.2 -51.73 2.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.559 0.219 . . . . 20.0 111.567 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -121.52 60.77 10.88 Favored Pre-proline 0 C--N 1.332 -0.18 0 CA-C-O 120.944 0.402 . . . . 20.0 111.895 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -48.57 152.6 3.98 Favored 'Trans proline' 0 CA--C 1.528 0.213 0 C-N-CA 123.48 2.787 . . . . 20.0 112.483 179.325 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.78 ' HB2' HD12 ' A' ' 121' ' ' LEU . 80.5 mtt-85 -125.43 158.58 34.03 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.352 -0.385 . . . . 20.0 111.088 -179.249 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 9.7 t -114.66 136.67 52.79 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.511 -0.313 . . . . 20.0 110.742 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' ARG . . . . . 0.426 ' HD3' ' HB2' ' A' ' 64' ' ' LEU . 52.9 ttt85 -148.74 136.05 20.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.848 0.356 . . . . 20.0 111.793 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.411 ' CB ' ' HG2' ' A' ' 118' ' ' ARG . 25.1 pttm -96.45 140.53 30.96 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.69 -0.485 . . . . 20.0 109.69 178.688 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.491 ' O ' ' CG ' ' A' ' 117' ' ' GLN . 7.8 t -145.44 125.96 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 CA-C-O 121.198 0.523 . . . . 20.0 111.779 -178.802 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.598 ' HG2' ' HB2' ' A' ' 114' ' ' TYR . 39.1 ttt180 -99.03 111.9 24.17 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.561 -0.745 . . . . 20.0 109.43 178.325 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.602 HD13 ' OE1' ' A' ' 77' ' ' GLU . 22.0 mt -113.31 140.04 48.34 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.749 0.648 . . . . 20.0 112.749 -178.426 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.906 HG13 ' CZ ' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -58.93 84.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 CA-C-N 116.219 -0.446 . . . . 20.0 111.455 179.43 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.418 ' HB1' HH21 ' A' ' 115' ' ' ARG . . . -74.14 -12.06 60.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.94 0.4 . . . . 20.0 110.43 179.34 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.5 t -164.98 124.86 1.88 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.89 -0.595 . . . . 20.0 110.358 179.231 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' CYS . . . . . 0.593 ' CB ' ' HA ' ' A' ' 111' ' ' PRO . 23.1 p -125.46 159.41 32.01 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 121.103 0.477 . . . . 20.0 112.023 -179.404 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 22.2 mttm -115.58 145.82 42.32 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 115.705 -0.68 . . . . 20.0 109.391 178.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 142' ' ' CYS . . . . . 0.716 ' HA ' ' HA ' ' A' ' 109' ' ' CYS . 18.4 p -86.57 99.78 11.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.056 0.455 . . . . 20.0 110.773 -179.549 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.555 ' O ' ' HB2' ' A' ' 144' ' ' ARG . 7.8 tptt -146.0 146.75 31.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.856 -0.611 . . . . 20.0 111.043 -179.39 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.555 ' HB2' ' O ' ' A' ' 143' ' ' LYS . 49.7 mtp85 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.319 -0.848 . . . . 20.0 110.83 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 54.7 mttp . . . . . 0 N--CA 1.489 1.493 0 CA-C-O 121.015 0.436 . . . . 20.0 111.374 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -82.23 14.5 2.88 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.789 -0.641 . . . . 20.0 111.691 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.415 ' O ' ' O ' ' A' ' 54' ' ' SER . 61.8 t -66.16 -34.57 71.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 112.149 0.425 . . . . 20.0 112.149 -179.503 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 53.5 m -82.19 0.23 41.99 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.916 0.339 . . . . 20.0 111.916 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 90.7 mt-10 -67.22 -37.39 83.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.789 0.328 . . . . 20.0 111.045 179.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.556 ' CD1' ' SG ' ' A' ' 142' ' ' CYS . 0.0 OUTLIER -101.66 -72.39 0.68 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.588 -0.523 . . . . 20.0 109.588 178.983 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.551 ' HB2' ' HA3' ' A' ' 82' ' ' GLY . 0.5 OUTLIER -145.24 -159.84 1.06 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.927 -0.579 . . . . 20.0 109.974 178.664 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.458 ' SG ' ' C ' ' A' ' 54' ' ' SER . 0.0 OUTLIER 50.62 54.05 11.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.167 0.508 . . . . 20.0 109.844 -179.941 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.94 -152.85 0.48 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.329 -0.851 . . . . 20.0 110.862 -179.567 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -72.6 58.67 0.43 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.937 0.399 . . . . 20.0 111.09 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.859 HD11 HD23 ' A' ' 78' ' ' LEU . 0.3 OUTLIER -96.8 135.82 38.21 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.94 -0.573 . . . . 20.0 111.469 -179.642 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -150.56 131.05 13.84 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.807 -0.633 . . . . 20.0 110.576 178.35 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.774 ' CE1' HG13 ' A' ' 79' ' ' VAL . 0.5 OUTLIER -143.5 163.07 34.17 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.212 -0.449 . . . . 20.0 110.362 -179.858 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 30.1 p -106.99 93.32 4.49 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 112.862 0.69 . . . . 20.0 112.862 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.936 ' O ' HG21 ' A' ' 75' ' ' VAL . 23.1 mtt-85 -127.26 127.71 44.83 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 108.043 -1.095 . . . . 20.0 108.043 176.678 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.586 ' C ' HD23 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -118.47 -79.51 0.6 Allowed 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 113.053 0.76 . . . . 20.0 113.053 -177.0 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 1.076 HD11 HG23 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -166.43 136.96 3.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.014 0.435 . . . . 20.0 111.984 -178.314 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 59.9 p -129.88 140.01 51.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.719 -0.673 . . . . 20.0 110.356 178.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.535 ' O ' ' C ' ' A' ' 67' ' ' GLY . 11.7 t0 -147.86 -164.32 1.98 Allowed 'General case' 0 C--O 1.236 0.353 0 N-CA-C 109.968 -0.382 . . . . 20.0 109.968 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.866 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -30.67 146.04 0.01 OUTLIER Glycine 0 C--N 1.343 0.963 0 N-CA-C 110.2 -1.16 . . . . 20.0 110.2 179.48 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.493 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 59.4 Cg_exo -16.43 55.19 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 125.256 3.971 . . . . 20.0 115.037 -178.365 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.866 ' N ' ' O ' ' A' ' 67' ' ' GLY . 33.4 m -163.89 163.8 23.59 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.476 -0.935 . . . . 20.0 108.476 178.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.474 ' HG3' ' O ' ' A' ' 69' ' ' CYS . 82.1 mtt85 -157.71 148.02 20.68 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.342 0.591 . . . . 20.0 112.357 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.814 ' HA ' HD12 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -88.26 164.06 15.79 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 115.302 -0.863 . . . . 20.0 109.952 178.568 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.411 ' HA ' ' CE1' ' A' ' 63' ' ' PHE . . . -149.73 26.77 0.82 Allowed 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 119.957 -0.697 . . . . 20.0 112.734 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.724 ' CB ' HG11 ' A' ' 119' ' ' VAL . 1.3 mptp? -73.58 145.7 85.1 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-O 120.888 0.375 . . . . 20.0 110.277 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -49.84 123.03 9.98 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.797 2.331 . . . . 20.0 112.79 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.936 HG21 ' O ' ' A' ' 62' ' ' ARG . 23.9 m -137.73 145.53 28.9 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.162 0 CA-C-N 116.053 -0.521 . . . . 20.0 111.503 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 21.3 m -123.18 115.27 21.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.915 -0.584 . . . . 20.0 109.625 178.367 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.577 ' CD ' HD12 ' A' ' 136' ' ' LEU . 48.1 mt-10 -130.26 163.43 26.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.629 0.252 . . . . 20.0 110.818 -179.527 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.859 HD23 HD11 ' A' ' 58' ' ' LEU . 6.0 mp -118.11 136.69 53.43 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 121.139 0.495 . . . . 20.0 111.578 179.098 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.81 HG23 ' O ' ' A' ' 79' ' ' VAL . 19.7 m -102.94 81.88 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.677 -0.692 . . . . 20.0 110.287 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.521 ' CB ' ' SG ' ' A' ' 109' ' ' CYS . 0.0 OUTLIER -93.44 108.5 20.17 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.735 -0.666 . . . . 20.0 112.006 -178.974 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.5 m -152.28 99.77 2.54 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.824 -0.625 . . . . 20.0 110.282 179.01 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.551 ' HA3' ' HB2' ' A' ' 54' ' ' SER . . . -154.97 -151.33 5.81 Favored Glycine 0 C--N 1.331 0.261 0 C-N-CA 120.359 -0.924 . . . . 20.0 112.736 -179.61 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.524 ' HA ' ' HA ' ' A' ' 108' ' ' ARG . 91.5 mt-30 -124.69 140.61 52.78 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-O 120.858 0.361 . . . . 20.0 110.135 179.693 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.448 ' C ' ' HD3' ' A' ' 86' ' ' PRO . 89.7 m -111.26 151.24 28.53 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.854 0.359 . . . . 20.0 110.638 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLY . . . . . 0.401 ' N ' ' HD3' ' A' ' 86' ' ' PRO . . . -127.85 64.0 0.6 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.594 -0.812 . . . . 20.0 112.166 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' PRO . . . . . 0.554 ' HD2' ' CD2' ' A' ' 107' ' ' PHE . 24.3 Cg_exo -62.31 143.04 93.34 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 122.145 1.897 . . . . 20.0 111.271 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.545 ' O ' HD22 ' A' ' 89' ' ' LEU . . . -73.69 3.62 6.17 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.799 -0.637 . . . . 20.0 111.221 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -90.95 93.39 9.18 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 120.866 0.365 . . . . 20.0 110.697 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.545 HD22 ' O ' ' A' ' 87' ' ' ALA . 0.7 OUTLIER -100.21 133.16 45.02 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.861 -0.609 . . . . 20.0 110.621 179.934 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.656 HD22 ' N ' ' A' ' 90' ' ' LEU . 1.8 mm? -111.24 91.82 14.4 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 120.851 0.358 . . . . 20.0 111.054 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.658 ' HA ' ' CZ2' ' A' ' 100' ' ' TRP . 52.6 Cg_endo -70.16 88.57 0.58 Allowed 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.776 2.317 . . . . 20.0 111.573 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.481 ' O ' ' CH2' ' A' ' 99' ' ' TRP . 80.8 m-20 -139.83 65.92 1.41 Allowed 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 112.27 0.471 . . . . 20.0 112.27 -179.092 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.691 ' HB1' ' CG2' ' A' ' 97' ' ' VAL . . . -57.2 -18.9 17.76 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.386 0.143 . . . . 20.0 111.386 179.666 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.52 HG22 ' O ' ' A' ' 94' ' ' ILE . 3.5 mt 30.35 34.6 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 CA-C-O 121.143 0.497 . . . . 20.0 111.419 179.154 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLY . . . . . 0.556 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 90.17 -42.5 2.94 Favored Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.722 -0.672 . . . . 20.0 111.844 -179.34 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.485 ' N ' ' O ' ' A' ' 93' ' ' ALA . 41.7 ttm180 -106.27 128.86 54.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.857 0.36 . . . . 20.0 110.923 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.691 ' CG2' ' HB1' ' A' ' 93' ' ' ALA . 25.1 t -130.24 136.65 58.18 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.855 0 CA-C-O 121.467 0.651 . . . . 20.0 110.357 179.289 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt 176.17 -32.33 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.986 -1.006 . . . . 20.0 110.005 -179.002 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.578 ' CE3' ' HB3' ' A' ' 100' ' ' TRP . 0.1 OUTLIER -77.37 -79.75 0.11 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.742 -1.117 . . . . 20.0 110.713 -179.848 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 100' ' ' TRP . . . . . 0.658 ' CZ2' ' HA ' ' A' ' 91' ' ' PRO . 0.0 OUTLIER -89.59 177.69 6.48 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 120.92 0.391 . . . . 20.0 110.598 179.319 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.635 ' NE ' ' CZ2' ' A' ' 100' ' ' TRP . 0.0 OUTLIER 154.46 158.8 0.0 OUTLIER Pre-proline 0 CA--C 1.519 -0.228 0 CA-C-N 115.383 -0.826 . . . . 20.0 111.339 178.048 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.456 ' HD2' ' NE ' ' A' ' 101' ' ' ARG . 3.7 Cg_exo -40.76 -23.31 0.14 Allowed 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 123.501 2.801 . . . . 20.0 112.311 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ASN . . . . . 0.405 ' N ' ' O ' ' A' ' 101' ' ' ARG . 24.8 p-10 -77.4 2.53 15.72 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.851 0.358 . . . . 20.0 110.583 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.463 ' HA2' ' HD3' ' A' ' 105' ' ' PRO . . . 91.94 138.67 8.3 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.974 -0.631 . . . . 20.0 112.976 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.588 ' HB2' ' CE2' ' A' ' 107' ' ' PHE . 12.0 Cg_exo -72.12 161.88 43.38 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 123.036 2.491 . . . . 20.0 111.518 179.4 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -74.36 98.61 3.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.766 0.317 . . . . 20.0 110.911 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.588 ' CE2' ' HB2' ' A' ' 105' ' ' PRO . 32.9 m-85 -123.55 162.22 23.37 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.457 -0.338 . . . . 20.0 111.566 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.524 ' HA ' ' HA ' ' A' ' 83' ' ' GLN . 35.2 ptt-85 -154.95 156.92 36.91 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.45 -0.341 . . . . 20.0 111.338 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.54 ' HA ' ' HA ' ' A' ' 142' ' ' CYS . 17.2 t -69.74 123.63 21.9 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 121.018 0.437 . . . . 20.0 110.208 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.728 HG23 ' HD2' ' A' ' 111' ' ' PRO . 39.3 mm -123.4 143.46 41.39 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 115.765 -0.652 . . . . 20.0 112.047 -178.421 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 1.033 ' CB ' HG11 ' A' ' 137' ' ' VAL . 14.8 Cg_endo -59.89 154.59 49.19 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 123.437 2.758 . . . . 20.0 112.771 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -124.25 -59.14 1.5 Allowed 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 111.922 0.342 . . . . 20.0 111.922 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.543 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 24.9 ttm105 -125.93 145.18 50.38 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.525 0.202 . . . . 20.0 111.224 -179.582 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.874 ' CD1' HG13 ' A' ' 137' ' ' VAL . 0.8 OUTLIER -118.57 159.82 22.88 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 121.448 0.642 . . . . 20.0 111.941 -179.513 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.62 ' HB2' ' HB2' ' A' ' 138' ' ' ALA . 38.5 ttm-85 -100.89 140.45 35.16 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 114.768 -1.105 . . . . 20.0 108.702 178.191 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -80.45 123.32 27.96 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 116.116 -0.493 . . . . 20.0 111.394 -178.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.69 ' HG2' HD23 ' A' ' 136' ' ' LEU . 22.6 mm100 -124.93 124.77 42.74 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.971 -0.559 . . . . 20.0 109.887 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 67.0 ttp85 -130.28 92.43 3.28 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.025 0.441 . . . . 20.0 111.055 -179.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 1.076 HG23 HD11 ' A' ' 64' ' ' LEU . 35.1 m -126.3 170.22 16.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.562 -0.745 . . . . 20.0 110.666 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.555 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 13.0 pt20 -110.94 138.58 47.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.998 0.428 . . . . 20.0 110.946 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.827 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -75.82 125.04 28.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.975 -0.557 . . . . 20.0 110.928 -179.608 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.814 HD12 ' HA ' ' A' ' 71' ' ' SER . 1.9 mp -91.45 142.96 27.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.478 -0.783 . . . . 20.0 111.742 -178.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' CYS . . . . . 0.506 ' SG ' ' HD2' ' A' ' 124' ' ' PRO . 0.4 OUTLIER -119.23 152.3 52.16 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 115.372 -0.831 . . . . 20.0 110.538 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.506 ' HD2' ' SG ' ' A' ' 123' ' ' CYS . 76.4 Cg_exo -49.33 110.86 0.4 Allowed 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.525 2.15 . . . . 20.0 111.85 -179.586 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 91.83 3.9 67.89 Favored Glycine 0 N--CA 1.446 -0.695 0 CA-C-N 115.381 -0.827 . . . . 20.0 111.499 -178.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 38.42 86.07 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.758 -0.734 . . . . 20.0 112.024 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -117.19 -53.36 2.46 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.053 0.39 . . . . 20.0 112.053 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -125.87 56.36 15.25 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 120.905 0.383 . . . . 20.0 111.506 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -52.82 146.92 33.97 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.642 2.228 . . . . 20.0 111.458 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.827 ' HB2' HD12 ' A' ' 121' ' ' LEU . 79.8 mtt85 -125.69 150.6 47.51 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.16 -0.473 . . . . 20.0 111.112 -179.126 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.541 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 14.1 p -102.94 133.76 47.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.955 -0.566 . . . . 20.0 110.449 179.789 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 67.6 ttt180 -144.8 141.48 29.21 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.002 -0.545 . . . . 20.0 111.269 -179.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 14.4 pttp -103.3 149.65 24.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 20.0 110.414 179.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.557 HG23 ' HB2' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -151.88 130.28 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 CA-C-O 121.195 0.521 . . . . 20.0 111.399 -179.279 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.67 ' C ' HD22 ' A' ' 136' ' ' LEU . 86.1 mtm-85 -91.15 122.6 33.93 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.603 -0.726 . . . . 20.0 109.719 178.594 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.83 HD22 ' N ' ' A' ' 136' ' ' LEU . 0.7 OUTLIER -121.23 127.01 51.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.252 0.549 . . . . 20.0 112.341 -178.655 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 1.033 HG11 ' CB ' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -55.49 92.0 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.937 -0.574 . . . . 20.0 111.803 179.639 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.62 ' HB2' ' HB2' ' A' ' 115' ' ' ARG . . . -81.48 -5.72 58.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.196 -0.456 . . . . 20.0 110.616 179.303 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.6 t -159.36 115.63 2.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.756 -0.656 . . . . 20.0 109.677 179.273 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' CYS . . . . . . . . . . . . . 24.6 p -136.12 157.15 47.51 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.12 0.486 . . . . 20.0 112.076 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -131.82 145.82 51.78 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.655 -0.702 . . . . 20.0 110.81 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' CYS . . . . . 0.556 ' SG ' ' CD1' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -74.22 98.32 3.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.248 0.547 . . . . 20.0 110.158 179.628 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.464 ' O ' ' HB2' ' A' ' 144' ' ' ARG . 27.5 tptt -145.31 154.76 42.68 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.445 -0.798 . . . . 20.0 110.819 179.54 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.464 ' HB2' ' O ' ' A' ' 143' ' ' LYS . 64.9 mtp180 . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.239 -0.886 . . . . 20.0 110.723 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.5 mttp . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.887 0.375 . . . . 20.0 111.19 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.431 ' OD1' ' C ' ' A' ' 49' ' ' ASP . 32.7 p30 -88.95 14.17 11.12 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.169 -0.469 . . . . 20.0 111.627 -179.234 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.42 ' O ' ' O ' ' A' ' 54' ' ' SER . 28.0 m -97.58 -18.26 6.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.096 -0.502 . . . . 20.0 111.074 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.447 ' HA ' ' O ' ' A' ' 54' ' ' SER . 51.4 p -80.59 -9.19 59.79 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.728 -0.669 . . . . 20.0 110.919 -179.551 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -60.99 -33.25 72.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.897 0.38 . . . . 20.0 110.29 179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.629 ' CD2' ' HB2' ' A' ' 54' ' ' SER . 35.0 p90 -107.2 -57.11 2.12 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.237 -0.438 . . . . 20.0 111.77 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.629 ' HB2' ' CD2' ' A' ' 53' ' ' TYR . 0.4 OUTLIER -151.37 -166.57 2.56 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.706 -0.479 . . . . 20.0 109.706 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.9 m 61.52 55.1 2.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.135 0.493 . . . . 20.0 110.161 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.51 ' HD3' ' O ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -126.02 152.76 45.33 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.564 -0.744 . . . . 20.0 111.171 -179.907 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.503 ' O ' ' HG2' ' A' ' 57' ' ' GLU . 83.2 tt0 28.12 43.66 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.282 0.563 . . . . 20.0 110.61 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.927 ' O ' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -124.18 117.54 24.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.646 -0.706 . . . . 20.0 111.781 -178.861 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.407 ' C ' ' CD1' ' A' ' 60' ' ' TYR . 7.7 m-70 -151.16 133.55 15.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.979 -0.555 . . . . 20.0 110.717 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.66 ' CD1' HG13 ' A' ' 79' ' ' VAL . 2.7 m-85 -132.06 150.08 52.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 20.0 111.381 -179.007 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -97.51 96.99 8.7 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.984 -0.553 . . . . 20.0 111.75 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.943 ' O ' HG21 ' A' ' 75' ' ' VAL . 23.2 tpt180 -126.28 121.6 33.11 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 107.714 -1.217 . . . . 20.0 107.714 177.709 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.606 ' CD2' ' O ' ' A' ' 73' ' ' LYS . 0.0 OUTLIER -112.48 -81.28 0.59 Allowed 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.003 -0.679 . . . . 20.0 112.702 -177.445 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.922 HD21 ' HB ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -169.06 137.6 2.02 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.214 -0.594 . . . . 20.0 112.203 -178.192 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.923 HG22 ' HG3' ' A' ' 70' ' ' ARG . 51.9 p -129.74 136.42 49.63 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.721 -0.672 . . . . 20.0 109.246 178.329 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.527 ' O ' ' C ' ' A' ' 67' ' ' GLY . 8.6 t0 -148.82 -158.31 0.9 Allowed 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.606 -0.438 . . . . 20.0 111.008 -179.195 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.864 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -31.37 141.5 0.04 OUTLIER Glycine 0 C--N 1.346 1.118 0 N-CA-C 109.718 -1.353 . . . . 20.0 109.718 179.518 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.521 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 20.1 Cg_exo -15.54 53.16 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.889 1 C-N-CA 125.409 4.072 . . . . 20.0 115.48 -178.207 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.864 ' N ' ' O ' ' A' ' 67' ' ' GLY . 65.4 m -159.29 162.85 36.1 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 107.885 -1.154 . . . . 20.0 107.885 178.093 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.923 ' HG3' HG22 ' A' ' 65' ' ' THR . 62.5 ttt180 -148.41 137.94 22.1 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.567 0.58 . . . . 20.0 112.567 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.637 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.6 OUTLIER -81.15 162.91 23.46 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 115.931 -0.577 . . . . 20.0 110.278 178.543 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -151.7 27.83 0.63 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.942 0.719 . . . . 20.0 112.942 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.611 ' HB2' ' CG1' ' A' ' 119' ' ' VAL . 9.9 tttt -71.17 150.5 94.56 Favored Pre-proline 0 C--N 1.327 -0.379 0 N-CA-C 109.85 -0.426 . . . . 20.0 109.85 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.557 ' HD2' ' CG ' ' A' ' 73' ' ' LYS . 41.9 Cg_exo -59.85 115.07 2.37 Favored 'Trans proline' 0 N--CA 1.464 -0.247 0 C-N-CA 122.175 1.917 . . . . 20.0 112.241 -179.258 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.943 HG21 ' O ' ' A' ' 62' ' ' ARG . 4.9 m -134.77 155.42 38.43 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.202 0 CA-C-N 115.676 -0.693 . . . . 20.0 111.062 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 18.7 m -126.76 121.76 32.89 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.717 -0.674 . . . . 20.0 109.813 179.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.511 ' CB ' HD13 ' A' ' 136' ' ' LEU . 6.1 pt-20 -130.58 150.78 51.62 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.041 0.448 . . . . 20.0 111.404 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.665 ' HB3' HD21 ' A' ' 58' ' ' LEU . 5.2 mp -102.6 141.09 35.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.884 -0.598 . . . . 20.0 111.104 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.778 ' H ' HD23 ' A' ' 58' ' ' LEU . 5.8 m -90.91 87.84 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 N-CA-C 109.207 -0.664 . . . . 20.0 109.207 178.684 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.554 ' SG ' ' HB3' ' A' ' 109' ' ' CYS . 33.4 m -94.2 116.22 28.59 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.38 -0.827 . . . . 20.0 110.498 -178.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.728 ' O ' ' N ' ' A' ' 109' ' ' CYS . 4.2 m -114.78 154.88 27.75 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-O 121.349 0.595 . . . . 20.0 111.938 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.477 ' O ' ' HA ' ' A' ' 107' ' ' PHE . . . -64.25 113.15 5.61 Favored Glycine 0 CA--C 1.522 0.521 0 C-N-CA 119.098 -1.525 . . . . 20.0 113.356 -178.163 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.587 ' HB2' ' N ' ' A' ' 108' ' ' ARG . 60.5 tt0 -156.56 152.3 27.1 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.038 0.447 . . . . 20.0 112.009 179.012 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.524 ' HB2' ' O ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER 162.71 40.29 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.687 -0.688 . . . . 20.0 111.165 178.931 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 109.87 -81.54 0.29 Allowed Glycine 0 CA--C 1.521 0.418 0 C-N-CA 120.625 -0.797 . . . . 20.0 113.396 179.46 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' PRO . . . . . 0.571 ' O ' ' CZ ' ' A' ' 144' ' ' ARG . 80.7 Cg_exo -38.38 113.19 0.14 Allowed 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 123.612 2.875 . . . . 20.0 113.826 -178.841 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -101.9 26.99 6.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.762 -0.653 . . . . 20.0 111.147 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.99 107.03 0.66 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.961 0.41 . . . . 20.0 110.351 -179.768 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.547 HD22 ' HA3' ' A' ' 104' ' ' GLY . 31.2 mt -87.28 151.42 23.15 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.87 -0.604 . . . . 20.0 110.396 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' A' ' 102' ' ' PRO . 0.6 OUTLIER -92.29 115.13 64.18 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.767 0.318 . . . . 20.0 110.421 -179.822 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.408 ' HA ' ' HB3' ' A' ' 102' ' ' PRO . 25.6 Cg_endo -61.27 -162.43 0.03 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.759 2.306 . . . . 20.0 112.269 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -74.3 129.33 37.59 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.387 0.613 . . . . 20.0 112.007 -178.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.675 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . . . -94.39 -6.75 43.46 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 114.993 -1.003 . . . . 20.0 112.413 -179.526 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.5 HG13 ' C ' ' A' ' 93' ' ' ALA . 9.6 mt -155.09 -36.01 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 N-CA-C 113.087 0.773 . . . . 20.0 113.087 -178.561 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 115.93 -30.19 6.72 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.508 -0.853 . . . . 20.0 111.175 -178.307 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.427 ' CD ' ' HE3' ' A' ' 98' ' ' LYS . 29.1 ptt180 -105.81 137.81 43.06 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.226 -0.657 . . . . 20.0 109.226 178.519 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.931 HG21 ' NE ' ' A' ' 101' ' ' ARG . 3.7 t -109.67 123.48 65.6 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 CA-C-O 122.075 0.94 . . . . 20.0 111.642 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.469 ' CG ' ' HD1' ' A' ' 99' ' ' TRP . 10.9 ptpt -158.99 20.16 0.2 Allowed 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 113.672 -1.604 . . . . 20.0 110.302 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.723 ' CZ2' ' CZ3' ' A' ' 100' ' ' TRP . 0.4 OUTLIER -153.75 -66.29 0.14 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.994 0.426 . . . . 20.0 112.125 -177.757 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 100' ' ' TRP . . . . . 0.723 ' CZ3' ' CZ2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -123.02 -165.7 1.35 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.852 -0.613 . . . . 20.0 110.8 -178.856 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.931 ' NE ' HG21 ' A' ' 97' ' ' VAL . 0.5 OUTLIER -168.0 143.82 3.2 Favored Pre-proline 0 N--CA 1.453 -0.321 0 CA-C-O 120.974 0.416 . . . . 20.0 111.309 179.769 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.539 ' CD ' ' HD2' ' A' ' 101' ' ' ARG . 29.0 Cg_exo -63.09 1.36 1.2 Allowed 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 123.161 2.574 . . . . 20.0 114.068 -178.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -50.93 -28.54 9.95 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.62 -0.511 . . . . 20.0 109.62 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.547 ' HA3' HD22 ' A' ' 89' ' ' LEU . . . 124.12 153.69 8.7 Favored Glycine 0 C--N 1.334 0.471 0 C-N-CA 120.905 -0.664 . . . . 20.0 113.756 178.677 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.604 ' HD2' ' CZ ' ' A' ' 107' ' ' PHE . 2.8 Cg_endo -81.06 171.48 14.02 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.34 2.693 . . . . 20.0 111.139 178.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.511 ' O ' ' HB3' ' A' ' 81' ' ' SER . 54.6 t0 -75.35 122.24 23.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.979 0.419 . . . . 20.0 110.897 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.604 ' CZ ' ' HD2' ' A' ' 105' ' ' PRO . 16.8 m-30 -109.6 131.7 54.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.003 -0.544 . . . . 20.0 110.508 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.587 ' N ' ' HB2' ' A' ' 83' ' ' GLN . 41.6 ttm180 178.86 -46.16 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 113.599 0.963 . . . . 20.0 113.599 179.122 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.728 ' N ' ' O ' ' A' ' 81' ' ' SER . 1.1 m -167.36 146.2 4.98 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 113.455 0.909 . . . . 20.0 113.455 -178.054 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.907 HG22 ' O ' ' A' ' 141' ' ' LYS . 3.5 tp -105.82 132.66 20.69 Favored Pre-proline 0 N--CA 1.464 0.271 0 O-C-N 121.691 -0.631 . . . . 20.0 110.436 177.405 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.598 ' HA ' ' HB3' ' A' ' 140' ' ' CYS . 9.0 Cg_endo -53.58 139.51 66.45 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.848 2.366 . . . . 20.0 111.913 -179.341 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -132.49 -68.75 0.6 Allowed 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.666 -0.414 . . . . 20.0 111.232 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.528 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 21.4 ttm180 -125.92 141.93 51.75 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.088 -0.506 . . . . 20.0 111.008 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.867 ' CE2' HG13 ' A' ' 137' ' ' VAL . 0.8 OUTLIER -116.59 159.39 22.21 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-O 121.677 0.751 . . . . 20.0 112.098 -179.477 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.412 ' N ' ' O ' ' A' ' 136' ' ' LEU . 47.2 ttm-85 -97.5 146.49 25.19 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 114.423 -1.262 . . . . 20.0 108.413 177.684 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -83.31 136.42 34.38 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 120.717 -0.393 . . . . 20.0 111.691 -178.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.767 ' HB2' HG23 ' A' ' 134' ' ' VAL . 27.9 mm100 -134.47 135.26 42.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.984 -0.553 . . . . 20.0 110.81 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 58.3 ttt-85 -128.38 93.96 3.77 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.359 -0.382 . . . . 20.0 110.298 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.922 ' HB ' HD21 ' A' ' 64' ' ' LEU . 25.1 t -129.17 144.69 37.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 N-CA-C 112.501 0.556 . . . . 20.0 112.501 -178.469 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.501 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 19.0 pt20 -88.24 131.15 34.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.169 -0.469 . . . . 20.0 110.711 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.594 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -77.26 116.15 17.63 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.08 -0.509 . . . . 20.0 111.163 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.469 HD12 ' HA ' ' A' ' 71' ' ' SER . 0.2 OUTLIER -80.27 150.67 29.92 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.6 -0.727 . . . . 20.0 111.107 -179.922 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 123' ' ' CYS . . . . . 0.521 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -111.25 112.2 55.04 Favored Pre-proline 0 C--N 1.332 -0.184 0 CA-C-O 120.827 0.346 . . . . 20.0 110.81 179.433 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -54.99 108.13 0.28 Allowed 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 122.502 2.135 . . . . 20.0 111.58 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 74.12 23.77 75.21 Favored Glycine 0 N--CA 1.452 -0.274 0 N-CA-C 110.853 -0.899 . . . . 20.0 110.853 -178.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' GLY . . . . . 0.5 ' O ' ' HB3' ' A' ' 123' ' ' CYS . . . -150.61 119.37 1.0 Allowed Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 111.412 -0.675 . . . . 20.0 111.412 -179.53 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.465 ' C ' ' HD3' ' A' ' 129' ' ' PRO . . . -85.42 43.33 1.01 Allowed 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 112.968 0.729 . . . . 20.0 112.968 -178.81 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -114.16 60.52 1.0 Allowed Pre-proline 0 C--N 1.327 -0.375 0 CA-C-O 121.093 0.473 . . . . 20.0 110.533 178.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' PRO . . . . . 0.465 ' HD3' ' C ' ' A' ' 127' ' ' ALA . 41.3 Cg_endo -68.62 146.88 68.79 Favored 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 123.38 2.72 . . . . 20.0 112.71 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.563 ' HB2' HD12 ' A' ' 121' ' ' LEU . 83.2 mtt85 -134.35 148.36 50.7 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.874 -0.603 . . . . 20.0 110.46 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.495 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 57.8 p -89.8 141.12 28.93 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 121.096 -0.241 . . . . 20.0 110.869 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' ARG . . . . . 0.425 ' HB3' HD13 ' A' ' 64' ' ' LEU . 53.4 ttt85 -146.86 148.39 31.8 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.135 0.493 . . . . 20.0 112.135 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 1.9 pttt -101.39 145.72 28.55 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 115.382 -0.826 . . . . 20.0 109.884 178.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.767 HG23 ' HB2' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -149.29 126.54 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-O 121.399 0.619 . . . . 20.0 111.448 179.86 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.595 ' C ' HD23 ' A' ' 136' ' ' LEU . 85.1 mtm180 -95.42 112.76 24.42 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.061 -0.972 . . . . 20.0 109.771 179.063 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.595 HD23 ' C ' ' A' ' 135' ' ' ARG . 1.7 mt -113.99 125.35 53.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.524 0.678 . . . . 20.0 112.677 -179.489 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.867 HG13 ' CE2' ' A' ' 114' ' ' TYR . 2.3 m -55.39 90.77 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.088 -0.96 . . . . 20.0 112.835 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -65.53 -25.46 67.46 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.488 -0.93 . . . . 20.0 108.488 177.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 26.3 p -161.94 129.11 3.88 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 114.992 -1.004 . . . . 20.0 110.632 179.146 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 140' ' ' CYS . . . . . 0.598 ' HB3' ' HA ' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -121.73 -174.93 2.98 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.803 0.335 . . . . 20.0 111.5 179.862 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.907 ' O ' HG22 ' A' ' 110' ' ' ILE . 15.5 tttp -118.56 168.55 10.58 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.315 -0.402 . . . . 20.0 111.698 -179.387 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' CYS . . . . . 0.558 ' N ' ' HG2' ' A' ' 141' ' ' LYS . 43.4 t -86.74 103.27 15.03 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.232 -0.44 . . . . 20.0 112.022 -179.254 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.896 ' CB ' HG21 ' A' ' 110' ' ' ILE . 12.0 tptm -142.94 142.39 31.68 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.078 -0.51 . . . . 20.0 110.247 178.446 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.571 ' CZ ' ' O ' ' A' ' 86' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.311 -0.852 . . . . 20.0 110.414 179.625 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.9 mtmm . . . . . 0 N--CA 1.485 1.279 0 CA-C-O 120.904 0.383 . . . . 20.0 111.183 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -82.11 14.3 2.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.046 -0.525 . . . . 20.0 111.684 -179.214 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.472 HG11 ' HG2' ' A' ' 141' ' ' LYS . 29.2 m -99.42 -17.6 6.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.075 0.464 . . . . 20.0 110.917 179.593 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 89.8 p -84.81 -1.58 56.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.607 -0.724 . . . . 20.0 111.268 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -61.57 -30.43 70.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.843 0.354 . . . . 20.0 110.444 -179.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.55 ' CD1' ' SG ' ' A' ' 142' ' ' CYS . 0.0 OUTLIER -111.47 -74.27 0.65 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.176 0.512 . . . . 20.0 110.366 179.118 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.566 ' CB ' ' HA3' ' A' ' 82' ' ' GLY . 20.3 t -143.05 -158.55 0.88 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.332 -0.849 . . . . 20.0 110.053 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.476 ' O ' ' O ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER 61.73 35.1 17.03 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.108 -0.496 . . . . 20.0 110.852 179.738 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.554 ' O ' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -57.45 -146.33 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 20.0 110.209 179.423 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.46 ' N ' ' HG2' ' A' ' 56' ' ' ARG . 93.8 mt-10 -92.46 96.52 10.29 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.93 0.395 . . . . 20.0 110.756 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.863 ' O ' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -125.4 138.82 54.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.994 -0.548 . . . . 20.0 110.194 179.596 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.417 ' C ' ' CD1' ' A' ' 60' ' ' TYR . 1.6 m-70 -139.0 132.6 30.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.052 0.453 . . . . 20.0 111.181 -179.88 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.655 ' CD1' HG13 ' A' ' 79' ' ' VAL . 10.2 m-85 -133.77 148.74 51.4 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.732 -0.667 . . . . 20.0 111.697 -178.684 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 73.2 p -103.29 82.46 2.06 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.178 -0.465 . . . . 20.0 111.318 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.904 ' O ' HG21 ' A' ' 75' ' ' VAL . 68.0 ttt180 -114.93 123.19 48.5 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 108.405 -0.961 . . . . 20.0 108.405 177.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.931 ' O ' HG11 ' A' ' 134' ' ' VAL . 0.1 OUTLIER -110.6 -80.24 0.58 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.154 0.427 . . . . 20.0 112.154 -177.859 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.675 ' O ' HD23 ' A' ' 121' ' ' LEU . 0.0 OUTLIER -166.92 133.97 2.43 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.62 -0.432 . . . . 20.0 111.089 -178.887 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 49.4 p -131.04 141.68 50.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.355 -0.384 . . . . 20.0 110.756 179.538 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.525 ' O ' ' C ' ' A' ' 67' ' ' GLY . 9.3 t0 -152.37 -163.92 1.84 Allowed 'General case' 0 C--O 1.236 0.382 0 N-CA-C 109.785 -0.45 . . . . 20.0 109.785 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.861 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -31.85 148.17 0.01 OUTLIER Glycine 0 C--N 1.345 1.058 0 CA-C-O 118.098 -1.39 . . . . 20.0 110.167 179.135 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.524 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 41.6 Cg_exo -18.14 54.44 0.0 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 124.971 3.78 . . . . 20.0 115.289 -178.255 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.861 ' N ' ' O ' ' A' ' 67' ' ' GLY . 59.1 m -162.66 153.76 17.45 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 115.603 -0.726 . . . . 20.0 109.117 179.118 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.526 ' O ' ' N ' ' A' ' 122' ' ' LEU . 95.5 mtt180 -150.29 150.01 30.92 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.213 0.53 . . . . 20.0 112.335 -179.672 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.633 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -90.21 161.52 15.68 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 115.445 -0.798 . . . . 20.0 110.105 178.496 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.18 35.17 0.99 Allowed 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 114.276 1.213 . . . . 20.0 114.276 -179.31 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.985 ' HB2' HG11 ' A' ' 119' ' ' VAL . 0.9 OUTLIER -80.19 157.75 72.89 Favored Pre-proline 0 C--N 1.327 -0.387 0 C-N-CA 120.632 -0.427 . . . . 20.0 109.989 178.736 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.408 ' HD2' ' HG3' ' A' ' 73' ' ' LYS . 28.7 Cg_endo -61.92 116.27 3.35 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.479 2.12 . . . . 20.0 112.513 -179.363 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.904 HG21 ' O ' ' A' ' 62' ' ' ARG . 8.3 m -133.71 154.44 38.51 Favored 'Isoleucine or valine' 0 C--O 1.23 0.037 0 CA-C-O 120.857 0.36 . . . . 20.0 111.675 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 45.4 m -117.93 121.49 40.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.96 -0.563 . . . . 20.0 109.98 178.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.661 ' C ' HD12 ' A' ' 78' ' ' LEU . 81.0 tt0 -123.92 141.52 51.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.962 0.41 . . . . 20.0 111.814 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 1.02 HD13 ' O ' ' A' ' 137' ' ' VAL . 1.5 mp -117.57 125.68 51.23 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.864 -0.607 . . . . 20.0 110.965 179.297 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.814 ' H ' HD23 ' A' ' 58' ' ' LEU . 18.5 m -95.13 86.56 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-N 115.779 -0.646 . . . . 20.0 110.746 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.444 ' HB3' ' SG ' ' A' ' 109' ' ' CYS . 0.0 OUTLIER -90.11 101.89 14.61 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.907 0.384 . . . . 20.0 110.698 179.962 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 9.5 t -143.57 106.06 4.44 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.097 -0.502 . . . . 20.0 110.379 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.566 ' HA3' ' CB ' ' A' ' 54' ' ' SER . . . -164.6 -153.67 7.56 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.682 -0.771 . . . . 20.0 112.355 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.472 ' HA ' ' HA ' ' A' ' 108' ' ' ARG . 91.0 mt-30 -129.14 151.51 49.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.819 0.343 . . . . 20.0 110.948 179.659 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.41 ' SG ' ' O ' ' A' ' 142' ' ' CYS . 81.4 m -108.56 159.71 16.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.189 -0.46 . . . . 20.0 110.328 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -121.01 63.91 0.49 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.596 -0.812 . . . . 20.0 112.272 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -70.97 167.69 25.27 Favored 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.731 2.287 . . . . 20.0 111.853 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -74.89 3.75 7.66 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.295 -0.411 . . . . 20.0 111.179 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.5 mmm180 -58.57 135.63 57.38 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.068 0.461 . . . . 20.0 110.677 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.583 HD22 ' N ' ' A' ' 89' ' ' LEU . 1.3 mm? -98.83 135.89 39.64 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.797 -0.638 . . . . 20.0 110.465 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.954 HD13 ' HD2' ' A' ' 91' ' ' PRO . 0.2 OUTLIER -97.07 148.96 35.16 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 20.0 111.173 -179.442 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.954 ' HD2' HD13 ' A' ' 90' ' ' LEU . 9.3 Cg_endo -51.42 104.61 0.09 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.194 0 C-N-CA 122.764 2.309 . . . . 20.0 111.251 178.994 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.572 ' O ' ' CH2' ' A' ' 99' ' ' TRP . 80.2 m-20 -107.72 139.68 41.93 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.071 0.462 . . . . 20.0 111.943 -179.205 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.691 ' HA ' HG22 ' A' ' 97' ' ' VAL . . . -61.81 -29.5 70.2 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.703 -0.681 . . . . 20.0 111.581 179.702 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.792 HG22 ' O ' ' A' ' 94' ' ' ILE . 5.1 mt 31.46 35.45 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.485 0.659 . . . . 20.0 111.497 179.23 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLY . . . . . 0.513 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 108.89 -52.98 0.61 Allowed Glycine 0 CA--C 1.52 0.347 0 CA-C-N 115.122 -0.945 . . . . 20.0 113.111 179.41 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.515 ' O ' ' CZ2' ' A' ' 99' ' ' TRP . 58.1 mtp180 -118.61 143.14 47.0 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 110.422 -0.214 . . . . 20.0 110.422 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 1.11 HG13 ' CZ3' ' A' ' 100' ' ' TRP . 12.8 t -129.16 132.82 66.72 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 CA-C-O 121.974 0.892 . . . . 20.0 112.197 179.219 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.465 ' HG2' ' C ' ' A' ' 97' ' ' VAL . 1.2 ptpt 161.82 -32.77 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 113.944 -1.48 . . . . 20.0 108.468 -179.633 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.73 ' HH2' HD12 ' A' ' 94' ' ' ILE . 34.7 p-90 -92.06 24.93 3.05 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 113.146 -1.843 . . . . 20.0 110.396 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' TRP . . . . . 1.11 ' CZ3' HG13 ' A' ' 97' ' ' VAL . 0.0 OUTLIER -30.3 143.32 0.01 OUTLIER 'General case' 0 CA--C 1.499 -1.007 0 CA-C-O 121.858 0.837 . . . . 20.0 112.925 -177.881 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.441 ' O ' ' HD3' ' A' ' 91' ' ' PRO . 65.1 mtp180 -111.77 74.47 1.29 Allowed Pre-proline 0 N--CA 1.433 -1.285 0 CA-C-N 114.156 -1.384 . . . . 20.0 109.961 179.478 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -64.61 46.44 0.15 Allowed 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 123.436 2.757 . . . . 20.0 113.408 -179.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -52.96 -26.11 14.13 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.919 0.39 . . . . 20.0 110.324 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLY . . . . . 0.551 ' O ' ' CD2' ' A' ' 90' ' ' LEU . . . 130.24 146.56 5.99 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.897 -0.668 . . . . 20.0 112.868 179.257 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.83 ' HA ' HD21 ' A' ' 90' ' ' LEU . 56.6 Cg_endo -81.08 170.3 15.26 Favored 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 123.232 2.622 . . . . 20.0 113.127 -179.631 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -59.84 153.45 20.78 Favored 'General case' 0 C--N 1.334 -0.109 0 CA-C-N 116.094 -0.503 . . . . 20.0 110.569 179.52 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.467 ' HA ' ' O ' ' A' ' 144' ' ' ARG . 91.5 m-85 -100.56 129.83 46.55 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.029 0.442 . . . . 20.0 111.369 -179.367 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.472 ' HA ' ' HA ' ' A' ' 83' ' ' GLN . 88.4 mtt180 -74.97 156.99 35.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.791 -0.64 . . . . 20.0 111.468 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 142' ' ' CYS . 4.7 t -74.35 100.44 3.77 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 109.27 -0.641 . . . . 20.0 109.27 178.857 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.658 HG23 ' HD2' ' A' ' 111' ' ' PRO . 25.4 mm -114.58 139.74 24.39 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 121.088 0.471 . . . . 20.0 111.713 -179.052 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 1.047 ' CB ' HG11 ' A' ' 137' ' ' VAL . 12.1 Cg_endo -55.79 143.3 81.4 Favored 'Trans proline' 0 C--O 1.231 0.138 0 C-N-CA 123.131 2.554 . . . . 20.0 112.285 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -107.83 -61.63 1.55 Allowed 'General case' 0 C--N 1.333 -0.144 0 N-CA-C 112.327 0.491 . . . . 20.0 112.327 -179.689 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.447 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 42.3 ttm180 -121.69 147.87 45.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.033 0.444 . . . . 20.0 112.002 -178.597 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 1.019 ' CE2' HG13 ' A' ' 137' ' ' VAL . 0.1 OUTLIER -125.76 158.72 34.19 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.822 -0.626 . . . . 20.0 111.3 179.844 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 62.0 ttm-85 -93.51 142.53 27.24 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.661 -0.866 . . . . 20.0 108.661 178.036 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -80.78 132.81 35.55 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.138 0.494 . . . . 20.0 111.771 -178.426 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.83 ' HB2' HG23 ' A' ' 134' ' ' VAL . 27.8 mm100 -129.62 144.32 51.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.457 -0.792 . . . . 20.0 109.967 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 48.7 ttp180 -139.65 91.08 2.45 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.507 -0.315 . . . . 20.0 110.7 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.985 HG11 ' HB2' ' A' ' 73' ' ' LYS . 0.6 OUTLIER -125.57 164.37 25.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.387 -0.37 . . . . 20.0 110.885 -179.869 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.553 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 14.0 pt20 -106.22 138.37 42.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.155 0.503 . . . . 20.0 111.137 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.832 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -79.43 126.91 31.45 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.573 -0.739 . . . . 20.0 111.443 -179.787 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.526 ' N ' ' O ' ' A' ' 70' ' ' ARG . 0.3 OUTLIER -76.2 144.53 40.41 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.236 -0.893 . . . . 20.0 109.773 179.29 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 123' ' ' CYS . . . . . 0.576 ' HB2' ' O ' ' A' ' 126' ' ' GLY . 3.0 m -104.96 107.96 60.03 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 116.104 -0.498 . . . . 20.0 110.113 -178.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.473 ' HD2' ' HA ' ' A' ' 69' ' ' CYS . 37.7 Cg_endo -66.01 103.06 0.58 Allowed 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 122.08 1.853 . . . . 20.0 111.912 -179.638 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 87.87 18.15 56.74 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.631 -0.795 . . . . 20.0 111.496 -179.398 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' GLY . . . . . 0.576 ' O ' ' HB2' ' A' ' 123' ' ' CYS . . . -152.99 123.63 1.47 Allowed Glycine 0 N--CA 1.442 -0.919 0 N-CA-C 110.407 -1.077 . . . . 20.0 110.407 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -88.26 44.53 1.21 Allowed 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 112.382 0.512 . . . . 20.0 112.382 -178.418 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -120.44 66.28 12.38 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-O 121.096 0.474 . . . . 20.0 110.393 179.138 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_endo -52.05 148.88 22.57 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 123.101 2.534 . . . . 20.0 112.635 -179.551 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.832 ' HB2' HD12 ' A' ' 121' ' ' LEU . 56.7 mtp85 -125.75 151.55 46.54 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.039 -0.528 . . . . 20.0 110.496 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.44 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 47.5 t -102.72 135.88 43.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.682 0.277 . . . . 20.0 110.392 179.653 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 25.7 tpt180 -144.72 144.82 31.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.169 0.509 . . . . 20.0 111.745 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 18.2 pttp -99.19 143.7 29.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.473 -0.785 . . . . 20.0 109.664 178.605 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.931 HG11 ' O ' ' A' ' 63' ' ' PHE . 3.1 m -146.33 130.0 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 CA-C-O 121.349 0.595 . . . . 20.0 111.252 -179.599 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.825 ' C ' HD22 ' A' ' 136' ' ' LEU . 83.2 mtt-85 -92.79 127.79 38.42 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.128 -0.942 . . . . 20.0 110.207 179.424 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.825 HD22 ' C ' ' A' ' 135' ' ' ARG . 0.8 OUTLIER -117.6 114.38 23.33 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.005 0.372 . . . . 20.0 112.005 -178.871 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 1.047 HG11 ' CB ' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -59.74 76.51 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.798 0.333 . . . . 20.0 110.349 178.832 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.538 ' N ' ' O ' ' A' ' 136' ' ' LEU . . . -66.47 -10.46 44.55 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.196 -0.456 . . . . 20.0 110.832 -179.64 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 51.6 p -161.04 120.82 2.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.882 -0.599 . . . . 20.0 110.108 179.28 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 140' ' ' CYS . . . . . 0.528 ' HB2' ' HA ' ' A' ' 111' ' ' PRO . 26.7 p -139.44 155.06 47.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.283 0.563 . . . . 20.0 111.728 -179.688 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.472 ' HG2' HG11 ' A' ' 50' ' ' VAL . 22.1 mttt -125.77 157.12 38.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.091 -0.959 . . . . 20.0 108.778 178.747 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 142' ' ' CYS . . . . . 0.553 ' O ' ' SG ' ' A' ' 142' ' ' CYS . 0.1 OUTLIER -76.35 101.88 5.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.944 0.878 . . . . 20.0 111.42 -179.099 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.433 ' C ' ' HG2' ' A' ' 144' ' ' ARG . 44.7 mmtm -146.61 149.55 33.75 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.167 -0.924 . . . . 20.0 110.665 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.511 ' HD2' ' N ' ' A' ' 144' ' ' ARG . 14.9 mmm180 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.224 -0.894 . . . . 20.0 111.423 179.016 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 24.7 mttm . . . . . 0 N--CA 1.489 1.494 0 CA-C-O 120.7 0.286 . . . . 20.0 111.231 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.459 ' HB2' ' OE1' ' A' ' 52' ' ' GLU . 51.7 p30 -89.11 16.25 7.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.245 -0.434 . . . . 20.0 111.4 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.464 ' O ' ' CZ ' ' A' ' 53' ' ' TYR . 84.7 t -70.11 -37.83 73.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.339 -0.391 . . . . 20.0 111.639 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 60.4 p -83.88 5.08 26.64 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.274 -0.421 . . . . 20.0 110.972 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.593 ' HG2' ' CD1' ' A' ' 53' ' ' TYR . 15.7 pt-20 -67.65 -25.97 65.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.329 -0.396 . . . . 20.0 112.052 -178.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.593 ' CD1' ' HG2' ' A' ' 52' ' ' GLU . 0.1 OUTLIER -97.97 -84.21 0.39 Allowed 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.134 0.492 . . . . 20.0 111.18 179.853 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.554 ' HB3' ' CB ' ' A' ' 109' ' ' CYS . 0.3 OUTLIER -147.14 -165.01 2.13 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.667 -0.697 . . . . 20.0 110.297 -179.962 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 42.2 m 65.18 44.04 3.43 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.081 0.467 . . . . 20.0 110.398 179.663 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.735 ' N ' HD12 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -137.15 145.58 43.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.548 -0.751 . . . . 20.0 111.051 179.901 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.467 ' C ' ' O ' ' A' ' 56' ' ' ARG . 58.9 mm-40 31.02 36.32 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 121.335 0.588 . . . . 20.0 110.702 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.951 ' O ' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -115.95 122.14 44.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.166 -0.925 . . . . 20.0 110.903 -179.792 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -152.64 127.85 9.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.19 -0.459 . . . . 20.0 110.706 179.838 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.74 ' CD1' HG13 ' A' ' 79' ' ' VAL . 12.7 m-85 -127.58 149.02 50.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.201 -0.454 . . . . 20.0 112.002 -179.078 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 57.8 p -107.95 90.46 3.3 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.802 -0.636 . . . . 20.0 111.518 -179.446 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.945 ' O ' HG21 ' A' ' 75' ' ' VAL . 40.7 mmt180 -120.52 125.03 46.83 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.524 -0.917 . . . . 20.0 108.524 178.079 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.575 ' CD1' ' O ' ' A' ' 73' ' ' LYS . 0.0 OUTLIER -112.88 -82.88 0.59 Allowed 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.729 0.64 . . . . 20.0 112.729 -178.185 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.625 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -168.84 141.83 2.84 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.475 -0.49 . . . . 20.0 112.136 -178.201 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.683 HG22 ' HG3' ' A' ' 70' ' ' ARG . 81.1 p -134.98 134.61 40.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.265 -0.425 . . . . 20.0 110.681 178.515 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.73 ' HB2' HD13 ' A' ' 121' ' ' LEU . 92.1 m-20 -141.32 -165.52 1.99 Allowed 'General case' 0 C--O 1.237 0.426 0 N-CA-C 109.7 -0.481 . . . . 20.0 109.7 179.411 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.786 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -30.32 143.98 0.01 OUTLIER Glycine 0 C--N 1.345 1.055 0 N-CA-C 110.243 -1.143 . . . . 20.0 110.243 179.334 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.505 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 14.1 Cg_exo -16.07 58.73 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 125.193 3.929 . . . . 20.0 115.412 -178.077 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.786 ' N ' ' O ' ' A' ' 67' ' ' GLY . 59.8 m -164.11 158.86 19.74 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 108.168 -1.049 . . . . 20.0 108.168 178.201 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.683 ' HG3' HG22 ' A' ' 65' ' ' THR . 49.4 ttp180 -150.81 143.16 24.26 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.93 0.715 . . . . 20.0 112.93 -179.312 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.625 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -84.28 160.77 20.67 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 115.202 -0.908 . . . . 20.0 110.36 178.554 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -147.51 28.05 0.99 Allowed 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 113.47 0.915 . . . . 20.0 113.47 -179.587 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 1.048 ' HB2' HG11 ' A' ' 119' ' ' VAL . 1.0 OUTLIER -72.95 155.8 90.22 Favored Pre-proline 0 C--N 1.324 -0.509 0 C-N-CA 120.548 -0.461 . . . . 20.0 110.09 179.268 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -61.3 119.45 6.6 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.352 2.035 . . . . 20.0 111.97 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.945 HG21 ' O ' ' A' ' 62' ' ' ARG . 11.1 m -135.71 147.01 28.75 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 CA-C-N 116.422 -0.354 . . . . 20.0 111.191 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 41.2 m -113.79 123.95 51.07 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.021 0.438 . . . . 20.0 110.294 178.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.613 ' C ' HD12 ' A' ' 78' ' ' LEU . 40.0 tp10 -128.67 138.36 52.12 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.713 -0.676 . . . . 20.0 110.401 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.887 HD13 ' O ' ' A' ' 137' ' ' VAL . 1.4 mp -115.39 134.21 55.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.43 -0.35 . . . . 20.0 110.56 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.844 ' H ' HD23 ' A' ' 58' ' ' LEU . 15.1 m -97.58 86.56 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 CA-C-O 121.005 0.431 . . . . 20.0 111.335 -179.777 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.534 ' O ' ' HD3' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -100.98 111.94 24.26 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.063 -0.517 . . . . 20.0 110.358 179.389 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.1 t -145.17 109.03 4.73 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.102 0.408 . . . . 20.0 112.102 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.499 ' O ' ' HA ' ' A' ' 144' ' ' ARG . . . -174.99 -179.88 45.85 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 120.545 -0.836 . . . . 20.0 113.381 179.129 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.688 ' HA ' ' HA ' ' A' ' 144' ' ' ARG . 59.4 tt0 -109.08 144.79 36.64 Favored 'General case' 0 CA--C 1.528 0.103 0 C-N-CA 123.011 0.524 . . . . 20.0 110.616 179.261 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.482 ' SG ' ' C ' ' A' ' 142' ' ' CYS . 95.4 m -106.39 128.45 54.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.019 0.438 . . . . 20.0 110.133 179.413 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLY . . . . . 0.632 ' N ' ' CD ' ' A' ' 86' ' ' PRO . . . 69.99 35.32 71.7 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.863 -0.684 . . . . 20.0 112.059 -178.564 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' PRO . . . . . 0.632 ' CD ' ' N ' ' A' ' 85' ' ' GLY . 90.9 Cg_endo -76.9 135.33 15.58 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.721 2.281 . . . . 20.0 112.395 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.629 ' O ' HD22 ' A' ' 89' ' ' LEU . . . -109.32 -25.0 10.8 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.202 -0.454 . . . . 20.0 110.644 179.185 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ARG . . . . . 0.403 ' C ' HD13 ' A' ' 89' ' ' LEU . 20.4 tpt180 -85.08 97.54 9.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.819 -0.628 . . . . 20.0 110.529 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.629 HD22 ' O ' ' A' ' 87' ' ' ALA . 0.3 OUTLIER -96.42 118.14 32.34 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.89 -0.595 . . . . 20.0 110.052 179.888 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 5.4 mt -113.0 117.3 46.25 Favored Pre-proline 0 CA--C 1.533 0.315 0 N-CA-C 112.331 0.493 . . . . 20.0 112.331 -178.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.609 ' CG ' ' CD1' ' A' ' 100' ' ' TRP . 25.7 Cg_endo -62.03 136.63 62.1 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.742 2.295 . . . . 20.0 111.1 178.481 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.599 ' O ' ' CH2' ' A' ' 99' ' ' TRP . 26.3 m120 -100.65 148.23 25.08 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 113.279 0.844 . . . . 20.0 113.279 -178.154 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.704 ' HA ' ' CZ3' ' A' ' 100' ' ' TRP . . . -84.06 -18.39 37.15 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.073 -0.967 . . . . 20.0 112.315 179.206 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 1.118 HD12 ' CH2' ' A' ' 99' ' ' TRP . 22.4 mt 27.68 35.19 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 121.225 0.536 . . . . 20.0 111.565 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLY . . . . . 0.601 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 96.99 -50.72 1.49 Allowed Glycine 0 CA--C 1.521 0.445 0 CA-C-N 115.714 -0.676 . . . . 20.0 112.829 -179.637 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.598 ' O ' ' CZ2' ' A' ' 99' ' ' TRP . 42.9 mmt180 -114.13 142.92 45.61 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.6 0.2 . . . . 20.0 110.465 179.558 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.987 HG13 ' CZ3' ' A' ' 100' ' ' TRP . 10.9 t -122.05 134.18 66.12 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.78 0 CA-C-O 121.829 0.823 . . . . 20.0 111.924 179.509 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.437 ' HG2' ' C ' ' A' ' 97' ' ' VAL . 0.4 OUTLIER 162.91 -30.4 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 114.003 -1.453 . . . . 20.0 108.877 -179.481 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 1.118 ' CH2' HD12 ' A' ' 94' ' ' ILE . 25.0 p-90 -96.76 28.8 3.27 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 113.482 -1.69 . . . . 20.0 110.243 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' TRP . . . . . 0.987 ' CZ3' HG13 ' A' ' 97' ' ' VAL . 0.0 OUTLIER -34.52 136.0 0.16 Allowed 'General case' 0 CA--C 1.501 -0.916 0 CA-C-O 121.978 0.894 . . . . 20.0 112.883 -177.213 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.56 82.55 47.59 Favored Pre-proline 0 N--CA 1.437 -1.111 0 CA-C-N 113.871 -1.513 . . . . 20.0 110.616 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.557 ' O ' ' CB ' ' A' ' 89' ' ' LEU . 24.3 Cg_exo -62.62 -6.56 9.12 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.606 2.204 . . . . 20.0 112.071 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ASN . . . . . 0.448 ' C ' ' HB3' ' A' ' 89' ' ' LEU . 21.1 t-20 -59.68 -34.15 72.49 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.888 0.375 . . . . 20.0 110.304 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 102.95 153.18 24.23 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.894 -0.67 . . . . 20.0 112.991 179.543 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -61.92 168.53 8.71 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 123.243 2.628 . . . . 20.0 112.016 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -63.94 97.91 0.19 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.944 0.402 . . . . 20.0 110.918 -179.595 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.631 ' O ' ' CB ' ' A' ' 108' ' ' ARG . 13.2 m-85 -112.85 138.07 50.25 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.932 -0.576 . . . . 20.0 111.6 -179.788 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.631 ' CB ' ' O ' ' A' ' 107' ' ' PHE . 42.0 ttm180 112.22 67.18 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 O-C-N 124.112 0.882 . . . . 20.0 111.316 179.084 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.554 ' CB ' ' HB3' ' A' ' 54' ' ' SER . 0.5 OUTLIER 170.94 110.51 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.442 -0.344 . . . . 20.0 111.439 179.613 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.544 ' CG2' ' HB2' ' A' ' 143' ' ' LYS . 0.1 OUTLIER -147.83 141.61 15.8 Favored Pre-proline 0 CA--C 1.531 0.237 0 CA-C-O 120.888 0.375 . . . . 20.0 110.686 179.189 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.776 ' CB ' HG11 ' A' ' 137' ' ' VAL . 13.4 Cg_endo -55.44 138.99 81.66 Favored 'Trans proline' 0 N--CA 1.466 -0.137 0 C-N-CA 122.93 2.42 . . . . 20.0 111.896 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.476 ' OD2' ' HB3' ' A' ' 141' ' ' LYS . 83.4 m-20 -125.59 -56.1 1.51 Allowed 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.935 -0.306 . . . . 20.0 111.668 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.536 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 38.9 ttm180 -118.07 151.95 36.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.734 0.302 . . . . 20.0 111.493 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.919 ' CE2' HG13 ' A' ' 137' ' ' VAL . 2.5 m-85 -127.82 164.18 22.76 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.611 0.72 . . . . 20.0 111.699 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.417 ' N ' ' O ' ' A' ' 136' ' ' LEU . 49.0 ttm-85 -99.21 145.27 27.42 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 114.732 -1.122 . . . . 20.0 108.078 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -90.59 115.11 27.47 Favored 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 120.164 -0.614 . . . . 20.0 111.187 -179.055 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -132.22 137.3 47.51 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.068 -0.514 . . . . 20.0 111.352 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' ARG . . . . . 0.499 ' HG2' ' HA ' ' A' ' 133' ' ' LYS . 87.6 mtt-85 -127.94 111.9 14.09 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.686 -0.688 . . . . 20.0 109.946 179.455 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 1.048 HG11 ' HB2' ' A' ' 73' ' ' LYS . 38.8 t -127.46 146.23 33.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 116.188 -0.46 . . . . 20.0 111.89 -178.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.579 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 28.3 mp0 -78.15 131.34 37.17 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 116.208 -0.451 . . . . 20.0 111.13 -179.799 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.905 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.3 OUTLIER -79.3 122.13 25.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 20.0 109.984 179.569 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.75 136.71 34.06 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.383 0.611 . . . . 20.0 111.851 -178.421 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' CYS . . . . . 0.533 ' SG ' ' HD2' ' A' ' 124' ' ' PRO . 0.1 OUTLIER -111.39 158.52 35.98 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 115.359 -0.837 . . . . 20.0 109.986 179.289 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.533 ' HD2' ' SG ' ' A' ' 123' ' ' CYS . 51.3 Cg_exo -52.23 110.71 0.48 Allowed 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 121.942 1.761 . . . . 20.0 111.347 -179.641 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 98.7 -13.17 62.66 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.941 -0.647 . . . . 20.0 111.732 -179.003 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 66.03 56.4 14.44 Favored Glycine 0 C--N 1.333 0.397 0 C-N-CA 120.987 -0.625 . . . . 20.0 112.912 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -120.12 -23.47 6.29 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.399 0.518 . . . . 20.0 112.399 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -121.29 57.08 6.42 Favored Pre-proline 0 C--N 1.33 -0.254 0 N-CA-C 112.269 0.47 . . . . 20.0 112.269 -179.077 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' PRO . . . . . 0.499 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 37.7 Cg_endo -67.4 141.46 56.24 Favored 'Trans proline' 0 CA--C 1.528 0.221 0 C-N-CA 122.512 2.141 . . . . 20.0 111.722 178.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.905 ' HB2' HD12 ' A' ' 121' ' ' LEU . 84.5 mtt180 -139.64 136.47 34.36 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 121.019 -0.272 . . . . 20.0 111.511 -179.578 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 28.1 t -88.1 133.75 33.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.85 0.357 . . . . 20.0 111.43 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 132' ' ' ARG . . . . . 0.495 ' HD3' ' HB2' ' A' ' 64' ' ' LEU . 58.1 ttt85 -139.94 138.08 35.29 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.119 -0.491 . . . . 20.0 111.783 -179.698 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.499 ' HA ' ' HG2' ' A' ' 118' ' ' ARG . 12.0 pttt -87.08 142.94 27.55 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.103 -0.498 . . . . 20.0 110.122 179.015 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.611 HG12 ' CD2' ' A' ' 136' ' ' LEU . 15.6 t -142.58 126.03 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 CA-C-O 121.284 0.564 . . . . 20.0 111.477 -179.611 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.48 ' O ' ' CD2' ' A' ' 114' ' ' TYR . 99.7 mtt180 -95.13 99.07 11.11 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.152 -0.931 . . . . 20.0 109.265 178.148 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.611 ' CD2' HG12 ' A' ' 134' ' ' VAL . 5.3 mt -104.78 133.85 48.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.461 0.648 . . . . 20.0 112.502 -179.335 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.919 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.3 OUTLIER -68.93 89.34 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.286 -0.87 . . . . 20.0 112.106 -179.587 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -72.32 -12.6 61.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.333 0.587 . . . . 20.0 109.481 178.571 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 5.6 t -161.31 129.88 4.45 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 115.246 -0.888 . . . . 20.0 110.303 179.048 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 140' ' ' CYS . . . . . 0.54 ' HB3' ' HA ' ' A' ' 111' ' ' PRO . 26.0 p -126.42 159.99 31.74 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.789 0.328 . . . . 20.0 110.968 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.476 ' HB3' ' OD2' ' A' ' 112' ' ' ASP . 12.4 ttpt -123.55 158.95 30.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.305 -0.407 . . . . 20.0 110.651 -179.582 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 142' ' ' CYS . . . . . 0.537 ' O ' ' HD3' ' A' ' 143' ' ' LYS . 0.0 OUTLIER -55.78 109.23 0.54 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.981 0.419 . . . . 20.0 110.729 -179.263 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.544 ' HB2' ' CG2' ' A' ' 110' ' ' ILE . 25.8 mmtt -139.42 144.64 38.19 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.474 -0.785 . . . . 20.0 110.659 178.363 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.688 ' HA ' ' HA ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.045 -0.979 . . . . 20.0 111.042 -179.5 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.444 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 81.6 tttt . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.915 0.388 . . . . 20.0 111.025 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 89.7 m-20 -86.74 17.09 4.19 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.033 -0.53 . . . . 20.0 111.831 -179.277 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 34.7 m -81.1 -13.78 12.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.126 0.488 . . . . 20.0 110.299 178.748 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 88.2 p -81.92 -8.94 59.71 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.4 -0.818 . . . . 20.0 110.891 179.71 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.477 ' OE1' ' OE1' ' A' ' 83' ' ' GLN . 78.9 mt-10 -88.1 3.25 49.79 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.259 -0.428 . . . . 20.0 110.934 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.564 ' CD2' ' SG ' ' A' ' 142' ' ' CYS . 3.5 m-85 -85.92 25.73 1.08 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.101 -0.5 . . . . 20.0 111.353 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.434 ' C ' ' SG ' ' A' ' 55' ' ' CYS . 34.7 t -60.27 108.33 0.78 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.103 0.478 . . . . 20.0 111.145 -179.058 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.434 ' SG ' ' C ' ' A' ' 54' ' ' SER . 3.5 m -159.44 26.04 0.19 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.573 -0.74 . . . . 20.0 110.265 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.485 ' O ' ' N ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -57.46 155.18 9.74 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.058 -0.519 . . . . 20.0 111.623 -179.46 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.802 ' HA ' HD23 ' A' ' 78' ' ' LEU . 85.4 tt0 -52.04 85.44 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.896 -0.593 . . . . 20.0 111.08 -179.862 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.923 HD13 ' CG2' ' A' ' 79' ' ' VAL . 8.3 tt -96.42 151.46 19.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.017 -0.538 . . . . 20.0 110.934 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.603 ' CG ' HG22 ' A' ' 76' ' ' THR . 2.2 m-70 -128.02 133.24 49.1 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.022 0.379 . . . . 20.0 112.022 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.655 ' CZ ' HG12 ' A' ' 79' ' ' VAL . 0.2 OUTLIER -153.55 168.67 25.38 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.24 -0.436 . . . . 20.0 111.198 179.514 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.627 ' CG2' ' CZ ' ' A' ' 63' ' ' PHE . 32.3 m -93.8 126.58 39.07 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.87 0.843 . . . . 20.0 112.912 -178.434 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.862 ' O ' HG21 ' A' ' 75' ' ' VAL . 40.7 mtm180 -169.43 121.01 0.72 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.21 -1.359 . . . . 20.0 108.038 177.83 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.627 ' CZ ' ' CG2' ' A' ' 61' ' ' THR . 0.0 OUTLIER -120.28 -81.04 0.63 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 113.027 0.751 . . . . 20.0 113.027 -178.047 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.913 HD21 ' HB ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -166.58 139.68 3.85 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.169 0.433 . . . . 20.0 112.169 -177.756 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.466 ' O ' ' OD1' ' A' ' 66' ' ' ASP . 68.9 p -133.42 128.29 35.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.805 -0.634 . . . . 20.0 110.232 178.68 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.918 ' HB2' HD13 ' A' ' 121' ' ' LEU . 73.6 m-20 -139.42 -165.06 1.79 Allowed 'General case' 0 C--O 1.236 0.346 0 N-CA-C 110.011 -0.366 . . . . 20.0 110.011 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.833 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -29.59 144.61 0.01 OUTLIER Glycine 0 C--N 1.344 0.988 0 CA-C-O 118.798 -1.001 . . . . 20.0 110.733 179.47 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.504 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 39.0 Cg_exo -14.91 54.51 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.723 1 C-N-CA 125.949 4.433 . . . . 20.0 115.106 -178.756 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.833 ' N ' ' O ' ' A' ' 67' ' ' GLY . 17.1 m -163.27 157.67 20.55 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.138 -1.06 . . . . 20.0 108.138 178.677 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -145.98 146.92 31.19 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.091 0.472 . . . . 20.0 112.042 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.623 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -89.23 160.72 16.79 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 115.512 -0.767 . . . . 20.0 109.955 178.861 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -149.87 28.49 0.76 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 114.21 1.189 . . . . 20.0 114.21 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.589 ' O ' ' CD2' ' A' ' 63' ' ' PHE . 17.3 tttt -73.72 140.48 78.18 Favored Pre-proline 0 C--N 1.328 -0.332 0 C-N-CA 120.551 -0.459 . . . . 20.0 110.164 178.872 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.531 ' HD2' ' HG2' ' A' ' 73' ' ' LYS . 63.9 Cg_exo -51.34 125.87 17.7 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 122.392 2.061 . . . . 20.0 112.419 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.862 HG21 ' O ' ' A' ' 62' ' ' ARG . 26.3 m -133.63 163.25 37.97 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.159 0 CA-C-O 121.123 0.487 . . . . 20.0 112.033 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.603 HG22 ' CG ' ' A' ' 59' ' ' HIS . 0.2 OUTLIER -136.76 100.37 4.3 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.635 -0.711 . . . . 20.0 109.916 178.944 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.598 ' CD ' HD12 ' A' ' 136' ' ' LEU . 83.5 mt-10 -114.43 162.98 15.96 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.1 -0.5 . . . . 20.0 111.568 -178.81 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.834 HD13 ' O ' ' A' ' 137' ' ' VAL . 5.6 mp -111.1 142.35 43.39 Favored 'General case' 0 CA--C 1.512 -0.498 0 CA-C-O 121.355 0.598 . . . . 20.0 111.302 179.125 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.923 ' CG2' HD13 ' A' ' 58' ' ' LEU . 7.7 m -103.26 84.81 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 115.294 -0.866 . . . . 20.0 110.718 -179.279 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -86.15 106.97 17.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.944 -0.571 . . . . 20.0 110.801 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 25.6 p -141.08 113.76 8.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.008 -0.542 . . . . 20.0 110.7 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -169.77 -173.92 37.64 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.382 -0.913 . . . . 20.0 112.756 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.522 ' HA ' ' HA ' ' A' ' 108' ' ' ARG . 62.6 tt0 -117.83 139.77 50.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.66 0.267 . . . . 20.0 110.415 179.047 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.495 ' O ' ' O ' ' A' ' 85' ' ' GLY . 38.6 m -120.59 154.38 35.49 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 120.938 0.399 . . . . 20.0 111.732 -179.205 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLY . . . . . 0.495 ' O ' ' O ' ' A' ' 84' ' ' CYS . . . 48.98 167.94 0.01 OUTLIER Glycine 0 C--N 1.332 0.358 0 CA-C-N 115.732 -0.667 . . . . 20.0 112.957 179.356 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_exo -62.25 162.5 23.19 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.801 2.334 . . . . 20.0 112.208 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.95 12.24 9.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.096 -0.502 . . . . 20.0 111.496 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 20.8 tpt180 -70.56 131.52 44.1 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.55 -0.295 . . . . 20.0 110.31 179.75 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.631 HD22 ' N ' ' A' ' 89' ' ' LEU . 1.1 mm? -100.0 122.7 43.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.531 -0.304 . . . . 20.0 110.859 -179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.426 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 5.6 tp -114.14 109.31 49.43 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-O 120.731 0.3 . . . . 20.0 111.408 179.661 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.521 ' HB2' ' CG ' ' A' ' 100' ' ' TRP . 18.6 Cg_endo -60.35 113.88 1.87 Allowed 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.765 2.31 . . . . 20.0 111.474 179.113 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -97.48 141.31 30.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.828 0.347 . . . . 20.0 111.872 -178.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.999 ' CB ' HG22 ' A' ' 97' ' ' VAL . . . -87.16 0.86 54.64 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-N 116.265 -0.425 . . . . 20.0 111.818 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.809 HD12 ' CH2' ' A' ' 99' ' ' TRP . 2.3 mp 34.69 31.63 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.516 0.674 . . . . 20.0 111.657 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 120.15 -49.76 0.86 Allowed Glycine 0 CA--C 1.524 0.62 0 CA-C-N 114.926 -1.034 . . . . 20.0 113.576 179.339 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.839 ' O ' ' HB1' ' A' ' 93' ' ' ALA . 31.6 ttp180 -116.12 150.46 37.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.742 0.271 . . . . 20.0 110.278 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 1.06 HG13 ' CZ3' ' A' ' 100' ' ' TRP . 2.2 t -123.93 116.96 49.52 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.355 0 CA-C-O 121.778 0.799 . . . . 20.0 111.943 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.613 ' HG3' ' HD1' ' A' ' 99' ' ' TRP . 0.5 OUTLIER 171.88 38.49 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.368 -1.287 . . . . 20.0 108.772 -179.218 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.809 ' CH2' HD12 ' A' ' 94' ' ' ILE . 4.0 p-90 -178.63 52.12 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.142 -0.935 . . . . 20.0 109.328 -177.216 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' TRP . . . . . 1.06 ' CZ3' HG13 ' A' ' 97' ' ' VAL . 0.0 OUTLIER -53.92 138.26 37.02 Favored 'General case' 0 CA--C 1.498 -1.026 0 CA-C-O 122.494 1.14 . . . . 20.0 113.983 -176.82 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.403 ' C ' ' HB3' ' A' ' 91' ' ' PRO . 0.0 OUTLIER -122.47 83.22 47.16 Favored Pre-proline 0 N--CA 1.435 -1.184 0 CA-C-N 113.144 -1.844 . . . . 20.0 109.855 179.528 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.448 ' O ' ' CB ' ' A' ' 89' ' ' LEU . 13.2 Cg_endo -56.67 -10.52 5.38 Favored 'Trans proline' 0 CA--C 1.53 0.312 0 C-N-CA 123.293 2.662 . . . . 20.0 112.72 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ASN . . . . . 0.434 ' C ' ' HB3' ' A' ' 89' ' ' LEU . 29.2 m120 -58.06 -34.26 69.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.303 -0.408 . . . . 20.0 111.726 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 67.36 157.45 0.74 Allowed Glycine 0 N--CA 1.453 -0.208 0 C-N-CA 120.406 -0.902 . . . . 20.0 112.201 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.579 ' O ' ' CE2' ' A' ' 107' ' ' PHE . 10.0 Cg_exo -70.11 143.5 49.37 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.701 2.267 . . . . 20.0 111.943 179.798 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -70.04 127.76 33.98 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.119 -0.326 . . . . 20.0 110.119 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.579 ' CE2' ' O ' ' A' ' 105' ' ' PRO . 55.8 m-85 -113.1 136.05 53.13 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.769 0.319 . . . . 20.0 111.543 -179.299 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.522 ' HA ' ' HA ' ' A' ' 83' ' ' GLN . 29.6 ptt-85 -173.12 175.45 3.2 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.35 -0.386 . . . . 20.0 110.957 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.484 ' HA ' ' HA ' ' A' ' 142' ' ' CYS . 46.5 t -70.02 112.21 6.25 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.204 -0.665 . . . . 20.0 109.204 179.07 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.509 HD12 ' HB2' ' A' ' 144' ' ' ARG . 7.9 mt -109.49 138.39 20.55 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.115 0.483 . . . . 20.0 111.721 -178.615 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.923 ' HB3' HG11 ' A' ' 137' ' ' VAL . 20.3 Cg_endo -61.55 139.95 84.37 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 123.071 2.514 . . . . 20.0 111.272 178.865 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -100.11 -68.79 0.79 Allowed 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.552 0.575 . . . . 20.0 112.552 -179.164 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.427 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 60.9 ttm-85 -122.99 142.72 50.53 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.436 -0.347 . . . . 20.0 111.376 -179.017 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.886 ' CD2' HG13 ' A' ' 137' ' ' VAL . 0.7 OUTLIER -118.61 158.1 26.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.093 0.473 . . . . 20.0 111.296 -179.61 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 55.0 ttm-85 -97.29 141.63 30.16 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.807 -0.812 . . . . 20.0 108.807 178.345 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -77.66 128.15 33.62 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.878 0.37 . . . . 20.0 111.859 -178.382 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.837 ' HG2' HD23 ' A' ' 136' ' ' LEU . 27.5 mm100 -126.99 137.15 53.05 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.117 -0.492 . . . . 20.0 111.233 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -133.94 94.23 3.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.971 -0.559 . . . . 20.0 110.451 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.913 ' HB ' HD21 ' A' ' 64' ' ' LEU . 29.1 t -123.81 147.64 28.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.351 -0.386 . . . . 20.0 110.49 179.622 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.563 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 7.0 pt20 -94.37 133.87 37.47 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.42 -0.512 . . . . 20.0 110.71 -179.594 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.918 HD13 ' HB2' ' A' ' 66' ' ' ASP . 0.1 OUTLIER -77.33 118.65 20.02 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.421 0.629 . . . . 20.0 110.851 -179.717 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.16 140.86 37.66 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.002 -0.999 . . . . 20.0 111.124 -179.328 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 123' ' ' CYS . . . . . 0.504 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.3 OUTLIER -114.38 150.33 43.6 Favored Pre-proline 0 N--CA 1.446 -0.673 0 CA-C-N 115.619 -0.719 . . . . 20.0 109.578 179.128 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.467 ' HD2' ' SG ' ' A' ' 123' ' ' CYS . 59.4 Cg_exo -50.89 112.72 0.84 Allowed 'Trans proline' 0 N--CA 1.465 -0.2 0 C-N-CA 122.252 1.968 . . . . 20.0 112.147 -178.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 92.66 2.03 67.73 Favored Glycine 0 N--CA 1.449 -0.451 0 CA-C-N 115.547 -0.751 . . . . 20.0 111.736 -179.25 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 45.4 83.5 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 121.078 -0.582 . . . . 20.0 112.788 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.458 ' O ' ' HD2' ' A' ' 129' ' ' PRO . . . -116.63 -68.99 0.88 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.87 0.335 . . . . 20.0 111.775 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -118.06 60.74 3.79 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-O 120.976 0.417 . . . . 20.0 111.892 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 129' ' ' PRO . . . . . 0.458 ' HD2' ' O ' ' A' ' 127' ' ' ALA . 3.3 Cg_endo -46.37 155.32 0.72 Allowed 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 123.059 2.506 . . . . 20.0 111.458 178.913 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.774 ' HB2' HD12 ' A' ' 121' ' ' LEU . 72.4 mtt85 -130.0 154.35 47.48 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.434 -0.348 . . . . 20.0 110.541 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.534 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 29.7 m -107.19 140.81 39.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.719 0.295 . . . . 20.0 110.392 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' ARG . . . . . 0.5 ' HD3' ' CB ' ' A' ' 64' ' ' LEU . 56.6 ttt85 -141.92 142.64 33.04 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.162 0.506 . . . . 20.0 112.203 -179.353 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 7.5 pttt -93.3 143.95 25.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.492 -0.776 . . . . 20.0 109.076 178.159 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.454 ' O ' ' CD2' ' A' ' 136' ' ' LEU . 3.1 t -143.99 121.15 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 CA-C-O 121.164 0.507 . . . . 20.0 111.805 -178.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.598 ' C ' HD22 ' A' ' 136' ' ' LEU . 87.3 mtm-85 -92.26 112.66 24.69 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.321 -0.854 . . . . 20.0 109.289 178.69 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.837 HD23 ' HG2' ' A' ' 117' ' ' GLN . 1.6 mm? -113.98 123.78 50.54 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.337 0.589 . . . . 20.0 112.279 -178.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.923 HG11 ' HB3' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -57.5 84.39 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.411 -0.813 . . . . 20.0 111.672 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 138' ' ' ALA . . . . . 0.49 ' HA ' ' CD1' ' A' ' 78' ' ' LEU . . . -69.83 -16.12 63.22 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.408 -0.517 . . . . 20.0 109.818 178.904 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.0 t -153.83 117.67 4.73 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.748 -0.66 . . . . 20.0 110.511 178.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' CYS . . . . . . . . . . . . . 9.3 p -135.49 159.37 41.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.324 0.583 . . . . 20.0 112.281 -179.195 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -142.0 144.05 33.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.259 -0.882 . . . . 20.0 109.622 178.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 142' ' ' CYS . . . . . 0.564 ' SG ' ' CD2' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -69.96 95.41 0.93 Allowed 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.879 -0.328 . . . . 20.0 110.802 -179.886 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.511 ' O ' ' HB2' ' A' ' 144' ' ' ARG . 19.1 tptp -139.3 136.55 34.99 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-N 116.303 -0.408 . . . . 20.0 111.102 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.511 ' HB2' ' O ' ' A' ' 143' ' ' LYS . 51.1 mtp85 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.229 -0.891 . . . . 20.0 110.794 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 19.3 mttt . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.779 0.323 . . . . 20.0 110.895 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -84.58 14.93 4.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.16 -0.473 . . . . 20.0 111.495 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.631 ' O ' HG12 ' A' ' 50' ' ' VAL . 52.9 t -74.85 -3.84 5.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.451 -0.341 . . . . 20.0 111.166 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 78.5 p -64.8 -22.66 67.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.132 0.491 . . . . 20.0 110.083 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.538 ' O ' ' HB ' ' A' ' 79' ' ' VAL . 95.4 mt-10 -90.54 10.65 24.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.555 -0.748 . . . . 20.0 110.263 178.79 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.758 ' CB ' ' HB2' ' A' ' 81' ' ' SER . 1.7 t80 -121.36 -36.17 3.13 Favored 'General case' 0 C--O 1.208 -1.108 0 N-CA-C 112.468 0.544 . . . . 20.0 112.468 -178.077 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.826 ' O ' HD11 ' A' ' 58' ' ' LEU . 11.4 m -33.14 114.74 0.18 Allowed 'General case' 0 N--CA 1.482 1.145 0 O-C-N 121.23 -0.919 . . . . 20.0 112.459 -179.039 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.55 ' N ' ' H ' ' A' ' 81' ' ' SER . 0.6 OUTLIER -76.69 97.87 4.58 Favored 'General case' 0 C--N 1.351 0.654 0 CA-C-O 121.155 0.502 . . . . 20.0 110.245 -179.824 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.814 ' HB2' HD13 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -138.28 -151.55 0.39 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.44 -0.8 . . . . 20.0 110.786 -179.24 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -86.5 15.86 5.12 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.248 -0.433 . . . . 20.0 111.007 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.826 HD11 ' O ' ' A' ' 54' ' ' SER . 0.0 OUTLIER -81.07 157.16 25.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.476 0.655 . . . . 20.0 112.542 -179.163 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.401 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 3.0 m-70 -146.69 143.99 29.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.345 -0.843 . . . . 20.0 110.078 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.668 ' CZ ' HG11 ' A' ' 79' ' ' VAL . 17.8 m-30 -119.89 145.84 46.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.938 0.399 . . . . 20.0 111.355 -179.649 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 26.9 p -109.56 88.97 2.87 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.939 -0.573 . . . . 20.0 111.743 -179.608 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 1.063 ' O ' HG21 ' A' ' 75' ' ' VAL . 64.3 ttt-85 -119.94 122.37 41.07 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.445 -0.946 . . . . 20.0 108.445 177.847 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.695 ' O ' HD23 ' A' ' 64' ' ' LEU . 0.2 OUTLIER -105.22 -81.2 0.54 Allowed 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.779 0.659 . . . . 20.0 112.779 -177.538 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.695 HD23 ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -170.21 139.9 1.83 Allowed 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.566 -0.454 . . . . 20.0 111.828 -178.617 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.96 HG22 ' HG3' ' A' ' 70' ' ' ARG . 29.6 p -134.19 132.22 39.5 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.9 -0.591 . . . . 20.0 110.579 179.062 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.857 ' HB2' HD13 ' A' ' 121' ' ' LEU . 94.0 m-20 -141.98 -163.76 1.65 Allowed 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.946 -0.39 . . . . 20.0 109.946 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.812 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -28.47 144.41 0.01 OUTLIER Glycine 0 C--N 1.346 1.113 0 CA-C-O 118.736 -1.036 . . . . 20.0 110.633 179.567 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.551 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 50.1 Cg_exo -15.78 57.13 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.78 1 C-N-CA 125.373 4.049 . . . . 20.0 115.271 -178.53 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.812 ' N ' ' O ' ' A' ' 67' ' ' GLY . 81.5 m -164.98 164.16 20.67 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 108.625 -0.88 . . . . 20.0 108.625 178.4 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.96 ' HG3' HG22 ' A' ' 65' ' ' THR . 54.6 ttt180 -152.29 143.34 23.11 Favored 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 112.377 0.51 . . . . 20.0 112.377 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.984 ' HA ' HD12 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -86.06 161.48 18.91 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 115.718 -0.674 . . . . 20.0 110.844 179.156 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ALA . . . . . 0.548 ' HA ' ' CD2' ' A' ' 63' ' ' PHE . . . -140.64 29.29 1.94 Allowed 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 113.0 0.741 . . . . 20.0 113.0 -179.576 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.823 ' CB ' HG21 ' A' ' 119' ' ' VAL . 4.9 tmtm? -73.4 133.29 80.73 Favored Pre-proline 0 C--N 1.329 -0.316 0 C-N-CA 120.958 -0.297 . . . . 20.0 110.335 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' PRO . . . . . 0.474 ' HD2' ' HG2' ' A' ' 73' ' ' LYS . 50.7 Cg_exo -54.58 122.39 11.48 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.655 2.237 . . . . 20.0 112.356 -179.643 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 1.063 HG21 ' O ' ' A' ' 62' ' ' ARG . 5.1 m -135.54 159.57 40.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.852 -0.613 . . . . 20.0 111.167 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 38.8 m -118.57 128.78 54.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.083 0.468 . . . . 20.0 110.858 178.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.546 ' HB3' ' HB2' ' A' ' 60' ' ' TYR . 84.8 tt0 -131.54 139.2 49.19 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.642 -0.708 . . . . 20.0 110.031 179.314 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.833 ' N ' HD12 ' A' ' 78' ' ' LEU . 1.0 OUTLIER -111.37 144.32 40.75 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.307 0.575 . . . . 20.0 112.127 -179.05 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.706 HG22 ' CG ' ' A' ' 58' ' ' LEU . 0.7 OUTLIER -100.25 93.89 3.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 108.252 -1.018 . . . . 20.0 108.252 178.612 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.647 ' C ' ' O ' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -95.59 118.59 32.58 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.814 1.042 . . . . 20.0 113.814 -176.312 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.893 ' N ' ' HB2' ' A' ' 109' ' ' CYS . 8.3 t -161.45 95.69 1.03 Allowed 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.384 -0.825 . . . . 20.0 111.314 177.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.508 ' N ' ' SG ' ' A' ' 55' ' ' CYS . . . -159.09 -154.83 7.39 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.786 -0.721 . . . . 20.0 112.108 -179.805 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -120.97 160.14 24.13 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.748 0.309 . . . . 20.0 110.659 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -136.29 -41.73 0.64 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.33 -0.395 . . . . 20.0 111.055 -179.823 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -109.16 170.44 14.53 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.811 -0.709 . . . . 20.0 112.766 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -50.8 151.5 10.98 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.839 2.359 . . . . 20.0 112.425 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.678 ' HB1' ' HG3' ' A' ' 105' ' ' PRO . . . -83.01 14.03 3.61 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.001 -0.545 . . . . 20.0 111.553 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -67.62 133.45 49.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.846 0.355 . . . . 20.0 110.646 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.584 ' N ' HD22 ' A' ' 89' ' ' LEU . 1.3 mm? -97.27 129.93 44.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.259 -0.428 . . . . 20.0 110.933 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.5 mt -115.8 92.0 32.59 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.18 -0.464 . . . . 20.0 110.982 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.616 ' HA ' ' CZ2' ' A' ' 100' ' ' TRP . 76.1 Cg_exo -47.98 90.6 0.02 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.208 0 C-N-CA 122.562 2.175 . . . . 20.0 112.562 -179.72 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.591 ' ND2' HD11 ' A' ' 94' ' ' ILE . 63.3 t30 -140.35 68.88 1.35 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.19 -0.459 . . . . 20.0 110.991 179.57 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.628 ' HB2' ' HH2' ' A' ' 100' ' ' TRP . . . -66.6 -9.62 37.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.97 -0.559 . . . . 20.0 111.496 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 0.787 HG22 ' O ' ' A' ' 94' ' ' ILE . 9.7 mt 33.25 31.7 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.037 0.446 . . . . 20.0 111.236 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLY . . . . . 0.529 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 95.96 -41.39 2.44 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.839 -0.619 . . . . 20.0 112.535 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.517 ' HD2' ' HE3' ' A' ' 98' ' ' LYS . 61.3 ttm-85 -123.82 135.99 54.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.66 0.267 . . . . 20.0 111.109 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.566 HG11 ' HD3' ' A' ' 101' ' ' ARG . 17.6 t -110.85 128.46 67.23 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.729 0 CA-C-O 121.702 0.763 . . . . 20.0 110.368 179.141 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.517 ' HE3' ' HD2' ' A' ' 96' ' ' ARG . 1.0 OUTLIER -160.16 20.22 0.15 Allowed 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 114.428 -1.26 . . . . 20.0 111.086 -179.137 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 0.624 ' N ' ' CD1' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -150.07 -100.02 0.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.774 0.287 . . . . 20.0 111.774 -178.121 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 100' ' ' TRP . . . . . 0.628 ' HH2' ' HB2' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -60.04 175.22 0.42 Allowed 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.573 -0.285 . . . . 20.0 110.282 179.81 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ARG . . . . . 0.566 ' HD3' HG11 ' A' ' 97' ' ' VAL . 0.0 OUTLIER 155.55 150.07 0.0 OUTLIER Pre-proline 0 C--N 1.334 -0.097 0 CA-C-N 116.076 -0.511 . . . . 20.0 111.618 178.494 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.559 ' HD2' ' NE ' ' A' ' 101' ' ' ARG . 10.0 Cg_endo -52.45 -13.12 2.02 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 123.774 2.982 . . . . 20.0 113.481 -179.642 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -81.87 8.65 9.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.874 0.368 . . . . 20.0 110.946 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 127.12 149.73 7.29 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 121.081 -0.58 . . . . 20.0 112.423 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' PRO . . . . . 0.678 ' HG3' ' HB1' ' A' ' 87' ' ' ALA . 98.2 Cg_endo -83.45 133.72 6.36 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 122.96 2.44 . . . . 20.0 112.512 -179.762 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.478 ' O ' ' CD2' ' A' ' 107' ' ' PHE . 84.1 m-20 -84.9 130.44 34.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.12 0.486 . . . . 20.0 111.417 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.483 ' O ' ' O ' ' A' ' 82' ' ' GLY . 74.7 m-85 -162.15 26.54 0.11 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.62 -0.718 . . . . 20.0 110.065 179.233 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.532 ' O ' ' N ' ' A' ' 143' ' ' LYS . 97.2 mtt180 -45.69 162.96 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.403 -0.817 . . . . 20.0 111.938 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.893 ' HB2' ' N ' ' A' ' 81' ' ' SER . 15.2 m -95.34 106.3 18.34 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.976 -1.011 . . . . 20.0 109.526 178.565 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.723 HG23 ' O ' ' A' ' 143' ' ' LYS . 0.6 OUTLIER -108.08 149.04 38.63 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-O 121.314 0.578 . . . . 20.0 111.996 -179.677 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.976 ' CB ' HG11 ' A' ' 137' ' ' VAL . 19.9 Cg_endo -60.73 130.2 32.24 Favored 'Trans proline' 0 N--CA 1.466 -0.144 0 C-N-CA 122.974 2.45 . . . . 20.0 111.725 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -97.16 -68.58 0.79 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.803 0.335 . . . . 20.0 111.752 -179.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.447 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 35.1 ttm180 -122.97 147.47 46.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.284 -0.416 . . . . 20.0 110.909 -179.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.854 ' CE2' HG13 ' A' ' 137' ' ' VAL . 0.5 OUTLIER -120.73 155.93 32.89 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.404 0.621 . . . . 20.0 111.558 -179.456 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 48.3 ttm-85 -95.11 142.66 27.3 Favored 'General case' 0 N--CA 1.443 -0.785 0 N-CA-C 108.327 -0.99 . . . . 20.0 108.327 177.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -80.51 130.98 35.48 Favored 'General case' 0 C--N 1.315 -0.913 0 C-N-CA 120.662 -0.415 . . . . 20.0 111.365 -178.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.664 ' HB2' HG23 ' A' ' 134' ' ' VAL . 26.2 mm100 -131.58 127.64 37.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.054 -0.521 . . . . 20.0 111.122 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 80.1 mtm180 -129.38 96.06 4.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.068 -0.514 . . . . 20.0 110.358 179.079 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 0.823 HG21 ' CB ' ' A' ' 73' ' ' LYS . 59.5 t -122.1 144.54 31.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.544 -0.753 . . . . 20.0 110.934 -179.472 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.507 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 2.4 mp0 -82.13 121.48 26.65 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.812 -0.44 . . . . 20.0 109.812 179.621 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.857 HD13 ' HB2' ' A' ' 66' ' ' ASP . 0.2 OUTLIER -66.35 126.33 28.43 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.197 0.523 . . . . 20.0 110.649 -179.093 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.984 HD12 ' HA ' ' A' ' 71' ' ' SER . 0.9 OUTLIER -91.52 144.08 25.92 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.397 -0.82 . . . . 20.0 111.312 -178.742 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 123' ' ' CYS . . . . . 0.551 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -108.19 123.27 38.05 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 115.688 -0.687 . . . . 20.0 111.382 -179.663 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -67.34 103.18 0.76 Allowed 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.108 1.872 . . . . 20.0 110.763 178.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 78.46 29.75 51.79 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.457 -0.878 . . . . 20.0 111.35 -178.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' GLY . . . . . 0.537 ' O ' ' HB3' ' A' ' 123' ' ' CYS . . . -157.27 124.0 1.36 Allowed Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 111.632 -0.587 . . . . 20.0 111.632 -179.763 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.469 ' C ' ' HD3' ' A' ' 129' ' ' PRO . . . -88.29 43.33 1.12 Allowed 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 111.767 0.284 . . . . 20.0 111.767 -179.363 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -113.12 56.76 0.59 Allowed Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.968 0.413 . . . . 20.0 110.605 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' PRO . . . . . 0.469 ' HD3' ' C ' ' A' ' 127' ' ' ALA . 46.8 Cg_endo -68.2 151.18 77.07 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.934 2.423 . . . . 20.0 112.752 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.552 ' HB2' HD12 ' A' ' 121' ' ' LEU . 99.7 mtt180 -138.71 151.04 46.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.122 -0.49 . . . . 20.0 110.987 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 10.6 t -91.11 139.21 30.97 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.623 0.249 . . . . 20.0 110.954 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 132' ' ' ARG . . . . . 0.524 ' HD3' ' CB ' ' A' ' 64' ' ' LEU . 54.6 ttt85 -146.23 143.77 29.44 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.082 0.467 . . . . 20.0 112.086 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.475 ' HA ' ' O ' ' A' ' 117' ' ' GLN . 25.4 pttm -104.42 142.08 35.22 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.589 -0.732 . . . . 20.0 110.006 178.747 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.664 HG23 ' HB2' ' A' ' 117' ' ' GLN . 1.8 m -147.58 128.65 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-O 121.276 0.56 . . . . 20.0 110.97 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.541 ' HB3' ' HB2' ' A' ' 114' ' ' TYR . 91.2 mtt-85 -89.62 110.99 21.81 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.282 -0.872 . . . . 20.0 110.315 179.54 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.587 ' CD2' ' N ' ' A' ' 136' ' ' LEU . 0.2 OUTLIER -107.86 127.24 53.55 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.873 0.368 . . . . 20.0 111.067 -179.811 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.976 HG11 ' CB ' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -63.05 88.73 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.816 0.341 . . . . 20.0 111.666 -179.941 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.68 -23.88 66.39 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.25 0.548 . . . . 20.0 109.602 179.07 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 37.0 t -155.21 126.39 7.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.342 -0.844 . . . . 20.0 111.325 179.483 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 140' ' ' CYS . . . . . . . . . . . . . 26.5 p -131.23 164.14 26.22 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.386 -0.37 . . . . 20.0 110.619 179.215 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 141' ' ' LYS . . . . . 0.436 ' HG2' ' N ' ' A' ' 142' ' ' CYS . 75.3 tttt -141.54 162.14 36.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.273 -0.421 . . . . 20.0 111.495 -179.576 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 142' ' ' CYS . . . . . 0.863 ' HA ' ' HA ' ' A' ' 109' ' ' CYS . 0.5 OUTLIER -60.44 106.17 0.51 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.986 -0.552 . . . . 20.0 109.856 179.61 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.723 ' O ' HG23 ' A' ' 110' ' ' ILE . 69.6 mmtt -132.93 141.14 48.2 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 113.261 0.837 . . . . 20.0 113.261 -179.055 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.438 ' CD ' ' HB3' ' A' ' 143' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.268 -0.872 . . . . 20.0 111.068 179.201 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 93.4 mttt . . . . . 0 N--CA 1.487 1.411 0 CA-C-O 120.699 0.285 . . . . 20.0 110.65 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -89.26 17.75 5.77 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.495 -0.321 . . . . 20.0 111.668 -179.093 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.583 HG13 ' CB ' ' A' ' 81' ' ' SER . 92.7 t -71.8 -11.22 14.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 120.779 -0.368 . . . . 20.0 111.14 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 72.6 m -59.76 -33.93 72.32 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.152 0.501 . . . . 20.0 109.748 179.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.564 ' O ' ' CG2' ' A' ' 79' ' ' VAL . 96.9 mt-10 -86.29 13.28 8.31 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.381 -0.827 . . . . 20.0 110.647 179.327 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.864 ' O ' ' N ' ' A' ' 81' ' ' SER . 0.3 OUTLIER -128.48 30.32 5.17 Favored 'General case' 0 C--O 1.194 -1.829 0 CA-C-N 116.062 -0.517 . . . . 20.0 111.798 -178.75 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.473 ' C ' ' HA ' ' A' ' 80' ' ' CYS . 2.1 m -70.52 131.44 44.01 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 119.973 1.26 . . . . 20.0 112.68 -178.029 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.551 ' HA ' ' CB ' ' A' ' 80' ' ' CYS . 3.9 m -71.03 -29.04 64.85 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 109.673 -0.491 . . . . 20.0 109.673 178.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.47 ' CG ' ' HB3' ' A' ' 54' ' ' SER . 0.0 OUTLIER -26.77 -85.21 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.982 -0.554 . . . . 20.0 111.816 -179.435 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 36.8 tp10 -171.56 62.66 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.675 -0.693 . . . . 20.0 109.975 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.96 HD22 HG22 ' A' ' 79' ' ' VAL . 6.8 tt -100.23 140.2 34.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.987 -0.551 . . . . 20.0 111.871 -179.393 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.753 ' N ' HD23 ' A' ' 58' ' ' LEU . 86.9 m-70 -132.27 139.04 48.1 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.797 -0.638 . . . . 20.0 111.085 179.758 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.927 ' CE1' HD21 ' A' ' 58' ' ' LEU . 10.2 m-30 -115.51 152.53 32.82 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.974 0.416 . . . . 20.0 111.765 -179.769 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 58.6 p -102.53 79.68 1.84 Allowed 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.9 -0.591 . . . . 20.0 111.198 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.911 ' O ' HG21 ' A' ' 75' ' ' VAL . 16.1 tpt180 -118.32 120.27 37.13 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 108.712 -0.847 . . . . 20.0 108.712 178.197 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.636 ' C ' HD23 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -109.08 -79.44 0.58 Allowed 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 112.663 0.616 . . . . 20.0 112.663 -177.786 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 1.002 HD11 HG23 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -168.29 137.75 2.44 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.699 -0.4 . . . . 20.0 111.869 -178.063 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.693 HG22 ' HG3' ' A' ' 70' ' ' ARG . 19.3 p -129.45 149.12 51.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.852 0.358 . . . . 20.0 110.263 178.425 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.506 ' O ' ' C ' ' A' ' 67' ' ' GLY . 24.7 t0 -154.45 -165.51 2.09 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.396 -0.594 . . . . 20.0 109.396 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.847 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -32.29 147.55 0.01 OUTLIER Glycine 0 C--N 1.345 1.082 0 N-CA-C 109.879 -1.289 . . . . 20.0 109.879 178.927 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.502 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 25.3 Cg_exo -15.95 55.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 125.138 3.892 . . . . 20.0 115.29 -178.496 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.847 ' N ' ' O ' ' A' ' 67' ' ' GLY . 33.3 m -162.23 162.41 28.21 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 123.492 0.717 . . . . 20.0 109.121 178.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.693 ' HG3' HG22 ' A' ' 65' ' ' THR . 75.7 ttt180 -158.41 144.58 17.11 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.079 0.466 . . . . 20.0 111.988 179.768 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' SER . . . . . 0.644 ' HB3' HD12 ' A' ' 64' ' ' LEU . 1.0 OUTLIER -83.05 172.37 12.8 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 115.59 -0.732 . . . . 20.0 110.819 179.287 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -152.87 36.51 0.49 Allowed 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.26 -0.576 . . . . 20.0 112.422 178.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.652 ' CB ' HG11 ' A' ' 119' ' ' VAL . 30.3 mmtt -79.89 163.68 56.88 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.405 -0.361 . . . . 20.0 110.637 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -63.51 116.07 3.42 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.601 2.201 . . . . 20.0 112.505 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' VAL . . . . . 0.911 HG21 ' O ' ' A' ' 62' ' ' ARG . 4.4 m -140.07 136.52 37.99 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 CA-C-N 116.573 -0.285 . . . . 20.0 111.101 179.332 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.446 HG23 ' HB3' ' A' ' 59' ' ' HIS . 54.6 m -126.49 123.29 37.48 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 120.918 0.389 . . . . 20.0 112.031 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.57 ' CG ' ' HB2' ' A' ' 60' ' ' TYR . 20.0 pt-20 -131.17 148.64 52.74 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.034 -0.53 . . . . 20.0 109.677 178.876 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LEU . . . . . 0.568 ' N ' HD12 ' A' ' 78' ' ' LEU . 6.5 mp -101.07 158.36 16.07 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 113.575 0.954 . . . . 20.0 113.575 -178.687 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' VAL . . . . . 0.96 HG22 HD22 ' A' ' 58' ' ' LEU . 1.4 m -135.06 84.01 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 CA-C-N 113.903 -1.499 . . . . 20.0 109.162 178.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.628 ' C ' ' HB2' ' A' ' 109' ' ' CYS . 3.2 p -98.65 137.3 37.48 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.511 0.93 . . . . 20.0 113.511 -177.15 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.864 ' N ' ' O ' ' A' ' 53' ' ' TYR . 40.3 t -151.05 108.18 3.58 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.808 0.843 . . . . 20.0 110.041 178.624 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLY . . . . . 0.473 ' O ' ' HA ' ' A' ' 108' ' ' ARG . . . -163.13 -151.61 6.48 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.663 -0.78 . . . . 20.0 112.374 -179.089 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.415 ' C ' ' SG ' ' A' ' 142' ' ' CYS . 58.3 tt0 -108.15 141.49 39.79 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.627 -0.509 . . . . 20.0 109.627 179.207 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' CYS . . . . . 0.445 ' SG ' ' O ' ' A' ' 142' ' ' CYS . 4.5 m -100.7 153.61 19.3 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.575 -0.284 . . . . 20.0 110.605 -179.399 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLY . . . . . 0.425 ' N ' ' CD ' ' A' ' 86' ' ' PRO . . . -54.23 -49.53 59.44 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 120.989 -0.624 . . . . 20.0 113.254 -179.147 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' PRO . . . . . 0.425 ' CD ' ' N ' ' A' ' 85' ' ' GLY . 51.8 Cg_exo -56.55 127.41 25.82 Favored 'Trans proline' 0 N--CA 1.473 0.284 0 C-N-CA 122.818 2.345 . . . . 20.0 112.755 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -113.08 25.16 11.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.127 -0.488 . . . . 20.0 111.989 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -67.08 124.44 23.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.073 0.463 . . . . 20.0 110.699 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.515 HD13 ' O ' ' A' ' 103' ' ' ASN . 10.7 mt -111.88 107.37 16.38 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.86 -0.609 . . . . 20.0 110.845 -179.415 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -115.18 119.25 38.94 Favored Pre-proline 0 C--N 1.327 -0.395 0 N-CA-C 112.123 0.416 . . . . 20.0 112.123 -179.526 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' PRO . . . . . 0.616 ' HB2' ' CD2' ' A' ' 100' ' ' TRP . 44.0 Cg_endo -65.99 131.0 25.8 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.743 2.295 . . . . 20.0 111.306 178.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ASN . . . . . 0.599 ' O ' ' CH2' ' A' ' 99' ' ' TRP . 48.9 m-20 -101.16 146.81 27.01 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 113.303 0.853 . . . . 20.0 113.303 -178.276 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ALA . . . . . 0.727 ' HA ' ' CZ3' ' A' ' 100' ' ' TRP . . . -74.06 -20.7 60.2 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.298 -0.864 . . . . 20.0 112.68 179.478 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ILE . . . . . 1.024 HD12 ' CH2' ' A' ' 99' ' ' TRP . 58.0 mt 30.55 33.85 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 121.116 0.484 . . . . 20.0 111.395 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLY . . . . . 0.565 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 97.63 -48.69 1.49 Allowed Glycine 0 CA--C 1.519 0.288 0 CA-C-N 115.721 -0.672 . . . . 20.0 112.203 -179.618 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ARG . . . . . 0.595 ' O ' ' CZ2' ' A' ' 99' ' ' TRP . 50.8 mtp85 -117.98 142.22 47.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.51 0.195 . . . . 20.0 110.518 179.396 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' VAL . . . . . 0.953 HG13 ' CZ3' ' A' ' 100' ' ' TRP . 10.8 t -123.48 133.97 67.65 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.924 0 CA-C-O 121.68 0.752 . . . . 20.0 110.91 178.842 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.452 ' CB ' ' O ' ' A' ' 97' ' ' VAL . 0.2 OUTLIER 161.27 -30.45 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 114.498 -1.228 . . . . 20.0 108.671 -178.988 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 99' ' ' TRP . . . . . 1.024 ' CH2' HD12 ' A' ' 94' ' ' ILE . 31.1 p-90 -96.54 22.05 8.49 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 113.324 -1.762 . . . . 20.0 109.408 179.723 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' TRP . . . . . 0.953 ' CZ3' HG13 ' A' ' 97' ' ' VAL . 0.0 OUTLIER -28.79 136.93 0.02 OUTLIER 'General case' 0 CA--C 1.497 -1.067 0 CA-C-O 121.908 0.861 . . . . 20.0 113.179 -177.317 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 11.2 mtp180 -124.78 80.71 62.2 Favored Pre-proline 0 N--CA 1.437 -1.095 0 CA-C-N 114.028 -1.442 . . . . 20.0 111.07 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.452 ' O ' ' CB ' ' A' ' 89' ' ' LEU . 26.5 Cg_endo -64.15 -4.11 7.2 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 122.804 2.336 . . . . 20.0 112.153 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ASN . . . . . 0.515 ' O ' HD13 ' A' ' 89' ' ' LEU . 34.8 m120 -54.76 -32.63 60.19 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.071 0.462 . . . . 20.0 110.069 179.239 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 107.58 151.75 17.17 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.823 -0.703 . . . . 20.0 112.677 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -69.86 167.35 24.82 Favored 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 122.905 2.403 . . . . 20.0 112.003 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.468 ' O ' ' O ' ' A' ' 144' ' ' ARG . 62.4 t0 -74.46 128.35 35.33 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.32 -0.4 . . . . 20.0 110.979 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 107' ' ' PHE . . . . . 0.406 ' HA ' ' HB3' ' A' ' 144' ' ' ARG . 97.4 m-85 -112.41 155.86 23.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.943 0.402 . . . . 20.0 111.231 -179.859 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ARG . . . . . 0.544 ' N ' ' HB3' ' A' ' 144' ' ' ARG . 57.6 ttp180 -173.03 174.13 3.54 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.041 -0.527 . . . . 20.0 110.673 -179.408 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.823 ' HA ' ' HA ' ' A' ' 142' ' ' CYS . 4.5 m -85.35 138.5 32.25 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.822 -0.172 . . . . 20.0 110.857 179.561 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ILE . . . . . 0.793 HG22 ' OH ' ' A' ' 53' ' ' TYR . 2.7 pp -147.56 154.64 45.01 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.316 0.579 . . . . 20.0 112.149 178.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' PRO . . . . . 0.921 ' CB ' HG11 ' A' ' 137' ' ' VAL . 16.6 Cg_endo -56.45 143.1 88.45 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 123.341 2.694 . . . . 20.0 112.028 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 67.5 t0 -126.59 -57.43 1.36 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.403 -0.362 . . . . 20.0 111.686 -179.291 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ARG . . . . . 0.521 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 48.0 ttt180 -121.38 150.16 41.89 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.298 -0.41 . . . . 20.0 111.072 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' TYR . . . . . 0.816 ' CE2' HG13 ' A' ' 137' ' ' VAL . 0.5 OUTLIER -125.48 160.77 28.67 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.702 0.763 . . . . 20.0 112.629 -179.289 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 42.9 ttm-85 -97.84 140.4 32.26 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 114.539 -1.21 . . . . 20.0 107.907 176.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -80.51 130.66 35.28 Favored 'General case' 0 C--N 1.313 -0.988 0 C-N-CA 120.683 -0.407 . . . . 20.0 111.633 -178.39 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 22.5 mm100 -133.79 136.62 44.62 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.09 -0.504 . . . . 20.0 110.807 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 50.1 ttt180 -134.02 94.71 3.3 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.996 -0.547 . . . . 20.0 110.189 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' VAL . . . . . 1.002 HG23 HD11 ' A' ' 64' ' ' LEU . 9.1 m -131.61 162.19 39.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.861 -0.608 . . . . 20.0 110.859 -179.402 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' GLN . . . . . 0.567 ' HA ' ' HA ' ' A' ' 131' ' ' SER . 7.2 pt20 -99.86 143.46 30.05 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.286 -0.415 . . . . 20.0 112.017 -179.121 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.783 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -79.51 131.52 36.06 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.85 -0.614 . . . . 20.0 110.049 179.456 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 122' ' ' LEU . . . . . 0.642 ' N ' HD12 ' A' ' 122' ' ' LEU . 3.5 mp -97.22 140.76 31.23 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.774 -0.648 . . . . 20.0 111.942 -178.611 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' CYS . . . . . 0.502 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -118.59 152.34 51.05 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.176 -0.92 . . . . 20.0 109.837 179.313 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 124' ' ' PRO . . . . . 0.452 ' HD2' ' SG ' ' A' ' 123' ' ' CYS . 82.0 Cg_exo -47.73 109.78 0.26 Allowed 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 121.603 1.535 . . . . 20.0 111.044 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 125' ' ' GLY . . . . . 0.424 ' O ' ' C ' ' A' ' 126' ' ' GLY . . . 95.56 3.6 61.07 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.89 -0.672 . . . . 20.0 112.202 -178.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' GLY . . . . . 0.424 ' C ' ' O ' ' A' ' 125' ' ' GLY . . . 36.47 63.29 0.7 Allowed Glycine 0 C--N 1.335 0.481 0 C-N-CA 120.685 -0.769 . . . . 20.0 111.788 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -97.41 -53.08 3.57 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 111.849 0.314 . . . . 20.0 111.849 -179.015 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -122.2 59.14 10.88 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 120.939 0.4 . . . . 20.0 111.741 -179.203 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -55.75 149.18 51.4 Favored 'Trans proline' 0 CA--C 1.528 0.203 0 C-N-CA 122.981 2.454 . . . . 20.0 111.945 179.229 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' ARG . . . . . 0.783 ' HB2' HD12 ' A' ' 121' ' ' LEU . 95.9 mtt-85 -130.49 155.57 46.24 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.358 -0.383 . . . . 20.0 110.822 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' SER . . . . . 0.567 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 66.6 m -109.04 133.91 52.36 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.898 0.38 . . . . 20.0 111.936 -179.606 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' ARG . . . . . 0.462 ' HD2' ' HB2' ' A' ' 64' ' ' LEU . 15.8 ttm180 -140.96 142.44 34.33 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.045 -0.525 . . . . 20.0 111.879 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -100.15 146.51 26.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.596 -0.729 . . . . 20.0 109.155 178.363 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' VAL . . . . . 0.528 HG21 ' O ' ' A' ' 63' ' ' PHE . 0.4 OUTLIER -153.03 133.3 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-O 121.385 0.612 . . . . 20.0 112.398 -178.576 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 135' ' ' ARG . . . . . 0.489 ' C ' HD23 ' A' ' 136' ' ' LEU . 62.1 mtp85 -91.37 113.06 25.23 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.823 -1.081 . . . . 20.0 109.89 178.475 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.768 HD12 ' HB ' ' A' ' 75' ' ' VAL . 7.6 mt -112.38 130.02 56.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.971 0.415 . . . . 20.0 111.927 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 137' ' ' VAL . . . . . 0.921 HG11 ' CB ' ' A' ' 111' ' ' PRO . 0.2 OUTLIER -64.61 94.58 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 112.401 0.519 . . . . 20.0 112.401 -179.407 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -80.27 -7.07 58.85 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-O 121.158 0.504 . . . . 20.0 109.74 178.329 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 20.1 t -163.29 129.78 3.33 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 115.405 -0.816 . . . . 20.0 109.919 179.13 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 140' ' ' CYS . . . . . 0.481 ' HB3' ' HA ' ' A' ' 111' ' ' PRO . 25.5 p -129.4 165.74 20.95 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.028 0.442 . . . . 20.0 111.49 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 36.1 mttt -123.02 154.4 38.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.718 -0.673 . . . . 20.0 110.032 179.617 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' CYS . . . . . 0.823 ' HA ' ' HA ' ' A' ' 109' ' ' CYS . 53.4 t -66.21 103.82 1.06 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.724 -0.473 . . . . 20.0 109.724 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 143' ' ' LYS . . . . . 0.599 ' HB3' HG13 ' A' ' 110' ' ' ILE . 20.5 tptt -147.16 136.66 22.79 Favored 'General case' 0 N--CA 1.461 0.097 0 C-N-CA 118.762 -1.175 . . . . 20.0 113.376 -178.676 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 144' ' ' ARG . . . . . 0.544 ' HB3' ' N ' ' A' ' 108' ' ' ARG . 11.7 tpt180 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.258 -0.877 . . . . 20.0 110.616 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . 0.427 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 30.4 m170 . . . . . 0 N--CA 1.461 0.112 0 N-CA-C 111.854 0.316 . . . . 20.0 111.854 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.59 ' CZ ' HG11 ' A' ' 79' ' ' VAL . 0.8 OUTLIER -126.15 166.28 17.34 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.125 -0.488 . . . . 20.0 111.143 179.793 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.95 79.67 1.54 Allowed 'General case' 0 C--O 1.231 0.121 0 CA-C-O 120.999 0.428 . . . . 20.0 111.716 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.947 ' O ' HG21 ' A' ' 75' ' ' VAL . 53.0 mtm180 -124.7 124.29 41.86 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.154 -1.054 . . . . 20.0 108.154 177.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.656 ' CD1' HG22 ' A' ' 75' ' ' VAL . 0.1 OUTLIER -109.53 -79.08 0.58 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 113.007 0.743 . . . . 20.0 113.007 -177.368 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.943 HD21 ' HB ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -170.72 136.74 1.23 Allowed 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.277 -0.569 . . . . 20.0 112.435 -178.128 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.974 HG22 ' HG3' ' A' ' 70' ' ' ARG . 16.8 p -132.96 132.06 41.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.06 -0.518 . . . . 20.0 110.295 178.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.598 ' HB2' HD13 ' A' ' 121' ' ' LEU . 91.7 m-20 -140.27 -163.68 1.57 Allowed 'General case' 0 C--O 1.237 0.44 0 N-CA-C 110.074 -0.343 . . . . 20.0 110.074 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.837 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -29.86 146.2 0.01 OUTLIER Glycine 0 C--N 1.345 1.036 0 CA-C-O 118.597 -1.113 . . . . 20.0 110.622 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.492 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 39.6 Cg_exo -15.11 56.23 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 125.292 3.995 . . . . 20.0 115.183 -178.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.837 ' N ' ' O ' ' A' ' 67' ' ' GLY . 39.8 m -163.84 163.68 23.76 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 108.453 -0.943 . . . . 20.0 108.453 178.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.974 ' HG3' HG22 ' A' ' 65' ' ' THR . 58.0 ttp180 -154.64 145.88 22.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.112 0.482 . . . . 20.0 111.84 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 1.002 ' HA ' HD12 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -89.27 160.54 16.86 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.751 -0.659 . . . . 20.0 110.465 179.075 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.465 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . . . -147.66 28.36 0.96 Allowed 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.177 0.806 . . . . 20.0 113.177 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.651 ' HB3' HG21 ' A' ' 119' ' ' VAL . 1.5 tttt -79.33 143.2 59.71 Favored Pre-proline 0 C--N 1.326 -0.436 0 N-CA-C 110.017 -0.364 . . . . 20.0 110.017 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.506 ' HD2' ' HG3' ' A' ' 73' ' ' LYS . 76.9 Cg_exo -51.28 122.29 9.85 Favored 'Trans proline' 0 C--O 1.232 0.225 0 C-N-CA 122.758 2.306 . . . . 20.0 113.024 -178.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.947 HG21 ' O ' ' A' ' 62' ' ' ARG . 20.0 m -136.72 145.5 30.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 115.791 -0.641 . . . . 20.0 110.97 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 41.7 m -119.14 128.52 54.35 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.919 0.39 . . . . 20.0 110.307 178.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.688 ' OE1' HD12 ' A' ' 136' ' ' LEU . 20.3 pt-20 -143.32 150.32 39.02 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.894 -0.594 . . . . 20.0 110.252 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.593 HD12 ' N ' ' A' ' 78' ' ' LEU . 6.0 mp -100.91 140.99 34.42 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 121.174 0.511 . . . . 20.0 111.076 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.797 HG23 ' O ' ' A' ' 79' ' ' VAL . 10.7 m . . . . . 0 N--CA 1.441 -0.91 0 CA-C-N 115.423 -0.808 . . . . 20.0 109.842 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 93.3 m-20 . . . . . 0 C--O 1.231 0.115 0 N-CA-C 112.018 0.377 . . . . 20.0 112.018 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . 0.402 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 25.3 ttm180 -121.2 147.84 45.06 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.354 -0.384 . . . . 20.0 110.832 -179.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.913 ' CE2' HG13 ' A' ' 137' ' ' VAL . 1.0 OUTLIER -119.65 160.8 21.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.174 0.511 . . . . 20.0 111.441 -179.114 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.641 ' HB2' ' HB2' ' A' ' 138' ' ' ALA . 50.9 ttm-85 -96.93 147.18 24.24 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.882 -0.784 . . . . 20.0 108.882 178.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . 0.417 ' O ' ' NE2' ' A' ' 117' ' ' GLN . . . -82.91 134.24 35.08 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.076 0.465 . . . . 20.0 111.938 -178.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.708 ' HG2' HD23 ' A' ' 136' ' ' LEU . 75.6 mm-40 -133.94 120.53 20.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.54 -0.755 . . . . 20.0 110.032 179.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 71.9 ttp85 -118.04 98.61 6.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.924 0.392 . . . . 20.0 110.663 179.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.943 ' HB ' HD21 ' A' ' 64' ' ' LEU . 92.2 t -131.14 145.06 35.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.902 -0.59 . . . . 20.0 111.3 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.557 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 24.4 mp0 -91.53 140.92 29.28 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.751 0.31 . . . . 20.0 110.518 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.884 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.0 OUTLIER -79.4 129.72 34.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.196 0.522 . . . . 20.0 110.801 -179.835 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 1.002 HD12 ' HA ' ' A' ' 71' ' ' SER . 1.5 mp -95.12 138.46 32.8 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.551 -0.75 . . . . 20.0 111.524 -179.048 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . 0.492 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER . . . . . 0 C--N 1.323 -0.585 0 CA-C-N 115.403 -0.817 . . . . 20.0 109.877 179.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.115 0 N-CA-C 112.271 0.471 . . . . 20.0 112.271 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -123.19 56.03 8.72 Favored Pre-proline 0 C--N 1.33 -0.242 0 N-CA-C 112.219 0.451 . . . . 20.0 112.219 -179.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.68 143.81 47.43 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.639 2.226 . . . . 20.0 112.081 179.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.884 ' HB2' HD12 ' A' ' 121' ' ' LEU . 67.5 mtt85 -132.02 153.38 50.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.379 -0.373 . . . . 20.0 110.623 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.456 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 43.9 t -98.84 133.72 42.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.801 0.334 . . . . 20.0 111.128 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . 0.479 ' HB3' HD13 ' A' ' 64' ' ' LEU . 74.5 ttt-85 -139.1 142.99 38.08 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.188 0.518 . . . . 20.0 111.761 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 3.6 pttm -96.09 146.07 24.96 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.445 -0.798 . . . . 20.0 110.259 179.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.556 ' HB ' HD21 ' A' ' 136' ' ' LEU . 0.0 OUTLIER -145.16 121.59 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 CA-C-O 121.287 0.565 . . . . 20.0 111.794 -179.415 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . 0.745 ' C ' HD22 ' A' ' 136' ' ' LEU . 86.1 mtt-85 -92.1 118.6 30.97 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.349 -0.842 . . . . 20.0 110.09 178.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.745 HD22 ' C ' ' A' ' 135' ' ' ARG . 1.0 OUTLIER -114.35 120.2 39.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.01 0.433 . . . . 20.0 112.087 -179.252 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.913 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -51.28 84.54 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.269 -0.423 . . . . 20.0 111.455 179.811 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.641 ' HB2' ' HB2' ' A' ' 115' ' ' ARG . . . -75.5 -6.44 50.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.009 0.433 . . . . 20.0 110.193 179.101 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 17.3 t . . . . . 0 C--N 1.332 -0.162 0 CA-C-N 115.82 -0.627 . . . . 20.0 110.517 179.245 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 7.5 m170 . . . . . 0 C--O 1.232 0.138 0 CA-C-O 120.911 0.386 . . . . 20.0 111.243 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.631 ' CD1' HG13 ' A' ' 79' ' ' VAL . 12.7 m-85 -129.25 148.63 51.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.083 -0.508 . . . . 20.0 111.639 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.418 ' OG1' ' CZ ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -103.86 87.15 2.73 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.038 0.447 . . . . 20.0 111.091 -179.819 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.949 ' O ' HG21 ' A' ' 75' ' ' VAL . 60.7 ttm-85 -122.37 124.96 44.89 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.572 -0.899 . . . . 20.0 108.572 178.544 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.685 ' O ' HG21 ' A' ' 134' ' ' VAL . 0.1 OUTLIER -111.18 -83.39 0.57 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.98 0.733 . . . . 20.0 112.98 -177.606 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 1.008 HD11 HG13 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -169.17 141.77 2.64 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 120.575 -0.45 . . . . 20.0 112.04 -178.405 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.784 HG22 ' HG3' ' A' ' 70' ' ' ARG . 31.0 p -136.4 131.62 34.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.101 -0.5 . . . . 20.0 110.806 178.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.652 ' HB2' HD13 ' A' ' 121' ' ' LEU . 93.4 m-20 -140.72 -162.13 1.31 Allowed 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.547 -0.538 . . . . 20.0 109.547 179.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.814 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -29.65 144.34 0.01 OUTLIER Glycine 0 C--N 1.347 1.183 0 CA-C-O 118.494 -1.17 . . . . 20.0 110.277 179.441 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.515 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 56.9 Cg_exo -16.57 58.53 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 125.071 3.848 . . . . 20.0 114.864 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.814 ' N ' ' O ' ' A' ' 67' ' ' GLY . 20.7 m -162.58 159.12 24.29 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 108.956 -0.757 . . . . 20.0 108.956 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.784 ' HG3' HG22 ' A' ' 65' ' ' THR . 79.3 ttt180 -149.97 141.29 23.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.218 0.532 . . . . 20.0 112.068 179.714 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.599 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -84.54 162.69 19.75 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.446 -0.797 . . . . 20.0 110.393 179.004 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -147.34 28.3 0.99 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.415 0.894 . . . . 20.0 113.415 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.907 ' HB2' HG21 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -75.76 141.97 72.85 Favored Pre-proline 0 C--N 1.327 -0.379 0 C-N-CA 120.54 -0.464 . . . . 20.0 110.27 179.249 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -50.63 122.51 9.76 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.706 2.27 . . . . 20.0 112.619 -179.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.949 HG21 ' O ' ' A' ' 62' ' ' ARG . 17.3 m -137.27 151.08 26.38 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 CA-C-N 116.202 -0.454 . . . . 20.0 111.891 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 88.1 m -111.73 124.24 51.92 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.069 -0.715 . . . . 20.0 109.069 177.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.64 ' C ' HD12 ' A' ' 78' ' ' LEU . 84.8 tt0 -125.31 133.1 52.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.192 0.52 . . . . 20.0 112.085 -179.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.733 HD12 ' N ' ' A' ' 78' ' ' LEU . 3.8 mp -108.06 138.29 44.58 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.534 -0.757 . . . . 20.0 109.405 178.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.634 HG23 ' O ' ' A' ' 79' ' ' VAL . 35.0 m . . . . . 0 C--N 1.317 -0.805 0 CA-C-O 121.481 0.657 . . . . 20.0 111.184 -178.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 . . . . . 0 CA--C 1.529 0.152 0 N-CA-C 112.989 0.737 . . . . 20.0 112.989 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . 0.496 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 41.0 ttm180 -119.82 149.05 42.69 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.245 0.461 . . . . 20.0 112.245 -178.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 1.021 ' CE2' HG13 ' A' ' 137' ' ' VAL . 1.3 m-85 -124.01 159.01 30.79 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.551 -0.75 . . . . 20.0 111.602 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.513 ' HD2' ' NE2' ' A' ' 117' ' ' GLN . 43.9 ttm-85 -95.43 148.31 22.61 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.467 -0.938 . . . . 20.0 108.467 177.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -83.33 137.94 33.75 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.137 0.494 . . . . 20.0 111.421 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.513 ' NE2' ' HD2' ' A' ' 115' ' ' ARG . 95.6 mm-40 -137.18 109.81 7.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.811 -0.632 . . . . 20.0 110.867 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.482 ' HA ' ' O ' ' A' ' 132' ' ' ARG . 93.8 mtt180 -125.42 98.25 5.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.059 -0.519 . . . . 20.0 110.739 179.394 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 1.008 HG13 HD11 ' A' ' 64' ' ' LEU . 14.7 p -133.72 152.12 34.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.877 -0.601 . . . . 20.0 110.857 -179.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.52 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 27.1 mp0 -77.92 135.73 37.9 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.932 0.396 . . . . 20.0 111.493 -179.234 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.889 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.2 OUTLIER -79.22 127.71 32.39 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.345 -0.613 . . . . 20.0 109.345 179.103 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.62 131.86 34.56 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.861 -0.608 . . . . 20.0 111.446 -178.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . 0.597 ' CB ' ' HB3' ' A' ' 128' ' ' ALA . 0.5 OUTLIER . . . . . 0 C--N 1.323 -0.547 0 CA-C-N 115.438 -0.801 . . . . 20.0 109.881 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.233 0.186 0 N-CA-C 112.384 0.512 . . . . 20.0 112.384 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.597 ' HB3' ' CB ' ' A' ' 123' ' ' CYS . . . -129.63 56.26 23.21 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 112.388 0.514 . . . . 20.0 112.388 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . 0.518 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 62.3 Cg_endo -73.74 136.32 23.02 Favored 'Trans proline' 0 CA--C 1.528 0.182 0 C-N-CA 122.529 2.153 . . . . 20.0 112.055 179.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.889 ' HB2' HD12 ' A' ' 121' ' ' LEU . 89.1 mtt180 -140.27 133.94 30.32 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.62 0.248 . . . . 20.0 111.271 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.417 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 23.3 t -85.51 136.71 33.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.952 0.406 . . . . 20.0 111.657 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . 0.691 HH12 HG13 ' A' ' 134' ' ' VAL . 56.6 ttt-85 -140.52 143.54 35.46 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.803 -0.635 . . . . 20.0 111.26 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.452 ' HA ' ' O ' ' A' ' 117' ' ' GLN . 19.7 pttp -100.93 144.61 29.66 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.09 -0.504 . . . . 20.0 110.66 179.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.691 HG13 HH12 ' A' ' 132' ' ' ARG . 0.0 OUTLIER -147.99 123.17 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 120.946 0.403 . . . . 20.0 111.721 -179.618 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . 0.596 ' O ' HD23 ' A' ' 136' ' ' LEU . 90.5 mtm-85 -90.85 110.89 22.11 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.855 -0.612 . . . . 20.0 110.213 178.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.61 ' N ' ' HB3' ' A' ' 114' ' ' TYR . 5.0 mt -114.04 126.85 55.58 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.255 0.55 . . . . 20.0 112.047 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 1.021 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.2 OUTLIER -57.83 83.22 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.569 -0.741 . . . . 20.0 111.405 -179.704 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.491 ' HB1' HH21 ' A' ' 115' ' ' ARG . . . -72.95 -6.98 48.94 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.053 0.454 . . . . 20.0 110.428 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 47.2 t . . . . . 0 C--N 1.331 -0.209 0 CA-C-N 115.787 -0.642 . . . . 20.0 110.169 179.171 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . 0.441 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 25.8 m170 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.895 0.379 . . . . 20.0 110.792 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.89 ' CD1' HG13 ' A' ' 79' ' ' VAL . 14.9 m-85 -128.16 156.14 43.35 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.027 -0.533 . . . . 20.0 111.589 -179.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 40.1 p -111.05 88.41 2.78 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 112.325 0.491 . . . . 20.0 112.325 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.797 ' O ' HG21 ' A' ' 75' ' ' VAL . 51.4 mtm180 -117.33 123.36 46.32 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.291 -1.003 . . . . 20.0 108.291 177.151 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.907 ' O ' HD23 ' A' ' 64' ' ' LEU . 1.7 m-85 -103.21 -79.29 0.54 Allowed 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 112.34 0.496 . . . . 20.0 112.34 -177.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.907 HD23 ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -177.46 142.16 0.32 Allowed 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.581 -0.448 . . . . 20.0 111.44 -178.76 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.733 HG22 ' HG3' ' A' ' 70' ' ' ARG . 30.0 p -138.9 132.71 30.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.058 -0.519 . . . . 20.0 110.081 178.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.558 ' O ' ' C ' ' A' ' 67' ' ' GLY . 5.1 t0 -150.29 -155.71 0.65 Allowed 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.701 -0.227 . . . . 20.0 110.397 -179.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.789 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -26.38 137.77 0.01 OUTLIER Glycine 0 C--N 1.347 1.171 0 N-CA-C 110.26 -1.136 . . . . 20.0 110.26 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.565 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 36.7 Cg_exo -17.09 59.74 0.0 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.97 0 C-N-CA 125.136 3.891 . . . . 20.0 115.387 -177.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.789 ' N ' ' O ' ' A' ' 67' ' ' GLY . 74.1 m -165.33 162.87 19.91 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 108.7 -0.852 . . . . 20.0 108.7 178.051 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.733 ' HG3' HG22 ' A' ' 65' ' ' THR . 54.9 ttt180 -147.09 140.82 25.73 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 112.555 0.576 . . . . 20.0 112.555 -179.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.674 ' CA ' ' HA ' ' A' ' 121' ' ' LEU . 1.4 t -87.98 158.36 18.67 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-N 115.896 -0.593 . . . . 20.0 110.253 178.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.427 ' HA ' ' CD2' ' A' ' 63' ' ' PHE . . . -146.93 27.37 1.07 Allowed 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 114.427 1.269 . . . . 20.0 114.427 -179.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.705 ' HB3' HG21 ' A' ' 119' ' ' VAL . 19.5 tttt -76.62 136.57 67.48 Favored Pre-proline 0 C--N 1.327 -0.411 0 C-N-CA 120.054 -0.658 . . . . 20.0 109.493 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -51.35 129.03 27.54 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.926 2.417 . . . . 20.0 113.172 -178.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.797 HG21 ' O ' ' A' ' 62' ' ' ARG . 17.4 m -142.3 147.79 20.91 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 CA-C-N 115.886 -0.597 . . . . 20.0 111.472 179.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 18.9 m -116.83 126.15 52.62 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.526 -0.546 . . . . 20.0 109.526 178.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.719 ' OE1' HD12 ' A' ' 136' ' ' LEU . 15.9 pt-20 -143.09 155.49 44.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.971 0.415 . . . . 20.0 111.554 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.575 HD12 ' N ' ' A' ' 78' ' ' LEU . 6.3 mp -105.39 143.59 33.34 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.757 -0.656 . . . . 20.0 110.272 178.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.89 HG13 ' CD1' ' A' ' 60' ' ' TYR . 32.8 m . . . . . 0 C--N 1.323 -0.576 0 CA-C-O 121.037 0.446 . . . . 20.0 110.632 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 46.6 t0 . . . . . 0 N--CA 1.455 -0.181 0 CA-C-O 120.739 0.304 . . . . 20.0 111.538 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . 0.441 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 53.2 ttt85 -126.38 143.59 51.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.286 -0.415 . . . . 20.0 111.519 -179.678 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.818 ' CD1' HG13 ' A' ' 137' ' ' VAL . 2.3 m-85 -118.66 157.39 27.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.908 -0.587 . . . . 20.0 110.6 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.652 ' HB2' ' HB2' ' A' ' 138' ' ' ALA . 55.5 ttm-85 -93.74 139.84 30.36 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 108.602 -0.888 . . . . 20.0 108.602 178.024 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -77.01 131.68 38.58 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 120.302 -0.559 . . . . 20.0 110.684 -178.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.673 ' CD ' HD23 ' A' ' 136' ' ' LEU . 49.6 mt-30 -133.46 101.87 5.31 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.961 -0.563 . . . . 20.0 110.57 -179.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 43.2 ttt85 -109.21 99.54 8.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.967 0.413 . . . . 20.0 110.28 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.721 ' HB ' HD21 ' A' ' 64' ' ' LEU . 45.3 t -129.33 148.92 33.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 115.895 -0.593 . . . . 20.0 110.976 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.565 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 13.1 pt20 -92.21 134.82 34.52 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.391 -0.368 . . . . 20.0 110.223 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.697 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.2 OUTLIER -74.48 120.85 20.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.137 0.494 . . . . 20.0 111.134 -179.27 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.509 ' N ' ' O ' ' A' ' 70' ' ' ARG . 0.2 OUTLIER -89.69 138.77 31.19 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.469 -0.787 . . . . 20.0 111.114 -179.242 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . 0.565 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.482 0 CA-C-N 116.06 -0.518 . . . . 20.0 111.02 179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.489 ' O ' ' HD2' ' A' ' 129' ' ' PRO . . . . . . . . 0 N--CA 1.455 -0.185 0 N-CA-C 112.057 0.391 . . . . 20.0 112.057 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.447 ' N ' ' CD ' ' A' ' 129' ' ' PRO . . . -113.44 53.89 0.56 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.125 0.488 . . . . 20.0 110.648 179.314 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . 0.49 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 36.9 Cg_endo -65.86 151.58 83.83 Favored 'Trans proline' 0 N--CA 1.464 -0.251 0 C-N-CA 122.977 2.451 . . . . 20.0 112.767 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.697 ' HB2' HD12 ' A' ' 121' ' ' LEU . 80.8 mtt85 -134.98 155.76 50.19 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 116.004 -0.544 . . . . 20.0 110.634 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.45 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 13.2 p -103.52 133.46 48.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.86 0.362 . . . . 20.0 111.23 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 60.6 ttt85 -140.37 143.57 35.79 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.094 -0.503 . . . . 20.0 111.593 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -97.02 149.31 22.06 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 115.884 -0.598 . . . . 20.0 110.44 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.722 HG12 HD21 ' A' ' 136' ' ' LEU . 3.2 t -147.68 123.92 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-O 121.118 0.485 . . . . 20.0 111.768 -179.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . 0.681 ' C ' HD22 ' A' ' 136' ' ' LEU . 93.9 mtt-85 -100.45 109.73 21.89 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.516 -0.765 . . . . 20.0 109.526 178.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.735 HD22 ' N ' ' A' ' 136' ' ' LEU . 1.1 mm? -111.57 125.69 54.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.1 0.476 . . . . 20.0 112.224 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.818 HG13 ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -52.83 83.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.1 -0.5 . . . . 20.0 111.393 179.853 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.652 ' HB2' ' HB2' ' A' ' 115' ' ' ARG . . . -74.36 -8.83 57.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.082 0.468 . . . . 20.0 110.039 178.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.7 p . . . . . 0 C--N 1.332 -0.189 0 CA-C-N 115.653 -0.703 . . . . 20.0 109.68 179.11 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.455 -0.218 0 CA-C-O 120.902 0.382 . . . . 20.0 111.439 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.602 ' CD2' HG11 ' A' ' 79' ' ' VAL . 20.6 m-30 -110.67 150.06 29.57 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.698 0.629 . . . . 20.0 112.698 -179.018 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 24.0 p -118.88 84.99 2.28 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 115.051 -0.977 . . . . 20.0 110.293 178.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.876 ' O ' HG21 ' A' ' 75' ' ' VAL . 57.1 ttt85 -112.43 125.64 54.44 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 108.473 -0.936 . . . . 20.0 108.473 178.44 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.851 ' CD1' HG22 ' A' ' 75' ' ' VAL . 0.1 OUTLIER -110.01 -84.75 0.55 Allowed 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.555 0.576 . . . . 20.0 112.555 -177.935 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.916 HD21 ' CG2' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -164.5 132.55 3.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.888 0.375 . . . . 20.0 111.448 -178.68 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.977 HG22 ' HG3' ' A' ' 70' ' ' ARG . 44.2 p -131.44 132.92 44.69 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.95 -0.568 . . . . 20.0 110.603 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.762 ' CG ' HD13 ' A' ' 121' ' ' LEU . 20.1 p-10 -145.01 -161.36 1.28 Allowed 'General case' 0 C--O 1.237 0.426 0 N-CA-C 110.355 -0.239 . . . . 20.0 110.355 179.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.837 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -30.51 149.09 0.01 OUTLIER Glycine 0 C--N 1.342 0.902 0 CA-C-O 118.784 -1.009 . . . . 20.0 110.688 179.183 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.502 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 57.0 Cg_exo -16.67 53.42 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.657 1 C-N-CA 125.852 4.368 . . . . 20.0 115.613 -178.476 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.837 ' N ' ' O ' ' A' ' 67' ' ' GLY . 18.3 m -164.56 160.28 20.1 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 108.344 -0.984 . . . . 20.0 108.344 178.412 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.977 ' HG3' HG22 ' A' ' 65' ' ' THR . 71.5 ttt180 -153.58 140.46 19.16 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.865 0.364 . . . . 20.0 111.414 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.654 ' HA ' HD12 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -81.15 165.19 21.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.923 -0.581 . . . . 20.0 110.324 179.279 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -148.26 24.03 1.03 Allowed 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.672 0.619 . . . . 20.0 112.672 178.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.67 ' O ' HG13 ' A' ' 75' ' ' VAL . 1.8 mmpt? -67.3 128.97 93.84 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 109.786 -0.45 . . . . 20.0 109.786 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -46.69 117.72 2.24 Favored 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 122.411 2.074 . . . . 20.0 112.693 -179.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.876 HG21 ' O ' ' A' ' 62' ' ' ARG . 28.8 m -133.24 155.69 41.09 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.244 0 CA-C-N 116.14 -0.482 . . . . 20.0 110.893 179.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.424 HG22 HD11 ' A' ' 78' ' ' LEU . 14.3 m -116.54 121.24 41.21 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.786 -0.45 . . . . 20.0 109.786 177.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.569 ' C ' HD12 ' A' ' 78' ' ' LEU . 78.6 tt0 -120.53 124.07 44.45 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.945 -0.57 . . . . 20.0 110.414 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.725 HD12 ' N ' ' A' ' 78' ' ' LEU . 3.9 mp -111.47 120.59 42.67 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 121.646 0.736 . . . . 20.0 111.61 -179.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.842 HG23 ' O ' ' A' ' 79' ' ' VAL . 3.9 m . . . . . 0 C--N 1.311 -1.068 0 CA-C-N 114.544 -1.207 . . . . 20.0 109.509 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 . . . . . 0 CA--C 1.533 0.312 0 N-CA-C 112.508 0.558 . . . . 20.0 112.508 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . 0.539 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 57.5 ttt180 -117.63 154.15 32.07 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.542 0.211 . . . . 20.0 111.444 -179.159 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 1.01 ' CE2' HG13 ' A' ' 137' ' ' VAL . 2.3 m-85 -127.81 155.3 44.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.488 0.661 . . . . 20.0 111.82 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.529 ' NH2' ' HB1' ' A' ' 138' ' ' ALA . 27.3 ttm-85 -94.29 146.27 24.15 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.968 -1.014 . . . . 20.0 108.959 178.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -94.74 116.39 28.68 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.29 0.567 . . . . 20.0 110.65 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -130.63 111.62 12.38 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.531 -0.759 . . . . 20.0 109.684 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 59.9 ttp180 -110.49 101.3 10.0 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.877 -0.601 . . . . 20.0 110.356 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.916 ' CG2' HD21 ' A' ' 64' ' ' LEU . 35.4 m -125.42 162.95 27.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 120.872 0.368 . . . . 20.0 111.264 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.564 ' HA ' ' HA ' ' A' ' 131' ' ' SER . 14.4 pt20 -95.99 137.84 34.48 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-O 121.53 0.681 . . . . 20.0 112.17 -178.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.764 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -74.79 133.9 41.88 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 115.218 -0.901 . . . . 20.0 109.557 179.094 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.655 HD12 ' N ' ' A' ' 122' ' ' LEU . 2.3 mp -94.72 140.34 30.02 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.404 0.621 . . . . 20.0 111.638 -178.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . 0.477 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.3 OUTLIER . . . . . 0 C--N 1.321 -0.639 0 CA-C-N 115.27 -0.877 . . . . 20.0 109.455 178.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 -0.101 0 N-CA-C 112.519 0.563 . . . . 20.0 112.519 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -125.28 58.3 19.73 Favored Pre-proline 0 C--N 1.325 -0.484 0 C-N-CA 120.886 -0.326 . . . . 20.0 111.819 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -48.87 150.15 6.92 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.477 2.118 . . . . 20.0 111.295 178.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.764 ' HB2' HD12 ' A' ' 121' ' ' LEU . 98.3 mtt180 -123.75 148.43 46.63 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 121.054 -0.258 . . . . 20.0 110.86 -179.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.564 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 22.9 t -100.46 134.61 43.16 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.004 0.431 . . . . 20.0 111.705 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . 0.542 ' HD3' ' CB ' ' A' ' 64' ' ' LEU . 47.4 ttt85 -141.2 141.77 34.04 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.854 -0.612 . . . . 20.0 111.194 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 16.7 pttm -92.91 145.2 24.56 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.783 0.325 . . . . 20.0 111.067 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.497 HG21 ' O ' ' A' ' 63' ' ' PHE . 41.2 t -147.66 130.62 8.0 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.799 0 CA-C-O 121.529 0.681 . . . . 20.0 112.295 -179.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . 0.625 ' O ' HD23 ' A' ' 136' ' ' LEU . 36.5 ptt-85 -113.52 111.85 22.59 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.868 -1.06 . . . . 20.0 109.652 178.411 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.625 HD23 ' O ' ' A' ' 135' ' ' ARG . 8.7 mt -119.05 143.05 47.32 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.372 0.508 . . . . 20.0 112.372 -179.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 1.01 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -63.32 83.76 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.989 -0.551 . . . . 20.0 111.028 179.192 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.529 ' HB1' ' NH2' ' A' ' 115' ' ' ARG . . . -65.98 -19.82 65.99 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.881 0.372 . . . . 20.0 110.672 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 38.6 t . . . . . 0 N--CA 1.465 0.304 0 CA-C-N 116.06 -0.518 . . . . 20.0 110.372 -179.882 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . 0.602 ' CG ' HG22 ' A' ' 76' ' ' THR . 48.2 m170 . . . . . 0 N--CA 1.453 -0.278 0 CA-C-O 120.573 0.225 . . . . 20.0 111.486 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.634 ' CD1' HG13 ' A' ' 79' ' ' VAL . 0.2 OUTLIER -147.9 161.8 40.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.988 0.423 . . . . 20.0 111.28 179.483 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.555 HG23 ' CE1' ' A' ' 63' ' ' PHE . 52.8 m -76.11 136.22 39.85 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.609 0.719 . . . . 20.0 112.128 -178.67 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.893 ' O ' HG21 ' A' ' 75' ' ' VAL . 47.4 tpt85 174.86 109.61 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.59 -1.186 . . . . 20.0 108.799 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.584 ' HD1' HG13 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -116.41 -80.95 0.61 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.551 0.575 . . . . 20.0 112.551 -178.343 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.635 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -164.57 132.45 3.32 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 112.109 0.411 . . . . 20.0 112.109 -178.786 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.491 ' O ' ' NH1' ' A' ' 132' ' ' ARG . 72.6 p -129.12 136.62 50.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.067 -0.515 . . . . 20.0 110.232 178.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.868 ' OD2' HD13 ' A' ' 121' ' ' LEU . 31.4 p-10 -145.34 -164.33 1.92 Allowed 'General case' 0 C--O 1.237 0.426 0 CA-C-N 116.454 -0.339 . . . . 20.0 110.361 -179.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.845 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -31.72 147.99 0.01 OUTLIER Glycine 0 C--N 1.345 1.028 0 CA-C-O 118.453 -1.193 . . . . 20.0 110.152 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.547 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 56.3 Cg_exo -16.99 56.07 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.689 0 C-N-CA 125.167 3.911 . . . . 20.0 115.103 -178.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.845 ' N ' ' O ' ' A' ' 67' ' ' GLY . 34.4 m -163.22 157.68 20.69 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 108.272 -1.01 . . . . 20.0 108.272 178.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.517 ' O ' ' N ' ' A' ' 122' ' ' LEU . 80.6 mtt180 -149.26 143.95 26.2 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.679 0.622 . . . . 20.0 112.679 -179.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.635 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -89.02 159.01 17.8 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.478 -0.783 . . . . 20.0 109.521 177.938 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.578 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . . . -145.85 22.7 1.41 Allowed 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 113.68 0.992 . . . . 20.0 113.68 -179.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.751 ' CB ' HG11 ' A' ' 119' ' ' VAL . 0.1 OUTLIER -67.11 139.74 95.41 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 109.433 -0.58 . . . . 20.0 109.433 178.999 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.46 ' HD2' ' HG3' ' A' ' 73' ' ' LYS . 54.1 Cg_exo -51.87 125.94 18.53 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.353 2.035 . . . . 20.0 112.333 -179.127 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.893 HG21 ' O ' ' A' ' 62' ' ' ARG . 19.0 m -131.41 161.07 41.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.001 0.429 . . . . 20.0 111.248 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.602 HG22 ' CG ' ' A' ' 59' ' ' HIS . 0.0 OUTLIER -134.97 97.08 3.65 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.849 -0.614 . . . . 20.0 109.983 178.749 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.634 ' OE2' HD22 ' A' ' 136' ' ' LEU . 67.8 mt-10 -110.99 161.27 16.03 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.738 -0.664 . . . . 20.0 110.23 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.498 HD12 ' C ' ' A' ' 77' ' ' GLU . 8.7 mp -111.02 132.98 53.76 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.404 0.621 . . . . 20.0 111.494 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.762 HG23 ' O ' ' A' ' 79' ' ' VAL . 23.4 m . . . . . 0 N--CA 1.447 -0.587 0 CA-C-N 115.023 -0.989 . . . . 20.0 110.073 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 50.3 t0 . . . . . 0 CA--C 1.529 0.147 0 N-CA-C 112.539 0.57 . . . . 20.0 112.539 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . 0.813 ' O ' HG12 ' A' ' 137' ' ' VAL . 56.9 ttm-85 -111.98 156.66 21.78 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.104 0.409 . . . . 20.0 112.104 -178.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.979 ' CE2' HG13 ' A' ' 137' ' ' VAL . 4.4 m-85 -134.51 165.49 25.08 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.681 -0.69 . . . . 20.0 112.188 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.514 ' N ' ' O ' ' A' ' 136' ' ' LEU . 14.2 ttm180 -103.3 151.31 22.86 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.611 -1.177 . . . . 20.0 108.358 177.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -90.52 124.84 35.33 Favored 'General case' 0 C--N 1.319 -0.761 0 C-N-CA 120.482 -0.487 . . . . 20.0 111.597 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.435 ' NE2' ' HG2' ' A' ' 115' ' ' ARG . 83.1 mm-40 -131.44 131.3 43.44 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.889 -0.596 . . . . 20.0 110.71 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.414 ' HA ' ' O ' ' A' ' 132' ' ' ARG . 50.9 mtm180 -127.35 95.68 4.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.203 -0.453 . . . . 20.0 110.156 178.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.751 HG11 ' CB ' ' A' ' 73' ' ' LYS . 41.5 t -119.22 145.44 25.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.813 -0.631 . . . . 20.0 111.2 -179.45 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.524 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 20.4 pt20 -79.27 131.23 36.09 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.174 -0.467 . . . . 20.0 109.803 179.53 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.9 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -78.46 125.49 29.44 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.088 0.471 . . . . 20.0 109.785 179.91 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.517 ' N ' ' O ' ' A' ' 70' ' ' ARG . 0.3 OUTLIER -85.77 131.96 34.22 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.435 -0.802 . . . . 20.0 111.665 -178.35 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . 0.566 ' CB ' ' HB3' ' A' ' 128' ' ' ALA . 0.5 OUTLIER . . . . . 0 C--N 1.323 -0.572 0 CA-C-N 115.16 -0.927 . . . . 20.0 109.035 179.028 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.159 0 N-CA-C 112.333 0.494 . . . . 20.0 112.333 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.566 ' HB3' ' CB ' ' A' ' 123' ' ' CYS . . . -133.12 51.02 6.25 Favored Pre-proline 0 C--N 1.331 -0.23 0 N-CA-C 112.727 0.64 . . . . 20.0 112.727 -179.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . 0.47 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 45.6 Cg_endo -68.97 140.16 44.9 Favored 'Trans proline' 0 CA--C 1.528 0.177 0 C-N-CA 122.421 2.081 . . . . 20.0 112.528 179.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.9 ' HB2' HD12 ' A' ' 121' ' ' LEU . 70.1 mtp85 -142.11 134.22 27.54 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.406 -0.361 . . . . 20.0 110.659 179.34 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 22.3 t -85.02 135.46 34.01 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.791 0.329 . . . . 20.0 110.701 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . 0.491 ' NH1' ' O ' ' A' ' 65' ' ' THR . 66.8 ttt180 -143.53 140.9 30.49 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.158 0.429 . . . . 20.0 112.158 -179.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.413 ' HA ' ' O ' ' A' ' 117' ' ' GLN . 2.5 pttp -98.41 139.13 34.62 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.473 -0.566 . . . . 20.0 109.473 178.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.411 HG21 ' O ' ' A' ' 63' ' ' PHE . 13.1 m -145.33 128.57 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 CA-C-O 121.401 0.619 . . . . 20.0 111.364 -179.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . 0.724 ' C ' HD23 ' A' ' 136' ' ' LEU . 55.9 mtm180 -81.59 122.15 27.23 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.939 -1.028 . . . . 20.0 110.007 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.724 HD23 ' C ' ' A' ' 135' ' ' ARG . 9.2 mt -117.5 126.19 52.17 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.878 0.37 . . . . 20.0 111.998 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.979 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.2 OUTLIER -71.33 89.48 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.403 -0.362 . . . . 20.0 111.909 179.692 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -78.44 -9.38 59.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.176 0.512 . . . . 20.0 109.809 178.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.3 p . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 115.575 -0.739 . . . . 20.0 110.353 179.28 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . 0.611 ' CD2' ' HG ' ' A' ' 78' ' ' LEU . 56.1 m80 . . . . . 0 N--CA 1.455 -0.215 0 CA-C-O 120.868 0.366 . . . . 20.0 111.631 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.613 ' CE1' HG11 ' A' ' 79' ' ' VAL . 13.3 m-30 -120.22 154.92 34.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.193 0.52 . . . . 20.0 111.519 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.406 ' O ' ' OG1' ' A' ' 61' ' ' THR . 0.2 OUTLIER -100.81 86.43 3.09 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.511 -0.768 . . . . 20.0 111.435 -179.298 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.99 ' O ' HG21 ' A' ' 75' ' ' VAL . 37.4 ttp180 -117.66 119.73 35.85 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.606 -0.887 . . . . 20.0 108.606 178.373 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.779 ' O ' HD23 ' A' ' 64' ' ' LEU . 0.1 OUTLIER -106.75 -80.03 0.57 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.851 0.685 . . . . 20.0 112.851 -177.755 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.862 HD21 ' HB ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -174.37 146.21 1.05 Allowed 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 120.692 -0.403 . . . . 20.0 112.035 -178.479 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 71.0 p -137.97 148.57 45.34 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.084 -0.507 . . . . 20.0 111.379 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.518 ' O ' ' C ' ' A' ' 67' ' ' GLY . 7.9 t0 -154.13 -167.5 2.66 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.108 -0.496 . . . . 20.0 109.835 179.051 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.835 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -32.56 149.17 0.01 OUTLIER Glycine 0 C--N 1.345 1.036 0 CA-C-O 118.171 -1.349 . . . . 20.0 110.197 179.093 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.503 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 77.6 Cg_exo -18.27 57.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 124.742 3.628 . . . . 20.0 114.949 -178.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.835 ' N ' ' O ' ' A' ' 67' ' ' GLY . 55.7 m -163.82 154.24 15.43 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 108.164 -1.05 . . . . 20.0 108.164 178.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.604 ' O ' HD12 ' A' ' 122' ' ' LEU . 74.1 mtt85 -151.84 144.3 24.14 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.61 0.596 . . . . 20.0 112.61 -179.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.621 ' CA ' ' HA ' ' A' ' 121' ' ' LEU . 0.3 OUTLIER -83.17 164.39 20.22 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.318 -0.856 . . . . 20.0 110.14 178.659 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -152.16 34.52 0.52 Allowed 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.309 0.855 . . . . 20.0 113.309 -179.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.719 ' HB2' HG11 ' A' ' 119' ' ' VAL . 21.8 mttm -82.35 148.55 59.52 Favored Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 109.193 -0.669 . . . . 20.0 109.193 178.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_endo -58.42 120.11 7.78 Favored 'Trans proline' 0 CA--C 1.525 0.072 0 C-N-CA 122.314 2.009 . . . . 20.0 112.871 -178.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.99 HG21 ' O ' ' A' ' 62' ' ' ARG . 16.4 m -133.99 143.74 37.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.672 -0.695 . . . . 20.0 110.813 179.531 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 73.4 m -125.29 129.56 50.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.955 0.407 . . . . 20.0 111.55 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.525 ' O ' ' HA ' ' A' ' 59' ' ' HIS . 15.0 pt-20 -144.23 154.92 43.6 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.91 -0.586 . . . . 20.0 109.633 178.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.611 ' HG ' ' CD2' ' A' ' 59' ' ' HIS . 6.4 mp -88.18 148.38 24.43 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.377 0.608 . . . . 20.0 112.095 -179.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.668 ' O ' ' CG2' ' A' ' 79' ' ' VAL . 0.8 OUTLIER . . . . . 0 N--CA 1.444 -0.762 0 CA-C-N 114.909 -1.041 . . . . 20.0 109.119 179.082 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 48.8 t0 . . . . . 0 N--CA 1.457 -0.111 0 CA-C-O 120.676 0.274 . . . . 20.0 111.468 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . 0.477 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 57.9 ttp180 -127.22 146.12 50.53 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.881 0.372 . . . . 20.0 111.393 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 1.166 ' CE2' HG13 ' A' ' 137' ' ' VAL . 2.9 m-85 -120.89 154.68 35.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.842 -0.617 . . . . 20.0 111.562 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.63 ' HB2' ' HB2' ' A' ' 138' ' ' ALA . 58.9 ttm-85 -92.13 147.44 22.93 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 108.646 -0.872 . . . . 20.0 108.646 178.338 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -82.41 123.0 28.73 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 120.814 -0.355 . . . . 20.0 111.206 -179.132 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.586 ' HG2' HD23 ' A' ' 136' ' ' LEU . 82.9 mm-40 -126.4 125.44 42.19 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 116.308 -0.405 . . . . 20.0 110.352 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 67.2 ttp85 -124.34 100.17 6.56 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.248 0.547 . . . . 20.0 110.553 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.862 ' HB ' HD21 ' A' ' 64' ' ' LEU . 86.2 t -125.1 147.66 29.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.372 -0.831 . . . . 20.0 111.093 -179.481 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.586 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 10.8 pt20 -92.12 133.87 35.37 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.858 -0.423 . . . . 20.0 109.858 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.902 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -78.24 135.16 37.52 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.25 0.547 . . . . 20.0 111.759 -178.82 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.604 HD12 ' O ' ' A' ' 70' ' ' ARG . 0.3 OUTLIER -82.39 146.84 29.12 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.248 -0.887 . . . . 20.0 110.282 179.801 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . 0.426 ' SG ' ' O ' ' A' ' 128' ' ' ALA . 3.5 m . . . . . 0 N--CA 1.45 -0.428 0 CA-C-O 120.975 0.417 . . . . 20.0 110.768 -178.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.186 0 N-CA-C 111.872 0.323 . . . . 20.0 111.872 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . 0.426 ' O ' ' SG ' ' A' ' 123' ' ' CYS . . . -120.85 63.89 11.54 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 121.117 0.484 . . . . 20.0 110.624 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -57.93 151.01 60.13 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.98 2.453 . . . . 20.0 112.015 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.902 ' HB2' HD12 ' A' ' 121' ' ' LEU . 73.8 mtp85 -124.12 154.75 39.55 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 116.3 -0.409 . . . . 20.0 110.915 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.445 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 47.0 t -106.2 133.12 51.4 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.786 0.327 . . . . 20.0 111.789 -179.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 58.0 ttt85 -147.8 138.3 23.08 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 112.223 0.453 . . . . 20.0 112.223 179.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 12.5 pttp -94.45 146.84 23.8 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.08 -0.509 . . . . 20.0 109.706 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.603 HG21 ' O ' ' A' ' 63' ' ' PHE . 4.9 t -147.28 127.84 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.71 0 CA-C-O 121.485 0.659 . . . . 20.0 111.95 -179.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . 0.777 ' C ' HD22 ' A' ' 136' ' ' LEU . 31.4 ptt180 -93.13 121.2 34.24 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.87 -1.059 . . . . 20.0 109.966 179.193 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.777 HD22 ' C ' ' A' ' 135' ' ' ARG . 0.7 OUTLIER -114.45 126.55 55.09 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.395 0.517 . . . . 20.0 112.395 -178.497 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 1.166 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -53.43 84.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.551 -0.295 . . . . 20.0 111.713 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.63 ' HB2' ' HB2' ' A' ' 115' ' ' ARG . . . -64.72 -20.32 66.26 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.303 0.573 . . . . 20.0 110.152 179.28 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 36.1 t . . . . . 0 C--N 1.327 -0.377 0 CA-C-N 115.404 -0.816 . . . . 20.0 110.483 179.508 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 1.4 m170 . . . . . 0 N--CA 1.451 -0.385 0 N-CA-C 109.014 -0.736 . . . . 20.0 109.014 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 1.033 ' CE1' HG13 ' A' ' 79' ' ' VAL . 5.7 p90 -126.64 157.69 38.31 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.948 0.404 . . . . 20.0 111.711 -177.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.0 p -105.1 95.11 5.62 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.941 -0.572 . . . . 20.0 111.981 -179.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.733 ' O ' HG21 ' A' ' 75' ' ' VAL . 55.0 ttm-85 -116.98 125.11 50.9 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.263 -1.014 . . . . 20.0 108.263 177.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.712 ' C ' HD23 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -116.9 -79.81 0.59 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 113.442 0.904 . . . . 20.0 113.442 -177.13 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.914 HD21 ' HB ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -171.21 141.15 1.57 Allowed 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.443 -0.503 . . . . 20.0 112.293 -177.269 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.783 HG22 ' HG3' ' A' ' 70' ' ' ARG . 30.6 p -134.42 133.59 40.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.483 . . . . 20.0 110.395 178.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.507 ' O ' ' C ' ' A' ' 67' ' ' GLY . 15.0 t0 -148.86 -162.31 1.53 Allowed 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.365 -0.379 . . . . 20.0 110.056 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.841 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -31.2 148.25 0.01 OUTLIER Glycine 0 C--N 1.344 1.015 0 CA-C-O 118.343 -1.254 . . . . 20.0 110.485 179.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.488 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 19.5 Cg_exo -16.51 60.21 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 124.75 3.633 . . . . 20.0 113.993 -178.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.841 ' N ' ' O ' ' A' ' 67' ' ' GLY . 59.9 m -163.14 150.77 13.25 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 114.923 -1.035 . . . . 20.0 109.251 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.783 ' HG3' HG22 ' A' ' 65' ' ' THR . 57.3 ttt180 -145.68 124.55 12.69 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.84 0.352 . . . . 20.0 110.672 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.626 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -74.71 156.59 36.47 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 116.109 -0.496 . . . . 20.0 110.324 179.669 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -150.45 31.94 0.65 Allowed 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 113.305 0.854 . . . . 20.0 113.305 -179.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.655 ' O ' HG13 ' A' ' 75' ' ' VAL . 6.8 ttmt -75.24 144.97 79.46 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.985 -0.376 . . . . 20.0 109.985 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.459 ' HD2' ' CG ' ' A' ' 73' ' ' LYS . 50.2 Cg_exo -53.11 113.1 1.12 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.169 1.913 . . . . 20.0 112.002 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.733 HG21 ' O ' ' A' ' 62' ' ' ARG . 24.1 m -132.13 149.4 32.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.971 -0.559 . . . . 20.0 111.567 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 6.1 m -115.01 118.13 32.55 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.568 -0.53 . . . . 20.0 109.568 178.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.662 ' CD ' HD12 ' A' ' 136' ' ' LEU . 44.1 mm-40 -125.04 151.12 46.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.521 -0.308 . . . . 20.0 110.769 -179.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.497 HD12 ' N ' ' A' ' 78' ' ' LEU . 6.0 mp -119.34 125.55 49.3 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 113.054 0.761 . . . . 20.0 113.054 -179.014 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 1.033 HG13 ' CE1' ' A' ' 60' ' ' TYR . 2.5 m . . . . . 0 N--CA 1.448 -0.547 0 CA-C-N 114.473 -1.24 . . . . 20.0 109.698 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 21.0 t70 . . . . . 0 CA--C 1.532 0.26 0 N-CA-C 112.69 0.626 . . . . 20.0 112.69 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . 0.475 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 39.2 ttm180 -119.31 151.0 39.18 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.732 0.301 . . . . 20.0 111.72 -178.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.836 ' CE2' HG13 ' A' ' 137' ' ' VAL . 4.4 m-85 -122.71 141.99 51.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.942 -0.572 . . . . 20.0 111.539 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.598 ' HB3' ' HB2' ' A' ' 138' ' ' ALA . 30.7 ttp180 -93.15 143.85 25.85 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 115.757 -0.656 . . . . 20.0 109.402 178.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -76.13 132.88 40.29 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.012 0.434 . . . . 20.0 111.198 -178.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.434 ' N ' ' O ' ' A' ' 134' ' ' VAL . 95.1 mm-40 -125.31 137.39 54.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.829 -0.623 . . . . 20.0 110.723 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 70.6 ttt-85 -130.2 106.9 8.9 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.11 -0.495 . . . . 20.0 110.863 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.914 ' HB ' HD21 ' A' ' 64' ' ' LEU . 21.5 t -135.03 152.16 32.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.062 -0.517 . . . . 20.0 111.358 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.544 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 11.1 pt20 -92.24 130.27 37.98 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.512 -0.313 . . . . 20.0 110.406 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.619 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.2 OUTLIER -77.0 126.61 31.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.005 0.431 . . . . 20.0 110.8 -179.982 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.54 HD12 ' O ' ' A' ' 70' ' ' ARG . 0.3 OUTLIER -90.64 134.83 34.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.93 -0.577 . . . . 20.0 111.419 -179.388 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . 0.403 ' HB3' ' O ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.389 0 CA-C-N 115.849 -0.614 . . . . 20.0 109.981 179.367 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.416 ' O ' ' HD2' ' A' ' 129' ' ' PRO . . . . . . . . 0 C--O 1.232 0.171 0 N-CA-C 111.896 0.332 . . . . 20.0 111.896 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -116.61 62.48 2.62 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 112.232 0.456 . . . . 20.0 112.232 -179.02 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . 0.416 ' HD2' ' O ' ' A' ' 127' ' ' ALA . 9.7 Cg_endo -49.91 146.7 16.01 Favored 'Trans proline' 0 N--CA 1.463 -0.295 0 C-N-CA 122.511 2.14 . . . . 20.0 110.898 178.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.551 ' HB2' HD12 ' A' ' 121' ' ' LEU . 14.6 mtp-105 -127.84 154.3 45.62 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 121.01 -0.276 . . . . 20.0 111.467 -179.056 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 99.7 p -105.18 139.85 39.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.326 -0.397 . . . . 20.0 111.303 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 53.9 ttt85 -145.51 138.9 26.41 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.085 0.469 . . . . 20.0 112.045 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -91.38 141.93 28.23 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.696 -0.684 . . . . 20.0 109.404 178.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.456 HG21 ' HB3' ' A' ' 64' ' ' LEU . 2.8 t -145.47 125.72 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 CA-C-O 121.318 0.58 . . . . 20.0 111.812 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . 0.64 ' O ' HD23 ' A' ' 136' ' ' LEU . 49.5 ptt85 -99.21 113.82 26.29 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.155 -0.929 . . . . 20.0 110.175 179.015 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.662 HD12 ' CD ' ' A' ' 77' ' ' GLU . 32.5 mt -127.61 148.99 50.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.067 0.46 . . . . 20.0 111.311 -179.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.836 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -57.55 92.75 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.728 -0.669 . . . . 20.0 112.397 -179.451 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.598 ' HB2' ' HB3' ' A' ' 115' ' ' ARG . . . -73.94 -13.06 60.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.142 0.496 . . . . 20.0 109.825 178.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 96.3 p . . . . . 0 C--N 1.333 -0.139 0 CA-C-N 115.697 -0.683 . . . . 20.0 110.089 179.108 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 4.2 m170 . . . . . 0 N--CA 1.466 0.33 0 CA-C-O 120.851 0.357 . . . . 20.0 110.991 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -119.83 159.32 24.82 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 112.432 0.53 . . . . 20.0 112.432 -178.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 42.5 p -123.62 83.85 2.19 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-N 115.705 -0.679 . . . . 20.0 110.442 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.689 ' O ' HG21 ' A' ' 75' ' ' VAL . 63.9 mtm180 -118.55 123.84 46.05 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 107.857 -1.164 . . . . 20.0 107.857 178.092 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.732 ' CD2' HG22 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -108.07 -78.71 0.58 Allowed 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.609 0.596 . . . . 20.0 112.609 -177.189 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.734 HD21 ' HB ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -169.09 138.43 2.12 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.539 -0.464 . . . . 20.0 112.133 -178.246 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.67 HG22 ' HG3' ' A' ' 70' ' ' ARG . 40.6 p -129.26 143.57 50.9 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.514 -0.55 . . . . 20.0 109.514 177.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.552 ' O ' ' C ' ' A' ' 67' ' ' GLY . 5.9 t0 -153.0 -162.69 1.54 Allowed 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.94 -0.393 . . . . 20.0 109.94 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.872 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -29.05 141.64 0.01 OUTLIER Glycine 0 C--N 1.345 1.039 0 CA-C-O 118.424 -1.209 . . . . 20.0 110.301 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.513 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 56.2 Cg_exo -15.77 55.02 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 125.287 3.991 . . . . 20.0 114.514 -178.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.872 ' N ' ' O ' ' A' ' 67' ' ' GLY . 19.6 m -162.81 167.34 23.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.005 -0.998 . . . . 20.0 108.537 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.67 ' HG3' HG22 ' A' ' 65' ' ' THR . 65.0 ttt180 -161.35 143.86 12.2 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.965 -0.294 . . . . 20.0 111.523 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.824 ' HA ' HD12 ' A' ' 122' ' ' LEU . 0.9 OUTLIER -83.86 171.17 13.34 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 116.442 -0.345 . . . . 20.0 110.253 178.996 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -152.29 25.54 0.61 Allowed 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 113.44 0.904 . . . . 20.0 113.44 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.579 ' HB2' HG11 ' A' ' 119' ' ' VAL . 0.2 OUTLIER -68.49 144.19 96.13 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 109.165 -0.679 . . . . 20.0 109.165 178.901 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.92 114.64 1.99 Allowed 'Trans proline' 0 CA--C 1.527 0.17 0 C-N-CA 122.411 2.074 . . . . 20.0 112.329 -179.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.732 HG22 ' CD2' ' A' ' 63' ' ' PHE . 16.1 m -130.85 155.36 41.84 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.167 0 CA-C-O 120.955 0.407 . . . . 20.0 111.518 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.521 HG22 HD11 ' A' ' 78' ' ' LEU . 70.4 m -116.36 123.93 48.82 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.99 -0.55 . . . . 20.0 110.601 179.015 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.602 ' OE1' HD13 ' A' ' 136' ' ' LEU . 52.6 tp10 -121.73 127.51 50.77 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.193 -0.458 . . . . 20.0 110.4 179.255 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.751 HD12 ' N ' ' A' ' 78' ' ' LEU . 1.7 mp -112.91 122.89 48.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.413 0.625 . . . . 20.0 111.551 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.816 HG23 ' O ' ' A' ' 79' ' ' VAL . 1.5 m . . . . . 0 C--N 1.322 -0.605 0 CA-C-O 122.065 0.936 . . . . 20.0 108.891 178.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 . . . . . 0 CA--C 1.53 0.194 0 N-CA-C 111.957 0.354 . . . . 20.0 111.957 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . 0.558 ' O ' HG12 ' A' ' 137' ' ' VAL . 40.9 ttm180 -124.61 151.8 44.37 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.968 0.358 . . . . 20.0 111.968 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.906 ' CZ ' HG13 ' A' ' 137' ' ' VAL . 0.9 OUTLIER -130.11 152.92 49.03 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.609 -0.723 . . . . 20.0 111.724 -179.693 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.585 ' O ' ' HA ' ' A' ' 135' ' ' ARG . 18.3 ttm-85 -93.98 137.61 33.0 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 115.868 -0.605 . . . . 20.0 109.7 178.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -82.1 120.86 25.84 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.756 0.312 . . . . 20.0 110.847 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.491 ' CG ' ' O ' ' A' ' 134' ' ' VAL . 9.2 pt20 -133.55 139.55 46.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.98 0.419 . . . . 20.0 111.269 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.411 ' HG2' ' CB ' ' A' ' 133' ' ' LYS . 71.7 mtp85 -123.14 108.81 13.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.926 -0.579 . . . . 20.0 110.841 179.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.734 ' HB ' HD21 ' A' ' 64' ' ' LEU . 74.8 t -120.36 145.06 27.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.786 -0.643 . . . . 20.0 110.773 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.565 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 26.9 mp0 -88.0 127.82 35.39 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.208 -0.451 . . . . 20.0 110.445 -179.748 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.78 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.2 OUTLIER -76.68 126.99 31.94 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.393 0.616 . . . . 20.0 111.589 -178.61 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.824 HD12 ' HA ' ' A' ' 71' ' ' SER . 3.1 mp -89.38 141.99 28.06 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.083 -0.962 . . . . 20.0 111.713 -179.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . 0.513 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.2 OUTLIER . . . . . 0 C--N 1.322 -0.626 0 CA-C-N 115.563 -0.744 . . . . 20.0 109.248 178.271 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.111 0 CA-C-O 120.559 0.219 . . . . 20.0 111.567 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -121.52 60.77 10.88 Favored Pre-proline 0 C--N 1.332 -0.18 0 CA-C-O 120.944 0.402 . . . . 20.0 111.895 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -48.57 152.6 3.98 Favored 'Trans proline' 0 CA--C 1.528 0.213 0 C-N-CA 123.48 2.787 . . . . 20.0 112.483 179.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.78 ' HB2' HD12 ' A' ' 121' ' ' LEU . 80.5 mtt-85 -125.43 158.58 34.03 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.352 -0.385 . . . . 20.0 111.088 -179.249 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 9.7 t -114.66 136.67 52.79 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.511 -0.313 . . . . 20.0 110.742 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . 0.426 ' HD3' ' HB2' ' A' ' 64' ' ' LEU . 52.9 ttt85 -148.74 136.05 20.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.848 0.356 . . . . 20.0 111.793 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.411 ' CB ' ' HG2' ' A' ' 118' ' ' ARG . 25.1 pttm -96.45 140.53 30.96 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.69 -0.485 . . . . 20.0 109.69 178.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.491 ' O ' ' CG ' ' A' ' 117' ' ' GLN . 7.8 t -145.44 125.96 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 CA-C-O 121.198 0.523 . . . . 20.0 111.779 -178.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . 0.598 ' HG2' ' HB2' ' A' ' 114' ' ' TYR . 39.1 ttt180 -99.03 111.9 24.17 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.561 -0.745 . . . . 20.0 109.43 178.325 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.602 HD13 ' OE1' ' A' ' 77' ' ' GLU . 22.0 mt -113.31 140.04 48.34 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.749 0.648 . . . . 20.0 112.749 -178.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.906 HG13 ' CZ ' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -58.93 84.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 CA-C-N 116.219 -0.446 . . . . 20.0 111.455 179.43 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.418 ' HB1' HH21 ' A' ' 115' ' ' ARG . . . -74.14 -12.06 60.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.94 0.4 . . . . 20.0 110.43 179.34 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.5 t . . . . . 0 C--N 1.332 -0.189 0 CA-C-N 115.89 -0.595 . . . . 20.0 110.358 179.231 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 5.9 m170 . . . . . 0 N--CA 1.453 -0.296 0 CA-C-O 120.829 0.347 . . . . 20.0 110.576 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.774 ' CE1' HG13 ' A' ' 79' ' ' VAL . 0.5 OUTLIER -143.5 163.07 34.17 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.212 -0.449 . . . . 20.0 110.362 -179.858 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 30.1 p -106.99 93.32 4.49 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 112.862 0.69 . . . . 20.0 112.862 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.936 ' O ' HG21 ' A' ' 75' ' ' VAL . 23.1 mtt-85 -127.26 127.71 44.83 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 108.043 -1.095 . . . . 20.0 108.043 176.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.586 ' C ' HD23 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -118.47 -79.51 0.6 Allowed 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 113.053 0.76 . . . . 20.0 113.053 -177.0 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 1.076 HD11 HG23 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -166.43 136.96 3.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.014 0.435 . . . . 20.0 111.984 -178.314 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 59.9 p -129.88 140.01 51.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.719 -0.673 . . . . 20.0 110.356 178.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.535 ' O ' ' C ' ' A' ' 67' ' ' GLY . 11.7 t0 -147.86 -164.32 1.98 Allowed 'General case' 0 C--O 1.236 0.353 0 N-CA-C 109.968 -0.382 . . . . 20.0 109.968 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.866 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -30.67 146.04 0.01 OUTLIER Glycine 0 C--N 1.343 0.963 0 N-CA-C 110.2 -1.16 . . . . 20.0 110.2 179.48 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.493 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 59.4 Cg_exo -16.43 55.19 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 125.256 3.971 . . . . 20.0 115.037 -178.365 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.866 ' N ' ' O ' ' A' ' 67' ' ' GLY . 33.4 m -163.89 163.8 23.59 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.476 -0.935 . . . . 20.0 108.476 178.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.474 ' HG3' ' O ' ' A' ' 69' ' ' CYS . 82.1 mtt85 -157.71 148.02 20.68 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.342 0.591 . . . . 20.0 112.357 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.814 ' HA ' HD12 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -88.26 164.06 15.79 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 115.302 -0.863 . . . . 20.0 109.952 178.568 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.411 ' HA ' ' CE1' ' A' ' 63' ' ' PHE . . . -149.73 26.77 0.82 Allowed 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 119.957 -0.697 . . . . 20.0 112.734 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.724 ' CB ' HG11 ' A' ' 119' ' ' VAL . 1.3 mptp? -73.58 145.7 85.1 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-O 120.888 0.375 . . . . 20.0 110.277 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -49.84 123.03 9.98 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.797 2.331 . . . . 20.0 112.79 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.936 HG21 ' O ' ' A' ' 62' ' ' ARG . 23.9 m -137.73 145.53 28.9 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.162 0 CA-C-N 116.053 -0.521 . . . . 20.0 111.503 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 21.3 m -123.18 115.27 21.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.915 -0.584 . . . . 20.0 109.625 178.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.577 ' CD ' HD12 ' A' ' 136' ' ' LEU . 48.1 mt-10 -130.26 163.43 26.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.629 0.252 . . . . 20.0 110.818 -179.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.686 HD13 ' O ' ' A' ' 137' ' ' VAL . 6.0 mp -118.11 136.69 53.43 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 121.139 0.495 . . . . 20.0 111.578 179.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.81 HG23 ' O ' ' A' ' 79' ' ' VAL . 19.7 m . . . . . 0 C--N 1.325 -0.479 0 CA-C-N 115.677 -0.692 . . . . 20.0 110.287 -179.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 . . . . . 0 CA--C 1.531 0.224 0 N-CA-C 111.922 0.342 . . . . 20.0 111.922 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . 0.543 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 24.9 ttm105 -125.93 145.18 50.38 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.525 0.202 . . . . 20.0 111.224 -179.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.874 ' CD1' HG13 ' A' ' 137' ' ' VAL . 0.8 OUTLIER -118.57 159.82 22.88 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 121.448 0.642 . . . . 20.0 111.941 -179.513 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.62 ' HB2' ' HB2' ' A' ' 138' ' ' ALA . 38.5 ttm-85 -100.89 140.45 35.16 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 114.768 -1.105 . . . . 20.0 108.702 178.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -80.45 123.32 27.96 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 116.116 -0.493 . . . . 20.0 111.394 -178.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.69 ' HG2' HD23 ' A' ' 136' ' ' LEU . 80.1 mm-40 -124.93 124.77 42.74 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.971 -0.559 . . . . 20.0 109.887 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 67.0 ttp85 -130.28 92.43 3.28 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.025 0.441 . . . . 20.0 111.055 -179.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 1.076 HG23 HD11 ' A' ' 64' ' ' LEU . 35.1 m -126.3 170.22 16.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.562 -0.745 . . . . 20.0 110.666 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.555 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 13.0 pt20 -110.94 138.58 47.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.998 0.428 . . . . 20.0 110.946 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.827 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -75.82 125.04 28.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.975 -0.557 . . . . 20.0 110.928 -179.608 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.814 HD12 ' HA ' ' A' ' 71' ' ' SER . 1.9 mp -91.45 142.96 27.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.478 -0.783 . . . . 20.0 111.742 -178.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . 0.493 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.4 OUTLIER . . . . . 0 C--N 1.323 -0.564 0 CA-C-N 115.372 -0.831 . . . . 20.0 110.538 179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.207 0 N-CA-C 112.053 0.39 . . . . 20.0 112.053 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -125.87 56.36 15.25 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 120.905 0.383 . . . . 20.0 111.506 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -52.82 146.92 33.97 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.642 2.228 . . . . 20.0 111.458 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.827 ' HB2' HD12 ' A' ' 121' ' ' LEU . 79.8 mtt85 -125.69 150.6 47.51 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.16 -0.473 . . . . 20.0 111.112 -179.126 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.541 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 14.1 p -102.94 133.76 47.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.955 -0.566 . . . . 20.0 110.449 179.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 67.6 ttt180 -144.8 141.48 29.21 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.002 -0.545 . . . . 20.0 111.269 -179.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 14.4 pttp -103.3 149.65 24.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 20.0 110.414 179.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.557 HG23 ' HB2' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -151.88 130.28 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 CA-C-O 121.195 0.521 . . . . 20.0 111.399 -179.279 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . 0.67 ' C ' HD22 ' A' ' 136' ' ' LEU . 86.1 mtm-85 -91.15 122.6 33.93 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.603 -0.726 . . . . 20.0 109.719 178.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.83 HD22 ' N ' ' A' ' 136' ' ' LEU . 0.7 OUTLIER -121.23 127.01 51.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.252 0.549 . . . . 20.0 112.341 -178.655 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.874 HG13 ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -55.49 92.0 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.937 -0.574 . . . . 20.0 111.803 179.639 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.62 ' HB2' ' HB2' ' A' ' 115' ' ' ARG . . . -81.48 -5.72 58.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.196 -0.456 . . . . 20.0 110.616 179.303 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 115.756 -0.656 . . . . 20.0 109.677 179.273 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . 0.407 ' C ' ' CD1' ' A' ' 60' ' ' TYR . 24.0 m170 . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.771 0.32 . . . . 20.0 110.717 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.66 ' CD1' HG13 ' A' ' 79' ' ' VAL . 2.7 m-85 -132.06 150.08 52.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 20.0 111.381 -179.007 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -97.51 96.99 8.7 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.984 -0.553 . . . . 20.0 111.75 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.943 ' O ' HG21 ' A' ' 75' ' ' VAL . 23.2 tpt180 -126.28 121.6 33.11 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 107.714 -1.217 . . . . 20.0 107.714 177.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.606 ' CD2' ' O ' ' A' ' 73' ' ' LYS . 0.0 OUTLIER -112.48 -81.28 0.59 Allowed 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.003 -0.679 . . . . 20.0 112.702 -177.445 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.922 HD21 ' HB ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -169.06 137.6 2.02 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.214 -0.594 . . . . 20.0 112.203 -178.192 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.923 HG22 ' HG3' ' A' ' 70' ' ' ARG . 51.9 p -129.74 136.42 49.63 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.721 -0.672 . . . . 20.0 109.246 178.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.527 ' O ' ' C ' ' A' ' 67' ' ' GLY . 8.6 t0 -148.82 -158.31 0.9 Allowed 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.606 -0.438 . . . . 20.0 111.008 -179.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.864 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -31.37 141.5 0.04 OUTLIER Glycine 0 C--N 1.346 1.118 0 N-CA-C 109.718 -1.353 . . . . 20.0 109.718 179.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.521 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 20.1 Cg_exo -15.54 53.16 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.889 1 C-N-CA 125.409 4.072 . . . . 20.0 115.48 -178.207 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.864 ' N ' ' O ' ' A' ' 67' ' ' GLY . 65.4 m -159.29 162.85 36.1 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 107.885 -1.154 . . . . 20.0 107.885 178.093 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.923 ' HG3' HG22 ' A' ' 65' ' ' THR . 62.5 ttt180 -148.41 137.94 22.1 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.567 0.58 . . . . 20.0 112.567 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.637 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.6 OUTLIER -81.15 162.91 23.46 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 115.931 -0.577 . . . . 20.0 110.278 178.543 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -151.7 27.83 0.63 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.942 0.719 . . . . 20.0 112.942 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.611 ' HB2' ' CG1' ' A' ' 119' ' ' VAL . 9.9 tttt -71.17 150.5 94.56 Favored Pre-proline 0 C--N 1.327 -0.379 0 N-CA-C 109.85 -0.426 . . . . 20.0 109.85 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.557 ' HD2' ' CG ' ' A' ' 73' ' ' LYS . 41.9 Cg_exo -59.85 115.07 2.37 Favored 'Trans proline' 0 N--CA 1.464 -0.247 0 C-N-CA 122.175 1.917 . . . . 20.0 112.241 -179.258 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.943 HG21 ' O ' ' A' ' 62' ' ' ARG . 4.9 m -134.77 155.42 38.43 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.202 0 CA-C-N 115.676 -0.693 . . . . 20.0 111.062 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 18.7 m -126.76 121.76 32.89 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.717 -0.674 . . . . 20.0 109.813 179.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.511 ' CB ' HD13 ' A' ' 136' ' ' LEU . 6.1 pt-20 -130.58 150.78 51.62 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.041 0.448 . . . . 20.0 111.404 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.628 HD12 ' N ' ' A' ' 78' ' ' LEU . 5.2 mp -102.6 141.09 35.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.884 -0.598 . . . . 20.0 111.104 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.66 HG13 ' CD1' ' A' ' 60' ' ' TYR . 5.8 m . . . . . 0 N--CA 1.446 -0.641 0 N-CA-C 109.207 -0.664 . . . . 20.0 109.207 178.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 10.5 t70 . . . . . 0 N--CA 1.456 -0.162 0 CA-C-O 120.876 0.37 . . . . 20.0 111.232 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . 0.528 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 21.4 ttm180 -125.92 141.93 51.75 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.088 -0.506 . . . . 20.0 111.008 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.867 ' CE2' HG13 ' A' ' 137' ' ' VAL . 0.8 OUTLIER -116.59 159.39 22.21 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-O 121.677 0.751 . . . . 20.0 112.098 -179.477 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.426 ' HD2' ' NE2' ' A' ' 117' ' ' GLN . 47.2 ttm-85 -97.5 146.49 25.19 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 114.423 -1.262 . . . . 20.0 108.413 177.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . 0.503 ' O ' ' NE2' ' A' ' 117' ' ' GLN . . . -83.31 136.42 34.38 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 120.717 -0.393 . . . . 20.0 111.691 -178.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.767 ' HB2' HG23 ' A' ' 134' ' ' VAL . 91.0 mm-40 -134.47 135.26 42.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.984 -0.553 . . . . 20.0 110.81 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 58.3 ttt-85 -128.38 93.96 3.77 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.359 -0.382 . . . . 20.0 110.298 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.922 ' HB ' HD21 ' A' ' 64' ' ' LEU . 25.1 t -129.17 144.69 37.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 N-CA-C 112.501 0.556 . . . . 20.0 112.501 -178.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.501 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 19.0 pt20 -88.24 131.15 34.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.169 -0.469 . . . . 20.0 110.711 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.594 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -77.26 116.15 17.63 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.08 -0.509 . . . . 20.0 111.163 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.469 HD12 ' HA ' ' A' ' 71' ' ' SER . 0.2 OUTLIER -80.27 150.67 29.92 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.6 -0.727 . . . . 20.0 111.107 -179.922 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . 0.521 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER . . . . . 0 C--N 1.332 -0.184 0 CA-C-O 120.827 0.346 . . . . 20.0 110.81 179.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.465 ' C ' ' HD3' ' A' ' 129' ' ' PRO . . . . . . . . 0 N--CA 1.462 0.129 0 N-CA-C 112.968 0.729 . . . . 20.0 112.968 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -114.16 60.52 1.0 Allowed Pre-proline 0 C--N 1.327 -0.375 0 CA-C-O 121.093 0.473 . . . . 20.0 110.533 178.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . 0.465 ' HD3' ' C ' ' A' ' 127' ' ' ALA . 41.3 Cg_endo -68.62 146.88 68.79 Favored 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 123.38 2.72 . . . . 20.0 112.71 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.563 ' HB2' HD12 ' A' ' 121' ' ' LEU . 83.2 mtt85 -134.35 148.36 50.7 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.874 -0.603 . . . . 20.0 110.46 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.495 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 57.8 p -89.8 141.12 28.93 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 121.096 -0.241 . . . . 20.0 110.869 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . 0.425 ' HB3' HD13 ' A' ' 64' ' ' LEU . 53.4 ttt85 -146.86 148.39 31.8 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.135 0.493 . . . . 20.0 112.135 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 1.9 pttt -101.39 145.72 28.55 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 115.382 -0.826 . . . . 20.0 109.884 178.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.767 HG23 ' HB2' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -149.29 126.54 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-O 121.399 0.619 . . . . 20.0 111.448 179.86 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . 0.595 ' C ' HD23 ' A' ' 136' ' ' LEU . 85.1 mtm180 -95.42 112.76 24.42 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.061 -0.972 . . . . 20.0 109.771 179.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.595 HD23 ' C ' ' A' ' 135' ' ' ARG . 1.7 mt -113.99 125.35 53.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.524 0.678 . . . . 20.0 112.677 -179.489 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.867 HG13 ' CE2' ' A' ' 114' ' ' TYR . 2.3 m -55.39 90.77 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.088 -0.96 . . . . 20.0 112.835 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -65.53 -25.46 67.46 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.488 -0.93 . . . . 20.0 108.488 177.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 26.3 p . . . . . 0 CA--C 1.531 0.223 0 CA-C-N 114.992 -1.004 . . . . 20.0 110.632 179.146 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . 0.417 ' C ' ' CD1' ' A' ' 60' ' ' TYR . 9.0 m170 . . . . . 0 CA--C 1.52 -0.193 0 CA-C-O 121.052 0.453 . . . . 20.0 111.181 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.655 ' CD1' HG13 ' A' ' 79' ' ' VAL . 10.2 m-85 -133.77 148.74 51.4 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.732 -0.667 . . . . 20.0 111.697 -178.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 73.2 p -103.29 82.46 2.06 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.178 -0.465 . . . . 20.0 111.318 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.904 ' O ' HG21 ' A' ' 75' ' ' VAL . 68.0 ttt180 -114.93 123.19 48.5 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 108.405 -0.961 . . . . 20.0 108.405 177.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.931 ' O ' HG11 ' A' ' 134' ' ' VAL . 0.1 OUTLIER -110.6 -80.24 0.58 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.154 0.427 . . . . 20.0 112.154 -177.859 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.675 ' O ' HD23 ' A' ' 121' ' ' LEU . 0.0 OUTLIER -166.92 133.97 2.43 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.62 -0.432 . . . . 20.0 111.089 -178.887 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 49.4 p -131.04 141.68 50.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.355 -0.384 . . . . 20.0 110.756 179.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.525 ' O ' ' C ' ' A' ' 67' ' ' GLY . 9.3 t0 -152.37 -163.92 1.84 Allowed 'General case' 0 C--O 1.236 0.382 0 N-CA-C 109.785 -0.45 . . . . 20.0 109.785 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.861 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -31.85 148.17 0.01 OUTLIER Glycine 0 C--N 1.345 1.058 0 CA-C-O 118.098 -1.39 . . . . 20.0 110.167 179.135 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.524 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 41.6 Cg_exo -18.14 54.44 0.0 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 124.971 3.78 . . . . 20.0 115.289 -178.255 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.861 ' N ' ' O ' ' A' ' 67' ' ' GLY . 59.1 m -162.66 153.76 17.45 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 115.603 -0.726 . . . . 20.0 109.117 179.118 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.526 ' O ' ' N ' ' A' ' 122' ' ' LEU . 95.5 mtt180 -150.29 150.01 30.92 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.213 0.53 . . . . 20.0 112.335 -179.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.633 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -90.21 161.52 15.68 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 115.445 -0.798 . . . . 20.0 110.105 178.496 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.18 35.17 0.99 Allowed 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 114.276 1.213 . . . . 20.0 114.276 -179.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.985 ' HB2' HG11 ' A' ' 119' ' ' VAL . 0.9 OUTLIER -80.19 157.75 72.89 Favored Pre-proline 0 C--N 1.327 -0.387 0 C-N-CA 120.632 -0.427 . . . . 20.0 109.989 178.736 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.408 ' HD2' ' HG3' ' A' ' 73' ' ' LYS . 28.7 Cg_endo -61.92 116.27 3.35 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.479 2.12 . . . . 20.0 112.513 -179.363 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.904 HG21 ' O ' ' A' ' 62' ' ' ARG . 8.3 m -133.71 154.44 38.51 Favored 'Isoleucine or valine' 0 C--O 1.23 0.037 0 CA-C-O 120.857 0.36 . . . . 20.0 111.675 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 45.4 m -117.93 121.49 40.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.96 -0.563 . . . . 20.0 109.98 178.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.661 ' C ' HD12 ' A' ' 78' ' ' LEU . 81.0 tt0 -123.92 141.52 51.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.962 0.41 . . . . 20.0 111.814 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 1.02 HD13 ' O ' ' A' ' 137' ' ' VAL . 1.5 mp -117.57 125.68 51.23 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.864 -0.607 . . . . 20.0 110.965 179.297 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.794 HG23 ' O ' ' A' ' 79' ' ' VAL . 18.5 m . . . . . 0 N--CA 1.446 -0.657 0 CA-C-N 115.779 -0.646 . . . . 20.0 110.746 179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 . . . . . 0 CA--C 1.528 0.13 0 N-CA-C 112.327 0.491 . . . . 20.0 112.327 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . 0.447 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 42.3 ttm180 -121.69 147.87 45.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.033 0.444 . . . . 20.0 112.002 -178.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 1.019 ' CE2' HG13 ' A' ' 137' ' ' VAL . 0.1 OUTLIER -125.76 158.72 34.19 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.822 -0.626 . . . . 20.0 111.3 179.844 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 62.0 ttm-85 -93.51 142.53 27.24 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.661 -0.866 . . . . 20.0 108.661 178.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -80.78 132.81 35.55 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.138 0.494 . . . . 20.0 111.771 -178.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.83 ' HB2' HG23 ' A' ' 134' ' ' VAL . 92.1 mm-40 -129.62 144.32 51.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.457 -0.792 . . . . 20.0 109.967 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 48.7 ttp180 -139.65 91.08 2.45 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.507 -0.315 . . . . 20.0 110.7 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.985 HG11 ' HB2' ' A' ' 73' ' ' LYS . 0.6 OUTLIER -125.57 164.37 25.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.387 -0.37 . . . . 20.0 110.885 -179.869 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.553 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 14.0 pt20 -106.22 138.37 42.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.155 0.503 . . . . 20.0 111.137 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.832 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -79.43 126.91 31.45 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.573 -0.739 . . . . 20.0 111.443 -179.787 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.526 ' N ' ' O ' ' A' ' 70' ' ' ARG . 0.3 OUTLIER -76.2 144.53 40.41 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.236 -0.893 . . . . 20.0 109.773 179.29 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . . . . . . . . . 3.0 m . . . . . 0 C--N 1.324 -0.505 0 CA-C-N 116.104 -0.498 . . . . 20.0 110.113 -178.977 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.19 0 N-CA-C 112.382 0.512 . . . . 20.0 112.382 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -120.44 66.28 12.38 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-O 121.096 0.474 . . . . 20.0 110.393 179.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_endo -52.05 148.88 22.57 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 123.101 2.534 . . . . 20.0 112.635 -179.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.832 ' HB2' HD12 ' A' ' 121' ' ' LEU . 56.7 mtp85 -125.75 151.55 46.54 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.039 -0.528 . . . . 20.0 110.496 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.44 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 47.5 t -102.72 135.88 43.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.682 0.277 . . . . 20.0 110.392 179.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 25.7 tpt180 -144.72 144.82 31.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.169 0.509 . . . . 20.0 111.745 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 18.2 pttp -99.19 143.7 29.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.473 -0.785 . . . . 20.0 109.664 178.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.931 HG11 ' O ' ' A' ' 63' ' ' PHE . 3.1 m -146.33 130.0 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 CA-C-O 121.349 0.595 . . . . 20.0 111.252 -179.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . 0.825 ' C ' HD22 ' A' ' 136' ' ' LEU . 83.2 mtt-85 -92.79 127.79 38.42 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.128 -0.942 . . . . 20.0 110.207 179.424 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.825 HD22 ' C ' ' A' ' 135' ' ' ARG . 0.8 OUTLIER -117.6 114.38 23.33 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.005 0.372 . . . . 20.0 112.005 -178.871 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 1.02 ' O ' HD13 ' A' ' 78' ' ' LEU . 0.0 OUTLIER -59.74 76.51 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.798 0.333 . . . . 20.0 110.349 178.832 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.538 ' N ' ' O ' ' A' ' 136' ' ' LEU . . . -66.47 -10.46 44.55 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.196 -0.456 . . . . 20.0 110.832 -179.64 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 51.6 p . . . . . 0 C--N 1.326 -0.423 0 CA-C-N 115.882 -0.599 . . . . 20.0 110.108 179.28 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.233 0.205 0 CA-C-O 120.785 0.326 . . . . 20.0 110.706 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.74 ' CD1' HG13 ' A' ' 79' ' ' VAL . 12.7 m-85 -127.58 149.02 50.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.201 -0.454 . . . . 20.0 112.002 -179.078 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 57.8 p -107.95 90.46 3.3 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.802 -0.636 . . . . 20.0 111.518 -179.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.945 ' O ' HG21 ' A' ' 75' ' ' VAL . 40.7 mmt180 -120.52 125.03 46.83 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.524 -0.917 . . . . 20.0 108.524 178.079 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.575 ' CD1' ' O ' ' A' ' 73' ' ' LYS . 0.0 OUTLIER -112.88 -82.88 0.59 Allowed 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.729 0.64 . . . . 20.0 112.729 -178.185 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.625 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -168.84 141.83 2.84 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.475 -0.49 . . . . 20.0 112.136 -178.201 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.683 HG22 ' HG3' ' A' ' 70' ' ' ARG . 81.1 p -134.98 134.61 40.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.265 -0.425 . . . . 20.0 110.681 178.515 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.73 ' HB2' HD13 ' A' ' 121' ' ' LEU . 92.1 m-20 -141.32 -165.52 1.99 Allowed 'General case' 0 C--O 1.237 0.426 0 N-CA-C 109.7 -0.481 . . . . 20.0 109.7 179.411 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.786 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -30.32 143.98 0.01 OUTLIER Glycine 0 C--N 1.345 1.055 0 N-CA-C 110.243 -1.143 . . . . 20.0 110.243 179.334 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.505 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 14.1 Cg_exo -16.07 58.73 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 125.193 3.929 . . . . 20.0 115.412 -178.077 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.786 ' N ' ' O ' ' A' ' 67' ' ' GLY . 59.8 m -164.11 158.86 19.74 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 108.168 -1.049 . . . . 20.0 108.168 178.201 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.683 ' HG3' HG22 ' A' ' 65' ' ' THR . 49.4 ttp180 -150.81 143.16 24.26 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.93 0.715 . . . . 20.0 112.93 -179.312 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.625 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -84.28 160.77 20.67 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 115.202 -0.908 . . . . 20.0 110.36 178.554 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -147.51 28.05 0.99 Allowed 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 113.47 0.915 . . . . 20.0 113.47 -179.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 1.048 ' HB2' HG11 ' A' ' 119' ' ' VAL . 1.0 OUTLIER -72.95 155.8 90.22 Favored Pre-proline 0 C--N 1.324 -0.509 0 C-N-CA 120.548 -0.461 . . . . 20.0 110.09 179.268 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -61.3 119.45 6.6 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.352 2.035 . . . . 20.0 111.97 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.945 HG21 ' O ' ' A' ' 62' ' ' ARG . 11.1 m -135.71 147.01 28.75 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 CA-C-N 116.422 -0.354 . . . . 20.0 111.191 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 41.2 m -113.79 123.95 51.07 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.021 0.438 . . . . 20.0 110.294 178.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.613 ' C ' HD12 ' A' ' 78' ' ' LEU . 40.0 tp10 -128.67 138.36 52.12 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.713 -0.676 . . . . 20.0 110.401 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.887 HD13 ' O ' ' A' ' 137' ' ' VAL . 1.4 mp -115.39 134.21 55.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.43 -0.35 . . . . 20.0 110.56 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.782 HG23 ' O ' ' A' ' 79' ' ' VAL . 15.1 m . . . . . 0 N--CA 1.449 -0.52 0 CA-C-O 121.005 0.431 . . . . 20.0 111.335 -179.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 83.4 m-20 . . . . . 0 N--CA 1.455 -0.184 0 CA-C-O 120.633 0.254 . . . . 20.0 111.668 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . 0.536 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 38.9 ttm180 -118.07 151.95 36.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.734 0.302 . . . . 20.0 111.493 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.919 ' CE2' HG13 ' A' ' 137' ' ' VAL . 2.5 m-85 -127.82 164.18 22.76 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.611 0.72 . . . . 20.0 111.699 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.417 ' N ' ' O ' ' A' ' 136' ' ' LEU . 49.0 ttm-85 -99.21 145.27 27.42 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 114.732 -1.122 . . . . 20.0 108.078 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -90.59 115.11 27.47 Favored 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 120.164 -0.614 . . . . 20.0 111.187 -179.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -132.22 137.3 47.51 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.068 -0.514 . . . . 20.0 111.352 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . 0.499 ' HG2' ' HA ' ' A' ' 133' ' ' LYS . 87.6 mtt-85 -127.94 111.9 14.09 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.686 -0.688 . . . . 20.0 109.946 179.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 1.048 HG11 ' HB2' ' A' ' 73' ' ' LYS . 38.8 t -127.46 146.23 33.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 116.188 -0.46 . . . . 20.0 111.89 -178.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.579 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 28.3 mp0 -78.15 131.34 37.17 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 116.208 -0.451 . . . . 20.0 111.13 -179.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.905 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.3 OUTLIER -79.3 122.13 25.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 20.0 109.984 179.569 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.75 136.71 34.06 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.383 0.611 . . . . 20.0 111.851 -178.421 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . 0.505 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.497 0 CA-C-N 115.359 -0.837 . . . . 20.0 109.986 179.289 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.139 0 N-CA-C 112.399 0.518 . . . . 20.0 112.399 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -121.29 57.08 6.42 Favored Pre-proline 0 C--N 1.33 -0.254 0 N-CA-C 112.269 0.47 . . . . 20.0 112.269 -179.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . 0.499 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 37.7 Cg_endo -67.4 141.46 56.24 Favored 'Trans proline' 0 CA--C 1.528 0.221 0 C-N-CA 122.512 2.141 . . . . 20.0 111.722 178.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.905 ' HB2' HD12 ' A' ' 121' ' ' LEU . 84.5 mtt180 -139.64 136.47 34.36 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 121.019 -0.272 . . . . 20.0 111.511 -179.578 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 28.1 t -88.1 133.75 33.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.85 0.357 . . . . 20.0 111.43 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . 0.495 ' HD3' ' HB2' ' A' ' 64' ' ' LEU . 58.1 ttt85 -139.94 138.08 35.29 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.119 -0.491 . . . . 20.0 111.783 -179.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.499 ' HA ' ' HG2' ' A' ' 118' ' ' ARG . 12.0 pttt -87.08 142.94 27.55 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.103 -0.498 . . . . 20.0 110.122 179.015 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.611 HG12 ' CD2' ' A' ' 136' ' ' LEU . 15.6 t -142.58 126.03 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 CA-C-O 121.284 0.564 . . . . 20.0 111.477 -179.611 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . 0.48 ' O ' ' CD2' ' A' ' 114' ' ' TYR . 99.7 mtt180 -95.13 99.07 11.11 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.152 -0.931 . . . . 20.0 109.265 178.148 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.611 ' CD2' HG12 ' A' ' 134' ' ' VAL . 5.3 mt -104.78 133.85 48.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.461 0.648 . . . . 20.0 112.502 -179.335 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.919 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.3 OUTLIER -68.93 89.34 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.286 -0.87 . . . . 20.0 112.106 -179.587 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -72.32 -12.6 61.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.333 0.587 . . . . 20.0 109.481 178.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 5.6 t . . . . . 0 CA--C 1.529 0.165 0 CA-C-N 115.246 -0.888 . . . . 20.0 110.303 179.048 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . 0.603 ' CG ' HG22 ' A' ' 76' ' ' THR . 30.0 m170 . . . . . 0 C--O 1.232 0.178 0 N-CA-C 112.022 0.379 . . . . 20.0 112.022 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.655 ' CZ ' HG12 ' A' ' 79' ' ' VAL . 0.2 OUTLIER -153.55 168.67 25.38 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.24 -0.436 . . . . 20.0 111.198 179.514 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.627 ' CG2' ' CZ ' ' A' ' 63' ' ' PHE . 32.3 m -93.8 126.58 39.07 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.87 0.843 . . . . 20.0 112.912 -178.434 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.862 ' O ' HG21 ' A' ' 75' ' ' VAL . 40.7 mtm180 -169.43 121.01 0.72 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.21 -1.359 . . . . 20.0 108.038 177.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.627 ' CZ ' ' CG2' ' A' ' 61' ' ' THR . 0.0 OUTLIER -120.28 -81.04 0.63 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 113.027 0.751 . . . . 20.0 113.027 -178.047 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.913 HD21 ' HB ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -166.58 139.68 3.85 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.169 0.433 . . . . 20.0 112.169 -177.756 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.466 ' O ' ' OD1' ' A' ' 66' ' ' ASP . 68.9 p -133.42 128.29 35.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.805 -0.634 . . . . 20.0 110.232 178.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.918 ' HB2' HD13 ' A' ' 121' ' ' LEU . 73.6 m-20 -139.42 -165.06 1.79 Allowed 'General case' 0 C--O 1.236 0.346 0 N-CA-C 110.011 -0.366 . . . . 20.0 110.011 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.833 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -29.59 144.61 0.01 OUTLIER Glycine 0 C--N 1.344 0.988 0 CA-C-O 118.798 -1.001 . . . . 20.0 110.733 179.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.504 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 39.0 Cg_exo -14.91 54.51 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.723 1 C-N-CA 125.949 4.433 . . . . 20.0 115.106 -178.756 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.833 ' N ' ' O ' ' A' ' 67' ' ' GLY . 17.1 m -163.27 157.67 20.55 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.138 -1.06 . . . . 20.0 108.138 178.677 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -145.98 146.92 31.19 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.091 0.472 . . . . 20.0 112.042 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.623 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -89.23 160.72 16.79 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 115.512 -0.767 . . . . 20.0 109.955 178.861 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -149.87 28.49 0.76 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 114.21 1.189 . . . . 20.0 114.21 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.589 ' O ' ' CD2' ' A' ' 63' ' ' PHE . 17.3 tttt -73.72 140.48 78.18 Favored Pre-proline 0 C--N 1.328 -0.332 0 C-N-CA 120.551 -0.459 . . . . 20.0 110.164 178.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.531 ' HD2' ' HG2' ' A' ' 73' ' ' LYS . 63.9 Cg_exo -51.34 125.87 17.7 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 122.392 2.061 . . . . 20.0 112.419 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.862 HG21 ' O ' ' A' ' 62' ' ' ARG . 26.3 m -133.63 163.25 37.97 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.159 0 CA-C-O 121.123 0.487 . . . . 20.0 112.033 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.603 HG22 ' CG ' ' A' ' 59' ' ' HIS . 0.2 OUTLIER -136.76 100.37 4.3 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.635 -0.711 . . . . 20.0 109.916 178.944 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.598 ' CD ' HD12 ' A' ' 136' ' ' LEU . 83.5 mt-10 -114.43 162.98 15.96 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.1 -0.5 . . . . 20.0 111.568 -178.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.834 HD13 ' O ' ' A' ' 137' ' ' VAL . 5.6 mp -111.1 142.35 43.39 Favored 'General case' 0 CA--C 1.512 -0.498 0 CA-C-O 121.355 0.598 . . . . 20.0 111.302 179.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.82 HG23 ' O ' ' A' ' 79' ' ' VAL . 7.7 m . . . . . 0 C--N 1.318 -0.796 0 CA-C-N 115.294 -0.866 . . . . 20.0 110.718 -179.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 . . . . . 0 CA--C 1.529 0.156 0 N-CA-C 112.552 0.575 . . . . 20.0 112.552 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . 0.427 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 60.9 ttm-85 -122.99 142.72 50.53 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.436 -0.347 . . . . 20.0 111.376 -179.017 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.886 ' CD2' HG13 ' A' ' 137' ' ' VAL . 0.7 OUTLIER -118.61 158.1 26.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.093 0.473 . . . . 20.0 111.296 -179.61 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 55.0 ttm-85 -97.29 141.63 30.16 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.807 -0.812 . . . . 20.0 108.807 178.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -77.66 128.15 33.62 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.878 0.37 . . . . 20.0 111.859 -178.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.837 ' HG2' HD23 ' A' ' 136' ' ' LEU . 89.6 mm-40 -126.99 137.15 53.05 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.117 -0.492 . . . . 20.0 111.233 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -133.94 94.23 3.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.971 -0.559 . . . . 20.0 110.451 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.913 ' HB ' HD21 ' A' ' 64' ' ' LEU . 29.1 t -123.81 147.64 28.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.351 -0.386 . . . . 20.0 110.49 179.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.563 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 20.0 pt20 -94.37 133.87 37.47 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.42 -0.512 . . . . 20.0 110.71 -179.594 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.918 HD13 ' HB2' ' A' ' 66' ' ' ASP . 0.1 OUTLIER -77.33 118.65 20.02 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.421 0.629 . . . . 20.0 110.851 -179.717 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.16 140.86 37.66 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.002 -0.999 . . . . 20.0 111.124 -179.328 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . 0.504 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.3 OUTLIER . . . . . 0 N--CA 1.446 -0.673 0 CA-C-N 115.619 -0.719 . . . . 20.0 109.578 179.128 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.458 ' O ' ' HD2' ' A' ' 129' ' ' PRO . . . . . . . . 0 N--CA 1.456 -0.165 0 N-CA-C 111.775 0.287 . . . . 20.0 111.775 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -118.06 60.74 3.79 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-O 120.976 0.417 . . . . 20.0 111.892 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . 0.458 ' HD2' ' O ' ' A' ' 127' ' ' ALA . 3.3 Cg_endo -46.37 155.32 0.72 Allowed 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 123.059 2.506 . . . . 20.0 111.458 178.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.774 ' HB2' HD12 ' A' ' 121' ' ' LEU . 72.4 mtt85 -130.0 154.35 47.48 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.434 -0.348 . . . . 20.0 110.541 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.534 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 29.7 m -107.19 140.81 39.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.719 0.295 . . . . 20.0 110.392 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . 0.5 ' HD3' ' CB ' ' A' ' 64' ' ' LEU . 56.6 ttt85 -141.92 142.64 33.04 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.162 0.506 . . . . 20.0 112.203 -179.353 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 7.5 pttt -93.3 143.95 25.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.492 -0.776 . . . . 20.0 109.076 178.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.454 ' O ' ' CD2' ' A' ' 136' ' ' LEU . 3.1 t -143.99 121.15 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 CA-C-O 121.164 0.507 . . . . 20.0 111.805 -178.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . 0.598 ' C ' HD22 ' A' ' 136' ' ' LEU . 87.3 mtm-85 -92.26 112.66 24.69 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.321 -0.854 . . . . 20.0 109.289 178.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.837 HD23 ' HG2' ' A' ' 117' ' ' GLN . 1.6 mm? -113.98 123.78 50.54 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.337 0.589 . . . . 20.0 112.279 -178.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.886 HG13 ' CD2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -57.5 84.39 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.411 -0.813 . . . . 20.0 111.672 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . 0.49 ' HA ' ' CD1' ' A' ' 78' ' ' LEU . . . -69.83 -16.12 63.22 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.408 -0.517 . . . . 20.0 109.818 178.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.0 t . . . . . 0 C--O 1.233 0.207 0 CA-C-N 115.748 -0.66 . . . . 20.0 110.511 178.979 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . 0.469 ' CD2' ' HG ' ' A' ' 78' ' ' LEU . 5.0 m170 . . . . . 0 CA--C 1.53 0.179 0 N-CA-C 110.078 -0.342 . . . . 20.0 110.078 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.668 ' CZ ' HG11 ' A' ' 79' ' ' VAL . 17.8 m-30 -119.89 145.84 46.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.938 0.399 . . . . 20.0 111.355 -179.649 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 26.9 p -109.56 88.97 2.87 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.939 -0.573 . . . . 20.0 111.743 -179.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 1.063 ' O ' HG21 ' A' ' 75' ' ' VAL . 64.3 ttt-85 -119.94 122.37 41.07 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.445 -0.946 . . . . 20.0 108.445 177.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.695 ' O ' HD23 ' A' ' 64' ' ' LEU . 0.2 OUTLIER -105.22 -81.2 0.54 Allowed 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.779 0.659 . . . . 20.0 112.779 -177.538 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.695 HD23 ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -170.21 139.9 1.83 Allowed 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.566 -0.454 . . . . 20.0 111.828 -178.617 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.96 HG22 ' HG3' ' A' ' 70' ' ' ARG . 29.6 p -134.19 132.22 39.5 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.9 -0.591 . . . . 20.0 110.579 179.062 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.857 ' HB2' HD13 ' A' ' 121' ' ' LEU . 94.0 m-20 -141.98 -163.76 1.65 Allowed 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.946 -0.39 . . . . 20.0 109.946 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.812 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -28.47 144.41 0.01 OUTLIER Glycine 0 C--N 1.346 1.113 0 CA-C-O 118.736 -1.036 . . . . 20.0 110.633 179.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.551 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 50.1 Cg_exo -15.78 57.13 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.78 1 C-N-CA 125.373 4.049 . . . . 20.0 115.271 -178.53 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.812 ' N ' ' O ' ' A' ' 67' ' ' GLY . 81.5 m -164.98 164.16 20.67 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 108.625 -0.88 . . . . 20.0 108.625 178.4 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.96 ' HG3' HG22 ' A' ' 65' ' ' THR . 54.6 ttt180 -152.29 143.34 23.11 Favored 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 112.377 0.51 . . . . 20.0 112.377 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.984 ' HA ' HD12 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -86.06 161.48 18.91 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 115.718 -0.674 . . . . 20.0 110.844 179.156 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . 0.548 ' HA ' ' CD2' ' A' ' 63' ' ' PHE . . . -140.64 29.29 1.94 Allowed 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 113.0 0.741 . . . . 20.0 113.0 -179.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.823 ' CB ' HG21 ' A' ' 119' ' ' VAL . 4.9 tmtm? -73.4 133.29 80.73 Favored Pre-proline 0 C--N 1.329 -0.316 0 C-N-CA 120.958 -0.297 . . . . 20.0 110.335 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . 0.474 ' HD2' ' HG2' ' A' ' 73' ' ' LYS . 50.7 Cg_exo -54.58 122.39 11.48 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.655 2.237 . . . . 20.0 112.356 -179.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 1.063 HG21 ' O ' ' A' ' 62' ' ' ARG . 5.1 m -135.54 159.57 40.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.852 -0.613 . . . . 20.0 111.167 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 38.8 m -118.57 128.78 54.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.083 0.468 . . . . 20.0 110.858 178.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.546 ' HB3' ' HB2' ' A' ' 60' ' ' TYR . 84.8 tt0 -131.54 139.2 49.19 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.642 -0.708 . . . . 20.0 110.031 179.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.833 HD12 ' N ' ' A' ' 78' ' ' LEU . 1.0 OUTLIER -111.37 144.32 40.75 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.307 0.575 . . . . 20.0 112.127 -179.05 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.668 HG11 ' CZ ' ' A' ' 60' ' ' TYR . 0.7 OUTLIER . . . . . 0 C--N 1.322 -0.601 0 N-CA-C 108.252 -1.018 . . . . 20.0 108.252 178.612 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 . . . . . 0 N--CA 1.456 -0.172 0 CA-C-O 120.803 0.335 . . . . 20.0 111.752 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . 0.447 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 35.1 ttm180 -122.97 147.47 46.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.284 -0.416 . . . . 20.0 110.909 -179.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.854 ' CE2' HG13 ' A' ' 137' ' ' VAL . 0.5 OUTLIER -120.73 155.93 32.89 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.404 0.621 . . . . 20.0 111.558 -179.456 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.429 ' HD2' ' NE2' ' A' ' 117' ' ' GLN . 48.3 ttm-85 -95.11 142.66 27.3 Favored 'General case' 0 N--CA 1.443 -0.785 0 N-CA-C 108.327 -0.99 . . . . 20.0 108.327 177.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . 0.52 ' O ' ' NE2' ' A' ' 117' ' ' GLN . . . -80.51 130.98 35.48 Favored 'General case' 0 C--N 1.315 -0.913 0 C-N-CA 120.662 -0.415 . . . . 20.0 111.365 -178.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.664 ' HB2' HG23 ' A' ' 134' ' ' VAL . 87.8 mm-40 -131.58 127.64 37.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.054 -0.521 . . . . 20.0 111.122 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 80.1 mtm180 -129.38 96.06 4.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.068 -0.514 . . . . 20.0 110.358 179.079 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 0.823 HG21 ' CB ' ' A' ' 73' ' ' LYS . 59.5 t -122.1 144.54 31.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.544 -0.753 . . . . 20.0 110.934 -179.472 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.507 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 24.2 mp0 -82.13 121.48 26.65 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.812 -0.44 . . . . 20.0 109.812 179.621 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.857 HD13 ' HB2' ' A' ' 66' ' ' ASP . 0.2 OUTLIER -66.35 126.33 28.43 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.197 0.523 . . . . 20.0 110.649 -179.093 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.984 HD12 ' HA ' ' A' ' 71' ' ' SER . 0.9 OUTLIER -91.52 144.08 25.92 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.397 -0.82 . . . . 20.0 111.312 -178.742 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . 0.551 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER . . . . . 0 C--N 1.322 -0.596 0 CA-C-N 115.688 -0.687 . . . . 20.0 111.382 -179.663 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . 0.469 ' C ' ' HD3' ' A' ' 129' ' ' PRO . . . . . . . . 0 N--CA 1.456 -0.151 0 N-CA-C 111.767 0.284 . . . . 20.0 111.767 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -113.12 56.76 0.59 Allowed Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.968 0.413 . . . . 20.0 110.605 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . 0.469 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 46.8 Cg_endo -68.2 151.18 77.07 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.934 2.423 . . . . 20.0 112.752 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.552 ' HB2' HD12 ' A' ' 121' ' ' LEU . 99.7 mtt180 -138.71 151.04 46.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.122 -0.49 . . . . 20.0 110.987 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 10.6 t -91.11 139.21 30.97 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.623 0.249 . . . . 20.0 110.954 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . 0.524 ' HD3' ' CB ' ' A' ' 64' ' ' LEU . 54.6 ttt85 -146.23 143.77 29.44 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.082 0.467 . . . . 20.0 112.086 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . 0.475 ' HA ' ' O ' ' A' ' 117' ' ' GLN . 25.4 pttm -104.42 142.08 35.22 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.589 -0.732 . . . . 20.0 110.006 178.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.664 HG23 ' HB2' ' A' ' 117' ' ' GLN . 1.8 m -147.58 128.65 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-O 121.276 0.56 . . . . 20.0 110.97 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . 0.541 ' HB3' ' HB2' ' A' ' 114' ' ' TYR . 91.2 mtt-85 -89.62 110.99 21.81 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.282 -0.872 . . . . 20.0 110.315 179.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.587 ' CD2' ' N ' ' A' ' 136' ' ' LEU . 0.2 OUTLIER -107.86 127.24 53.55 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.873 0.368 . . . . 20.0 111.067 -179.811 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.854 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -63.05 88.73 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.816 0.341 . . . . 20.0 111.666 -179.941 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.68 -23.88 66.39 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.25 0.548 . . . . 20.0 109.602 179.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 37.0 t . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 115.342 -0.844 . . . . 20.0 111.325 179.483 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . 0.553 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 38.4 m80 . . . . . 0 CA--C 1.528 0.134 0 CA-C-O 120.561 0.22 . . . . 20.0 111.085 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.614 ' CE2' HG11 ' A' ' 79' ' ' VAL . 10.2 m-30 -115.51 152.53 32.82 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.974 0.416 . . . . 20.0 111.765 -179.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 58.6 p -102.53 79.68 1.84 Allowed 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.9 -0.591 . . . . 20.0 111.198 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.911 ' O ' HG21 ' A' ' 75' ' ' VAL . 16.1 tpt180 -118.32 120.27 37.13 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 108.712 -0.847 . . . . 20.0 108.712 178.197 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.636 ' C ' HD23 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -109.08 -79.44 0.58 Allowed 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 112.663 0.616 . . . . 20.0 112.663 -177.786 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 1.002 HD11 HG23 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -168.29 137.75 2.44 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.699 -0.4 . . . . 20.0 111.869 -178.063 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.693 HG22 ' HG3' ' A' ' 70' ' ' ARG . 19.3 p -129.45 149.12 51.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.852 0.358 . . . . 20.0 110.263 178.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.506 ' O ' ' C ' ' A' ' 67' ' ' GLY . 24.7 t0 -154.45 -165.51 2.09 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.396 -0.594 . . . . 20.0 109.396 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.847 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -32.29 147.55 0.01 OUTLIER Glycine 0 C--N 1.345 1.082 0 N-CA-C 109.879 -1.289 . . . . 20.0 109.879 178.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.502 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 25.3 Cg_exo -15.95 55.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 125.138 3.892 . . . . 20.0 115.29 -178.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' CYS . . . . . 0.847 ' N ' ' O ' ' A' ' 67' ' ' GLY . 33.3 m -162.23 162.41 28.21 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 123.492 0.717 . . . . 20.0 109.121 178.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . 0.693 ' HG3' HG22 ' A' ' 65' ' ' THR . 75.7 ttt180 -158.41 144.58 17.11 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.079 0.466 . . . . 20.0 111.988 179.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . 0.644 ' HB3' HD12 ' A' ' 64' ' ' LEU . 1.0 OUTLIER -83.05 172.37 12.8 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 115.59 -0.732 . . . . 20.0 110.819 179.287 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -152.87 36.51 0.49 Allowed 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.26 -0.576 . . . . 20.0 112.422 178.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . 0.652 ' CB ' HG11 ' A' ' 119' ' ' VAL . 30.3 mmtt -79.89 163.68 56.88 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.405 -0.361 . . . . 20.0 110.637 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -63.51 116.07 3.42 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.601 2.201 . . . . 20.0 112.505 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' VAL . . . . . 0.911 HG21 ' O ' ' A' ' 62' ' ' ARG . 4.4 m -140.07 136.52 37.99 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 CA-C-N 116.573 -0.285 . . . . 20.0 111.101 179.332 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.446 HG23 ' HB3' ' A' ' 59' ' ' HIS . 54.6 m -126.49 123.29 37.48 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 120.918 0.389 . . . . 20.0 112.031 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.57 ' CG ' ' HB2' ' A' ' 60' ' ' TYR . 20.0 pt-20 -131.17 148.64 52.74 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.034 -0.53 . . . . 20.0 109.677 178.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LEU . . . . . 0.568 HD12 ' N ' ' A' ' 78' ' ' LEU . 6.5 mp -101.07 158.36 16.07 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 113.575 0.954 . . . . 20.0 113.575 -178.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' VAL . . . . . 0.81 HG23 ' O ' ' A' ' 79' ' ' VAL . 1.4 m . . . . . 0 N--CA 1.446 -0.647 0 CA-C-N 113.903 -1.499 . . . . 20.0 109.162 178.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 67.5 t0 . . . . . 0 N--CA 1.457 -0.084 0 CA-C-O 120.768 0.318 . . . . 20.0 111.686 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' ARG . . . . . 0.521 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 48.0 ttt180 -121.38 150.16 41.89 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.298 -0.41 . . . . 20.0 111.072 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' TYR . . . . . 0.816 ' CE2' HG13 ' A' ' 137' ' ' VAL . 0.5 OUTLIER -125.48 160.77 28.67 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.702 0.763 . . . . 20.0 112.629 -179.289 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.53 ' HD2' ' NE2' ' A' ' 117' ' ' GLN . 42.9 ttm-85 -97.84 140.4 32.26 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 114.539 -1.21 . . . . 20.0 107.907 176.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -80.51 130.66 35.28 Favored 'General case' 0 C--N 1.313 -0.988 0 C-N-CA 120.683 -0.407 . . . . 20.0 111.633 -178.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.53 ' NE2' ' HD2' ' A' ' 115' ' ' ARG . 89.1 mm-40 -133.79 136.62 44.62 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.09 -0.504 . . . . 20.0 110.807 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 50.1 ttt180 -134.02 94.71 3.3 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.996 -0.547 . . . . 20.0 110.189 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' VAL . . . . . 1.002 HG23 HD11 ' A' ' 64' ' ' LEU . 9.1 m -131.61 162.19 39.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.861 -0.608 . . . . 20.0 110.859 -179.402 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' GLN . . . . . 0.567 ' HA ' ' HA ' ' A' ' 131' ' ' SER . 21.7 pt20 -99.86 143.46 30.05 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.286 -0.415 . . . . 20.0 112.017 -179.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.783 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -79.51 131.52 36.06 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.85 -0.614 . . . . 20.0 110.049 179.456 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' LEU . . . . . 0.642 HD12 ' N ' ' A' ' 122' ' ' LEU . 3.5 mp -97.22 140.76 31.23 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.774 -0.648 . . . . 20.0 111.942 -178.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' CYS . . . . . 0.502 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER . . . . . 0 C--N 1.323 -0.578 0 CA-C-N 115.176 -0.92 . . . . 20.0 109.837 179.313 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.206 0 N-CA-C 111.849 0.314 . . . . 20.0 111.849 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -122.2 59.14 10.88 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 120.939 0.4 . . . . 20.0 111.741 -179.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' PRO . . . . . 0.42 ' HB2' ' NE2' ' A' ' 120' ' ' GLN . 12.4 Cg_endo -55.75 149.18 51.4 Favored 'Trans proline' 0 CA--C 1.528 0.203 0 C-N-CA 122.981 2.454 . . . . 20.0 111.945 179.229 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' ARG . . . . . 0.783 ' HB2' HD12 ' A' ' 121' ' ' LEU . 95.9 mtt-85 -130.49 155.57 46.24 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.358 -0.383 . . . . 20.0 110.822 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' SER . . . . . 0.567 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 66.6 m -109.04 133.91 52.36 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.898 0.38 . . . . 20.0 111.936 -179.606 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' ARG . . . . . 0.462 ' HD2' ' HB2' ' A' ' 64' ' ' LEU . 15.8 ttm180 -140.96 142.44 34.33 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.045 -0.525 . . . . 20.0 111.879 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -100.15 146.51 26.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.596 -0.729 . . . . 20.0 109.155 178.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' VAL . . . . . 0.528 HG21 ' O ' ' A' ' 63' ' ' PHE . 0.4 OUTLIER -153.03 133.3 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-O 121.385 0.612 . . . . 20.0 112.398 -178.576 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' ARG . . . . . 0.489 ' C ' HD23 ' A' ' 136' ' ' LEU . 62.1 mtp85 -91.37 113.06 25.23 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.823 -1.081 . . . . 20.0 109.89 178.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.768 HD12 ' HB ' ' A' ' 75' ' ' VAL . 7.6 mt -112.38 130.02 56.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.971 0.415 . . . . 20.0 111.927 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' VAL . . . . . 0.816 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.2 OUTLIER -64.61 94.58 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 112.401 0.519 . . . . 20.0 112.401 -179.407 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -80.27 -7.07 58.85 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-O 121.158 0.504 . . . . 20.0 109.74 178.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 20.1 t . . . . . 0 N--CA 1.461 0.117 0 CA-C-N 115.405 -0.816 . . . . 20.0 109.919 179.13 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.5 mttt . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.762 0.315 . . . . 20.0 111.424 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.494 ' HA ' ' HG3' ' A' ' 52' ' ' GLU . 89.6 m-20 -85.07 14.15 5.35 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.33 -0.395 . . . . 20.0 110.956 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 50.5 t -68.86 -38.86 79.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.125 -0.489 . . . . 20.0 111.732 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 69.8 m -83.87 -1.41 54.39 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.314 -0.403 . . . . 20.0 111.852 -179.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.494 ' HG3' ' HA ' ' A' ' 49' ' ' ASP . 97.3 mt-10 -63.3 -33.7 76.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.73 0.3 . . . . 20.0 110.751 179.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.627 ' CD1' ' CB ' ' A' ' 142' ' ' CYS . 0.0 OUTLIER -110.99 -80.11 0.58 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.171 0.51 . . . . 20.0 110.487 179.463 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.464 ' O ' ' SG ' ' A' ' 55' ' ' CYS . 28.2 t -147.08 -160.39 1.15 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.442 -0.799 . . . . 20.0 109.981 179.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.464 ' SG ' ' O ' ' A' ' 54' ' ' SER . 3.8 p 41.75 50.3 3.95 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.279 -0.419 . . . . 20.0 111.31 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.598 ' CZ ' HD12 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -55.36 -168.06 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.307 -0.406 . . . . 20.0 110.555 179.603 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.436 ' N ' ' HG2' ' A' ' 56' ' ' ARG . 97.6 mt-10 -67.07 70.98 0.09 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.586 -0.524 . . . . 20.0 109.586 179.014 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.99 HD22 HG22 ' A' ' 79' ' ' VAL . 7.9 tt -96.13 142.2 28.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.595 -0.73 . . . . 20.0 111.726 -178.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.676 ' N ' HD23 ' A' ' 58' ' ' LEU . 30.4 m170 -122.55 140.04 53.23 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.538 -0.755 . . . . 20.0 111.854 -179.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.59 ' CZ ' HG11 ' A' ' 79' ' ' VAL . 0.8 OUTLIER -126.15 166.28 17.34 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.125 -0.488 . . . . 20.0 111.143 179.793 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.95 79.67 1.54 Allowed 'General case' 0 C--O 1.231 0.121 0 CA-C-O 120.999 0.428 . . . . 20.0 111.716 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.947 ' O ' HG21 ' A' ' 75' ' ' VAL . 53.0 mtm180 -124.7 124.29 41.86 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 108.154 -1.054 . . . . 20.0 108.154 177.571 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.656 ' CD1' HG22 ' A' ' 75' ' ' VAL . 0.1 OUTLIER -109.53 -79.08 0.58 Allowed 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 113.007 0.743 . . . . 20.0 113.007 -177.368 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.943 HD21 ' HB ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -170.72 136.74 1.23 Allowed 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.277 -0.569 . . . . 20.0 112.435 -178.128 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.974 HG22 ' HG3' ' A' ' 70' ' ' ARG . 16.8 p -132.96 132.06 41.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.06 -0.518 . . . . 20.0 110.295 178.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.598 ' HB2' HD13 ' A' ' 121' ' ' LEU . 91.7 m-20 -140.27 -163.68 1.57 Allowed 'General case' 0 C--O 1.237 0.44 0 N-CA-C 110.074 -0.343 . . . . 20.0 110.074 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.837 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -29.86 146.2 0.01 OUTLIER Glycine 0 C--N 1.345 1.036 0 CA-C-O 118.597 -1.113 . . . . 20.0 110.622 179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.492 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 39.6 Cg_exo -15.11 56.23 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 125.292 3.995 . . . . 20.0 115.183 -178.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.837 ' N ' ' O ' ' A' ' 67' ' ' GLY . 39.8 m -163.84 163.68 23.76 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 108.453 -0.943 . . . . 20.0 108.453 178.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.974 ' HG3' HG22 ' A' ' 65' ' ' THR . 58.0 ttp180 -154.64 145.88 22.88 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.112 0.482 . . . . 20.0 111.84 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 1.002 ' HA ' HD12 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -89.27 160.54 16.86 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.751 -0.659 . . . . 20.0 110.465 179.075 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.465 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . . . -147.66 28.36 0.96 Allowed 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.177 0.806 . . . . 20.0 113.177 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.651 ' HB3' HG21 ' A' ' 119' ' ' VAL . 1.5 tttt -79.33 143.2 59.71 Favored Pre-proline 0 C--N 1.326 -0.436 0 N-CA-C 110.017 -0.364 . . . . 20.0 110.017 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.506 ' HD2' ' HG3' ' A' ' 73' ' ' LYS . 76.9 Cg_exo -51.28 122.29 9.85 Favored 'Trans proline' 0 C--O 1.232 0.225 0 C-N-CA 122.758 2.306 . . . . 20.0 113.024 -178.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.947 HG21 ' O ' ' A' ' 62' ' ' ARG . 20.0 m -136.72 145.5 30.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 115.791 -0.641 . . . . 20.0 110.97 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 41.7 m -119.14 128.52 54.35 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.919 0.39 . . . . 20.0 110.307 178.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.688 ' OE1' HD12 ' A' ' 136' ' ' LEU . 20.3 pt-20 -143.32 150.32 39.02 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.894 -0.594 . . . . 20.0 110.252 179.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.593 HD12 ' N ' ' A' ' 78' ' ' LEU . 6.0 mp -100.91 140.99 34.42 Favored 'General case' 0 CA--C 1.508 -0.651 0 CA-C-O 121.174 0.511 . . . . 20.0 111.076 179.685 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.99 HG22 HD22 ' A' ' 58' ' ' LEU . 10.7 m -97.92 86.25 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.91 0 CA-C-N 115.423 -0.808 . . . . 20.0 109.842 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.427 ' HA ' ' CB ' ' A' ' 55' ' ' CYS . 0.1 OUTLIER -81.46 90.45 6.21 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.691 -0.686 . . . . 20.0 110.809 -179.182 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.7 p -150.48 114.74 5.13 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.597 -0.729 . . . . 20.0 110.385 179.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.531 ' O ' ' HA ' ' A' ' 108' ' ' ARG . . . -162.41 -142.55 3.42 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.863 -0.684 . . . . 20.0 112.058 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 85.2 mt-30 -135.17 138.56 43.8 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 110.238 -0.282 . . . . 20.0 110.238 179.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.429 ' SG ' ' CG ' ' A' ' 53' ' ' TYR . 5.1 m -160.9 24.12 0.14 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.82 0.343 . . . . 20.0 110.905 -179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . 0.571 ' HA3' ' CD2' ' A' ' 107' ' ' PHE . . . -129.0 162.18 22.51 Favored Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.624 -0.798 . . . . 20.0 112.571 -179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -59.81 146.34 95.9 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 123.022 2.482 . . . . 20.0 112.601 179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -92.62 23.0 4.29 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.144 -0.48 . . . . 20.0 110.673 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 29.9 tpt180 -69.69 130.48 42.48 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.842 -0.617 . . . . 20.0 111.639 -179.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.549 HD22 ' N ' ' A' ' 89' ' ' LEU . 1.3 mm? -97.2 134.42 40.54 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.811 -0.631 . . . . 20.0 109.83 179.064 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.541 ' H ' HD12 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -109.4 98.34 31.4 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-O 120.749 0.309 . . . . 20.0 111.42 -179.578 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 90' ' ' LEU . 56.7 Cg_endo -70.92 115.34 4.22 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.638 2.225 . . . . 20.0 111.976 179.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.507 ' O ' ' CZ2' ' A' ' 99' ' ' TRP . 86.6 m-20 -139.78 31.31 2.04 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.194 -0.457 . . . . 20.0 111.255 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.799 ' HB1' HG22 ' A' ' 97' ' ' VAL . . . -65.14 -1.91 2.51 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.352 0.501 . . . . 20.0 112.352 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.444 HG13 ' O ' ' A' ' 92' ' ' ASN . 1.1 mt 33.89 32.49 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 121.313 0.577 . . . . 20.0 111.4 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.509 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 108.52 -42.57 1.91 Allowed Glycine 0 N--CA 1.451 -0.3 0 CA-C-N 115.306 -0.861 . . . . 20.0 112.993 179.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.511 ' HD3' ' CE ' ' A' ' 98' ' ' LYS . 52.2 ttt180 -122.13 132.01 54.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.801 0.334 . . . . 20.0 110.934 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.799 HG22 ' HB1' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -116.38 113.06 41.97 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 CA-C-O 121.276 0.56 . . . . 20.0 110.863 -179.739 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.542 ' HG3' ' N ' ' A' ' 99' ' ' TRP . 9.2 ptpt -147.6 -45.76 0.17 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.249 -0.887 . . . . 20.0 110.334 -179.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.653 ' CZ3' ' CE3' ' A' ' 100' ' ' TRP . 0.2 OUTLIER -58.76 -84.39 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.26 -1.336 . . . . 20.0 109.783 179.985 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' TRP . . . . . 0.732 ' CZ3' HG13 ' A' ' 97' ' ' VAL . 0.0 OUTLIER -96.42 -176.46 3.64 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.325 -0.991 . . . . 20.0 108.325 177.698 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.757 ' HD2' HG12 ' A' ' 97' ' ' VAL . 36.1 mmm-85 -166.35 140.77 3.56 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 120.665 0.269 . . . . 20.0 110.746 178.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 101' ' ' ARG . 32.0 Cg_exo -59.44 47.63 0.06 OUTLIER 'Trans proline' 0 N--CA 1.476 0.487 0 C-N-CA 123.569 2.846 . . . . 20.0 113.954 -179.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.497 ' N ' ' O ' ' A' ' 101' ' ' ARG . 71.2 m-20 -82.38 2.74 30.94 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.83 0.348 . . . . 20.0 110.465 179.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.417 ' HA2' ' HD3' ' A' ' 105' ' ' PRO . . . 108.27 144.91 11.32 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 121.193 -0.527 . . . . 20.0 112.611 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.618 ' HB2' ' CE2' ' A' ' 107' ' ' PHE . 11.7 Cg_exo -69.86 147.05 61.37 Favored 'Trans proline' 0 C--N 1.344 0.316 0 C-N-CA 122.937 2.425 . . . . 20.0 112.339 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -85.85 102.25 13.55 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.369 -0.378 . . . . 20.0 110.899 179.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.618 ' CE2' ' HB2' ' A' ' 105' ' ' PRO . 25.3 m-85 -126.09 149.7 48.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.324 -0.398 . . . . 20.0 110.805 179.457 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.531 ' HA ' ' O ' ' A' ' 82' ' ' GLY . 25.5 ptt180 -170.72 179.68 3.15 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.942 0.401 . . . . 20.0 111.194 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 142' ' ' CYS . 24.6 m -69.6 146.27 51.87 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.036 -0.529 . . . . 20.0 109.657 179.477 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.447 HG12 ' O ' ' A' ' 143' ' ' LYS . 3.2 mm -113.76 121.52 36.95 Favored Pre-proline 0 C--N 1.326 -0.444 0 CA-C-O 120.865 0.364 . . . . 20.0 111.948 -179.439 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.935 ' CB ' HG11 ' A' ' 137' ' ' VAL . 36.8 Cg_endo -64.86 134.99 42.54 Favored 'Trans proline' 0 C--N 1.343 0.261 0 C-N-CA 122.516 2.144 . . . . 20.0 111.427 179.17 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 93.3 m-20 -107.83 -66.83 1.0 Allowed 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.018 0.377 . . . . 20.0 112.018 -179.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.402 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 25.3 ttm180 -121.2 147.84 45.06 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.354 -0.384 . . . . 20.0 110.832 -179.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.913 ' CE2' HG13 ' A' ' 137' ' ' VAL . 1.0 OUTLIER -119.65 160.8 21.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.174 0.511 . . . . 20.0 111.441 -179.114 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.641 ' HB2' ' HB2' ' A' ' 138' ' ' ALA . 50.9 ttm-85 -96.93 147.18 24.24 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.882 -0.784 . . . . 20.0 108.882 178.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . 0.417 ' O ' ' NE2' ' A' ' 117' ' ' GLN . . . -82.91 134.24 35.08 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.076 0.465 . . . . 20.0 111.938 -178.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.708 ' HG2' HD23 ' A' ' 136' ' ' LEU . 75.6 mm-40 -133.94 120.53 20.45 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.54 -0.755 . . . . 20.0 110.032 179.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 71.9 ttp85 -118.04 98.61 6.41 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.924 0.392 . . . . 20.0 110.663 179.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.943 ' HB ' HD21 ' A' ' 64' ' ' LEU . 92.2 t -131.14 145.06 35.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 CA-C-N 115.902 -0.59 . . . . 20.0 111.3 -179.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.557 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 24.4 mp0 -91.53 140.92 29.28 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 120.751 0.31 . . . . 20.0 110.518 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.884 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.0 OUTLIER -79.4 129.72 34.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.196 0.522 . . . . 20.0 110.801 -179.835 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 1.002 HD12 ' HA ' ' A' ' 71' ' ' SER . 1.5 mp -95.12 138.46 32.8 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.551 -0.75 . . . . 20.0 111.524 -179.048 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . 0.526 ' SG ' ' HD2' ' A' ' 124' ' ' PRO . 0.1 OUTLIER -115.28 156.72 45.28 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 115.403 -0.817 . . . . 20.0 109.877 179.462 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.526 ' HD2' ' SG ' ' A' ' 123' ' ' CYS . 73.9 Cg_exo -50.28 112.51 0.75 Allowed 'Trans proline' 0 N--CA 1.462 -0.368 0 C-N-CA 122.007 1.804 . . . . 20.0 111.908 -179.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 98.35 -9.36 62.87 Favored Glycine 0 N--CA 1.449 -0.434 0 C-N-CA 120.946 -0.645 . . . . 20.0 112.477 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 56.47 59.45 10.72 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.746 -0.74 . . . . 20.0 112.521 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -118.44 -31.69 4.85 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.271 0.471 . . . . 20.0 112.271 -179.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -123.19 56.03 8.72 Favored Pre-proline 0 C--N 1.33 -0.242 0 N-CA-C 112.219 0.451 . . . . 20.0 112.219 -179.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -70.68 143.81 47.43 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.639 2.226 . . . . 20.0 112.081 179.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.884 ' HB2' HD12 ' A' ' 121' ' ' LEU . 67.5 mtt85 -132.02 153.38 50.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.379 -0.373 . . . . 20.0 110.623 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.456 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 43.9 t -98.84 133.72 42.74 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.801 0.334 . . . . 20.0 111.128 -179.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . 0.479 ' HB3' HD13 ' A' ' 64' ' ' LEU . 74.5 ttt-85 -139.1 142.99 38.08 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.188 0.518 . . . . 20.0 111.761 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 3.6 pttm -96.09 146.07 24.96 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.445 -0.798 . . . . 20.0 110.259 179.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.556 ' HB ' HD21 ' A' ' 136' ' ' LEU . 0.0 OUTLIER -145.16 121.59 4.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 CA-C-O 121.287 0.565 . . . . 20.0 111.794 -179.415 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.745 ' C ' HD22 ' A' ' 136' ' ' LEU . 86.1 mtt-85 -92.1 118.6 30.97 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.349 -0.842 . . . . 20.0 110.09 178.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.745 HD22 ' C ' ' A' ' 135' ' ' ARG . 1.0 OUTLIER -114.35 120.2 39.57 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.01 0.433 . . . . 20.0 112.087 -179.252 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.935 HG11 ' CB ' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -51.28 84.54 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 116.269 -0.423 . . . . 20.0 111.455 179.811 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.641 ' HB2' ' HB2' ' A' ' 115' ' ' ARG . . . -75.5 -6.44 50.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.009 0.433 . . . . 20.0 110.193 179.101 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 17.3 t -161.67 120.96 2.46 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.82 -0.627 . . . . 20.0 110.517 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' CYS . . . . . 0.481 ' HB3' ' HA ' ' A' ' 111' ' ' PRO . 11.3 p -141.0 169.81 16.9 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.533 -0.303 . . . . 20.0 110.904 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -128.82 148.49 50.88 Favored 'General case' 0 N--CA 1.455 -0.178 0 CA-C-N 116.546 -0.297 . . . . 20.0 110.401 179.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . 0.627 ' CB ' ' CD1' ' A' ' 53' ' ' TYR . 11.3 t -83.89 99.01 10.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.962 0.411 . . . . 20.0 110.068 179.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.488 ' O ' ' HG2' ' A' ' 144' ' ' ARG . 19.7 mmtm -130.24 145.49 51.75 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.932 -0.576 . . . . 20.0 111.39 -179.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.488 ' HG2' ' O ' ' A' ' 143' ' ' LYS . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.172 -0.918 . . . . 20.0 111.249 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 37.5 mtmm . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.773 0.32 . . . . 20.0 111.322 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.448 ' HB2' ' CD ' ' A' ' 52' ' ' GLU . 47.4 p30 -89.59 15.34 9.63 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.232 -0.44 . . . . 20.0 111.821 -179.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 92.0 t -71.86 -29.91 35.36 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 CA-C-O 120.761 0.315 . . . . 20.0 111.741 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 79.7 p -78.41 -6.75 56.15 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.416 -0.356 . . . . 20.0 111.427 -179.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.448 ' CD ' ' HB2' ' A' ' 49' ' ' ASP . 96.9 mt-10 -64.4 -31.85 73.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.892 0.377 . . . . 20.0 110.796 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.59 ' CD2' ' O ' ' A' ' 53' ' ' TYR . 2.0 p90 -111.49 22.94 14.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.132 -0.486 . . . . 20.0 110.521 179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.436 ' OG ' ' HG3' ' A' ' 56' ' ' ARG . 16.3 t -56.71 119.43 6.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 121.207 0.527 . . . . 20.0 110.846 -179.007 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.449 ' SG ' ' SG ' ' A' ' 80' ' ' CYS . 0.7 OUTLIER -110.24 25.35 11.88 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.415 -0.811 . . . . 20.0 110.618 -179.641 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.56 ' HD3' ' N ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -44.21 167.83 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.958 -0.565 . . . . 20.0 111.102 179.869 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.493 ' HG3' ' O ' ' A' ' 57' ' ' GLU . 22.0 pt-20 -44.05 88.32 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.97 -0.559 . . . . 20.0 111.451 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 1.01 ' O ' HD12 ' A' ' 58' ' ' LEU . 2.3 pp -108.09 132.35 53.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.772 -0.649 . . . . 20.0 110.505 179.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.488 ' CD2' ' O ' ' A' ' 58' ' ' LEU . 7.5 m170 -146.96 131.18 17.42 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.911 0.386 . . . . 20.0 111.243 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.631 ' CD1' HG13 ' A' ' 79' ' ' VAL . 12.7 m-85 -129.25 148.63 51.2 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.083 -0.508 . . . . 20.0 111.639 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.418 ' OG1' ' CZ ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -103.86 87.15 2.73 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.038 0.447 . . . . 20.0 111.091 -179.819 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.949 ' O ' HG21 ' A' ' 75' ' ' VAL . 60.7 ttm-85 -122.37 124.96 44.89 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 108.572 -0.899 . . . . 20.0 108.572 178.544 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.685 ' O ' HG21 ' A' ' 134' ' ' VAL . 0.1 OUTLIER -111.18 -83.39 0.57 Allowed 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 112.98 0.733 . . . . 20.0 112.98 -177.606 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 1.008 HD11 HG13 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -169.17 141.77 2.64 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 120.575 -0.45 . . . . 20.0 112.04 -178.405 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.784 HG22 ' HG3' ' A' ' 70' ' ' ARG . 31.0 p -136.4 131.62 34.4 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.101 -0.5 . . . . 20.0 110.806 178.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.652 ' HB2' HD13 ' A' ' 121' ' ' LEU . 93.4 m-20 -140.72 -162.13 1.31 Allowed 'General case' 0 C--O 1.235 0.323 0 N-CA-C 109.547 -0.538 . . . . 20.0 109.547 179.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.814 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -29.65 144.34 0.01 OUTLIER Glycine 0 C--N 1.347 1.183 0 CA-C-O 118.494 -1.17 . . . . 20.0 110.277 179.441 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.515 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 56.9 Cg_exo -16.57 58.53 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 125.071 3.848 . . . . 20.0 114.864 -178.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.814 ' N ' ' O ' ' A' ' 67' ' ' GLY . 20.7 m -162.58 159.12 24.29 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 108.956 -0.757 . . . . 20.0 108.956 179.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.784 ' HG3' HG22 ' A' ' 65' ' ' THR . 79.3 ttt180 -149.97 141.29 23.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.218 0.532 . . . . 20.0 112.068 179.714 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.599 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -84.54 162.69 19.75 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.446 -0.797 . . . . 20.0 110.393 179.004 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -147.34 28.3 0.99 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 113.415 0.894 . . . . 20.0 113.415 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.907 ' HB2' HG21 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -75.76 141.97 72.85 Favored Pre-proline 0 C--N 1.327 -0.379 0 C-N-CA 120.54 -0.464 . . . . 20.0 110.27 179.249 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -50.63 122.51 9.76 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.706 2.27 . . . . 20.0 112.619 -179.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.949 HG21 ' O ' ' A' ' 62' ' ' ARG . 17.3 m -137.27 151.08 26.38 Favored 'Isoleucine or valine' 0 C--O 1.232 0.151 0 CA-C-N 116.202 -0.454 . . . . 20.0 111.891 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 88.1 m -111.73 124.24 51.92 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 109.069 -0.715 . . . . 20.0 109.069 177.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.64 ' C ' HD12 ' A' ' 78' ' ' LEU . 84.8 tt0 -125.31 133.1 52.74 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.192 0.52 . . . . 20.0 112.085 -179.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.733 HD12 ' N ' ' A' ' 78' ' ' LEU . 3.8 mp -108.06 138.29 44.58 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.534 -0.757 . . . . 20.0 109.405 178.36 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.813 ' H ' HD13 ' A' ' 58' ' ' LEU . 35.0 m -97.41 83.04 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 CA-C-O 121.481 0.657 . . . . 20.0 111.184 -178.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.485 ' O ' ' HD3' ' A' ' 111' ' ' PRO . 0.8 OUTLIER -115.65 107.3 14.92 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 114.875 -1.057 . . . . 20.0 109.97 179.488 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.4 m -151.62 96.16 2.22 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 120.214 -0.594 . . . . 20.0 112.58 179.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.591 ' N ' ' O ' ' A' ' 109' ' ' CYS . . . 171.32 -170.73 43.54 Favored Glycine 0 N--CA 1.449 -0.497 0 CA-C-N 115.547 -0.751 . . . . 20.0 111.503 179.434 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.532 ' O ' ' N ' ' A' ' 108' ' ' ARG . 92.6 mt-30 -137.52 138.27 39.48 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.977 0.417 . . . . 20.0 111.065 178.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.5 ' N ' ' HA ' ' A' ' 144' ' ' ARG . 61.4 m -97.68 133.18 42.57 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.18 -0.464 . . . . 20.0 110.878 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . 0.57 ' HA3' ' CE2' ' A' ' 107' ' ' PHE . . . -145.75 -177.21 20.29 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.685 -0.769 . . . . 20.0 112.365 -179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_exo -56.76 140.89 92.08 Favored 'Trans proline' 0 N--CA 1.465 -0.18 0 C-N-CA 122.592 2.195 . . . . 20.0 111.963 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -74.87 -0.41 18.38 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.23 -0.441 . . . . 20.0 111.23 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.522 ' C ' HD13 ' A' ' 89' ' ' LEU . 21.7 tpt180 -73.68 117.19 15.16 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.334 -0.393 . . . . 20.0 110.57 -179.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.62 ' N ' HD13 ' A' ' 89' ' ' LEU . 0.1 OUTLIER -98.5 135.16 40.46 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.045 -0.525 . . . . 20.0 110.834 -179.986 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -118.53 90.78 40.16 Favored Pre-proline 0 C--N 1.329 -0.29 0 N-CA-C 112.086 0.402 . . . . 20.0 112.086 -179.474 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.602 ' HB2' ' CE2' ' A' ' 100' ' ' TRP . 37.1 Cg_endo -64.94 108.56 1.12 Allowed 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 122.634 2.223 . . . . 20.0 111.0 178.659 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.616 ' O ' ' CH2' ' A' ' 99' ' ' TRP . 56.8 t-20 -98.93 142.91 29.84 Favored 'General case' 0 N--CA 1.466 0.355 0 N-CA-C 111.873 0.323 . . . . 20.0 111.873 -179.01 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 1.16 ' CB ' HG22 ' A' ' 97' ' ' VAL . . . -100.32 -13.33 18.86 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.187 -0.461 . . . . 20.0 112.054 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.852 HD12 ' C ' ' A' ' 93' ' ' ALA . 0.1 OUTLIER 32.66 31.47 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-O 121.135 0.493 . . . . 20.0 111.836 -179.711 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.542 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 121.25 -44.39 1.37 Allowed Glycine 0 C--N 1.314 -0.655 0 CA-C-N 115.53 -0.759 . . . . 20.0 113.023 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.473 ' N ' ' O ' ' A' ' 93' ' ' ALA . 82.3 mtt180 -109.15 131.64 54.87 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.718 0.259 . . . . 20.0 110.7 179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 1.16 HG22 ' CB ' ' A' ' 93' ' ' ALA . 0.8 OUTLIER -129.89 129.65 66.05 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.651 0 CA-C-O 121.629 0.728 . . . . 20.0 111.584 178.877 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.48 ' HG2' ' C ' ' A' ' 97' ' ' VAL . 1.6 ptpt 164.72 -32.83 0.0 OUTLIER 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 114.525 -1.216 . . . . 20.0 108.974 -178.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.835 ' HH2' HD11 ' A' ' 94' ' ' ILE . 43.8 p-90 -94.7 26.83 3.31 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 113.357 -1.747 . . . . 20.0 110.595 -179.756 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' TRP . . . . . 1.128 ' CZ3' HG13 ' A' ' 97' ' ' VAL . 0.0 OUTLIER -30.26 132.01 0.08 Allowed 'General case' 0 CA--C 1.5 -0.961 0 CA-C-O 122.15 0.976 . . . . 20.0 113.232 -177.093 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.43 ' HD2' ' CE3' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -119.47 74.87 16.97 Favored Pre-proline 0 N--CA 1.437 -1.087 0 CA-C-N 113.524 -1.671 . . . . 20.0 110.813 -179.131 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.549 ' O ' ' CB ' ' A' ' 89' ' ' LEU . 55.3 Cg_endo -68.95 -0.17 5.88 Favored 'Trans proline' 0 CA--C 1.527 0.169 0 C-N-CA 123.59 2.86 . . . . 20.0 112.239 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.465 ' O ' ' HG ' ' A' ' 89' ' ' LEU . 57.8 t30 -59.24 -34.64 72.46 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.384 -0.371 . . . . 20.0 110.737 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.511 ' HA3' HD12 ' A' ' 89' ' ' LEU . . . 76.32 -178.09 50.08 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.646 -0.787 . . . . 20.0 112.45 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.589 ' HB2' ' CZ ' ' A' ' 107' ' ' PHE . 22.6 Cg_exo -63.24 153.85 71.55 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.803 2.335 . . . . 20.0 112.293 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.404 ' OD2' ' NH2' ' A' ' 108' ' ' ARG . 54.3 t0 -79.32 115.53 19.02 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.262 -0.426 . . . . 20.0 110.991 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.589 ' CZ ' ' HB2' ' A' ' 105' ' ' PRO . 63.9 m-85 -117.89 138.28 52.23 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.049 -0.523 . . . . 20.0 110.783 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.576 ' HA ' ' CB ' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -151.2 -162.73 1.6 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.944 0.402 . . . . 20.0 111.354 179.327 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.591 ' O ' ' N ' ' A' ' 82' ' ' GLY . 1.5 m -82.86 122.6 28.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.957 -0.565 . . . . 20.0 111.603 -179.133 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.553 ' O ' HG23 ' A' ' 110' ' ' ILE . 0.1 OUTLIER -100.56 116.13 64.62 Favored Pre-proline 0 C--N 1.329 -0.3 0 C-N-CA 120.597 -0.441 . . . . 20.0 110.274 178.596 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.544 ' CB ' HG11 ' A' ' 137' ' ' VAL . 18.6 Cg_endo -60.16 147.07 94.75 Favored 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.763 2.309 . . . . 20.0 111.67 -179.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 -119.83 -66.59 1.05 Allowed 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 112.989 0.737 . . . . 20.0 112.989 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.496 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 41.0 ttm180 -119.82 149.05 42.69 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.245 0.461 . . . . 20.0 112.245 -178.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 1.021 ' CE2' HG13 ' A' ' 137' ' ' VAL . 1.3 m-85 -124.01 159.01 30.79 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.551 -0.75 . . . . 20.0 111.602 -179.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.513 ' HD2' ' NE2' ' A' ' 117' ' ' GLN . 43.9 ttm-85 -95.43 148.31 22.61 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 108.467 -0.938 . . . . 20.0 108.467 177.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -83.33 137.94 33.75 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-O 121.137 0.494 . . . . 20.0 111.421 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.513 ' NE2' ' HD2' ' A' ' 115' ' ' ARG . 95.6 mm-40 -137.18 109.81 7.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.811 -0.632 . . . . 20.0 110.867 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.482 ' HA ' ' O ' ' A' ' 132' ' ' ARG . 93.8 mtt180 -125.42 98.25 5.53 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.059 -0.519 . . . . 20.0 110.739 179.394 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 1.008 HG13 HD11 ' A' ' 64' ' ' LEU . 14.7 p -133.72 152.12 34.28 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.877 -0.601 . . . . 20.0 110.857 -179.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.52 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 27.1 mp0 -77.92 135.73 37.9 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.932 0.396 . . . . 20.0 111.493 -179.234 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.889 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.2 OUTLIER -79.22 127.71 32.39 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 109.345 -0.613 . . . . 20.0 109.345 179.103 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -84.62 131.86 34.56 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.861 -0.608 . . . . 20.0 111.446 -178.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . 0.597 ' CB ' ' HB3' ' A' ' 128' ' ' ALA . 0.5 OUTLIER -112.53 151.89 44.21 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 115.438 -0.801 . . . . 20.0 109.881 179.71 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.517 ' HD2' ' SG ' ' A' ' 123' ' ' CYS . 78.1 Cg_exo -48.27 111.91 0.52 Allowed 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 121.766 1.644 . . . . 20.0 111.351 -179.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 100.86 -9.87 58.53 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.969 -0.634 . . . . 20.0 112.036 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 65.26 27.13 72.05 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 120.767 -0.73 . . . . 20.0 112.389 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -101.79 -7.27 22.7 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.384 0.512 . . . . 20.0 112.384 -178.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.597 ' HB3' ' CB ' ' A' ' 123' ' ' CYS . . . -129.63 56.26 23.21 Favored Pre-proline 0 C--N 1.329 -0.311 0 N-CA-C 112.388 0.514 . . . . 20.0 112.388 -179.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . 0.518 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 62.3 Cg_endo -73.74 136.32 23.02 Favored 'Trans proline' 0 CA--C 1.528 0.182 0 C-N-CA 122.529 2.153 . . . . 20.0 112.055 179.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.889 ' HB2' HD12 ' A' ' 121' ' ' LEU . 89.1 mtt180 -140.27 133.94 30.32 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 120.62 0.248 . . . . 20.0 111.271 179.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.417 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 23.3 t -85.51 136.71 33.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.952 0.406 . . . . 20.0 111.657 -179.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . 0.691 HH12 HG13 ' A' ' 134' ' ' VAL . 56.6 ttt-85 -140.52 143.54 35.46 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.803 -0.635 . . . . 20.0 111.26 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.452 ' HA ' ' O ' ' A' ' 117' ' ' GLN . 19.7 pttp -100.93 144.61 29.66 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.09 -0.504 . . . . 20.0 110.66 179.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.691 HG13 HH12 ' A' ' 132' ' ' ARG . 0.0 OUTLIER -147.99 123.17 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 CA-C-O 120.946 0.403 . . . . 20.0 111.721 -179.618 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.596 ' O ' HD23 ' A' ' 136' ' ' LEU . 90.5 mtm-85 -90.85 110.89 22.11 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.855 -0.612 . . . . 20.0 110.213 178.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.61 ' N ' ' HB3' ' A' ' 114' ' ' TYR . 5.0 mt -114.04 126.85 55.58 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.255 0.55 . . . . 20.0 112.047 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 1.021 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.2 OUTLIER -57.83 83.22 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 CA-C-N 115.569 -0.741 . . . . 20.0 111.405 -179.704 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.491 ' HB1' HH21 ' A' ' 115' ' ' ARG . . . -72.95 -6.98 48.94 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.053 0.454 . . . . 20.0 110.428 179.316 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 47.2 t -163.6 115.14 1.41 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.787 -0.642 . . . . 20.0 110.169 179.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' CYS . . . . . . . . . . . . . 10.0 p -132.09 159.78 37.87 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.972 0.415 . . . . 20.0 111.037 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -131.21 149.07 52.74 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.909 -0.587 . . . . 20.0 110.596 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . 0.565 ' SG ' ' CE2' ' A' ' 53' ' ' TYR . 0.5 OUTLIER -71.09 98.71 1.71 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.862 0.363 . . . . 20.0 110.481 179.86 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.52 ' HB2' ' CG2' ' A' ' 110' ' ' ILE . 25.1 mmtt -134.1 152.61 51.91 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.976 -0.556 . . . . 20.0 111.183 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.503 ' N ' ' CD ' ' A' ' 144' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.221 -0.895 . . . . 20.0 110.946 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.4 mttt . . . . . 0 N--CA 1.487 1.395 0 CA-C-O 120.724 0.297 . . . . 20.0 111.149 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.493 ' HA ' ' OE1' ' A' ' 52' ' ' GLU . 85.1 m-20 -86.4 15.91 4.98 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.272 -0.422 . . . . 20.0 111.96 -179.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 70.3 t -65.03 -38.11 81.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 CA-C-N 116.541 -0.299 . . . . 20.0 111.522 -179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.481 ' O ' ' CE1' ' A' ' 53' ' ' TYR . 45.5 m -89.67 -16.48 30.34 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.511 -0.313 . . . . 20.0 111.703 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.493 ' OE1' ' HA ' ' A' ' 49' ' ' ASP . 56.5 mp0 -90.51 15.44 10.8 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.352 -0.385 . . . . 20.0 111.493 -179.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.597 ' N ' ' CD1' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -45.53 -83.9 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.716 0.293 . . . . 20.0 111.025 -179.286 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.508 ' HB3' ' HB2' ' A' ' 109' ' ' CYS . 7.9 t -142.12 -163.1 1.52 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.975 0.417 . . . . 20.0 110.513 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.477 ' CB ' ' O ' ' A' ' 54' ' ' SER . 2.7 m 82.33 17.03 0.37 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.052 -0.522 . . . . 20.0 110.83 179.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.511 ' HG2' ' N ' ' A' ' 57' ' ' GLU . 0.0 OUTLIER -55.77 -156.65 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.435 -0.348 . . . . 20.0 110.547 179.874 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.511 ' N ' ' HG2' ' A' ' 56' ' ' ARG . 80.1 tt0 -86.22 118.6 25.78 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.824 0.345 . . . . 20.0 110.9 -179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.773 ' H ' HD12 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -150.18 131.8 14.89 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.126 -0.488 . . . . 20.0 111.465 -179.917 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.462 ' CD2' ' O ' ' A' ' 58' ' ' LEU . 25.8 m170 -139.58 122.26 16.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.895 0.379 . . . . 20.0 110.792 178.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.89 ' CD1' HG13 ' A' ' 79' ' ' VAL . 14.9 m-85 -128.16 156.14 43.35 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.027 -0.533 . . . . 20.0 111.589 -179.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 40.1 p -111.05 88.41 2.78 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 112.325 0.491 . . . . 20.0 112.325 -178.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.797 ' O ' HG21 ' A' ' 75' ' ' VAL . 51.4 mtm180 -117.33 123.36 46.32 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 108.291 -1.003 . . . . 20.0 108.291 177.151 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.907 ' O ' HD23 ' A' ' 64' ' ' LEU . 1.7 m-85 -103.21 -79.29 0.54 Allowed 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 112.34 0.496 . . . . 20.0 112.34 -177.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.907 HD23 ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -177.46 142.16 0.32 Allowed 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 120.581 -0.448 . . . . 20.0 111.44 -178.76 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.733 HG22 ' HG3' ' A' ' 70' ' ' ARG . 30.0 p -138.9 132.71 30.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 116.058 -0.519 . . . . 20.0 110.081 178.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.558 ' O ' ' C ' ' A' ' 67' ' ' GLY . 5.1 t0 -150.29 -155.71 0.65 Allowed 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.701 -0.227 . . . . 20.0 110.397 -179.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.789 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -26.38 137.77 0.01 OUTLIER Glycine 0 C--N 1.347 1.171 0 N-CA-C 110.26 -1.136 . . . . 20.0 110.26 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.565 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 36.7 Cg_exo -17.09 59.74 0.0 OUTLIER 'Trans proline' 0 N--CA 1.452 -0.97 0 C-N-CA 125.136 3.891 . . . . 20.0 115.387 -177.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.789 ' N ' ' O ' ' A' ' 67' ' ' GLY . 74.1 m -165.33 162.87 19.91 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 108.7 -0.852 . . . . 20.0 108.7 178.051 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.733 ' HG3' HG22 ' A' ' 65' ' ' THR . 54.9 ttt180 -147.09 140.82 25.73 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 112.555 0.576 . . . . 20.0 112.555 -179.321 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.674 ' CA ' ' HA ' ' A' ' 121' ' ' LEU . 1.4 t -87.98 158.36 18.67 Favored 'General case' 0 CA--C 1.514 -0.421 0 CA-C-N 115.896 -0.593 . . . . 20.0 110.253 178.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.427 ' HA ' ' CD2' ' A' ' 63' ' ' PHE . . . -146.93 27.37 1.07 Allowed 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 114.427 1.269 . . . . 20.0 114.427 -179.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.705 ' HB3' HG21 ' A' ' 119' ' ' VAL . 19.5 tttt -76.62 136.57 67.48 Favored Pre-proline 0 C--N 1.327 -0.411 0 C-N-CA 120.054 -0.658 . . . . 20.0 109.493 178.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -51.35 129.03 27.54 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.926 2.417 . . . . 20.0 113.172 -178.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.797 HG21 ' O ' ' A' ' 62' ' ' ARG . 17.4 m -142.3 147.79 20.91 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.122 0 CA-C-N 115.886 -0.597 . . . . 20.0 111.472 179.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 18.9 m -116.83 126.15 52.62 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.526 -0.546 . . . . 20.0 109.526 178.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.719 ' OE1' HD12 ' A' ' 136' ' ' LEU . 15.9 pt-20 -143.09 155.49 44.61 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.971 0.415 . . . . 20.0 111.554 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.618 ' HB3' HD13 ' A' ' 58' ' ' LEU . 6.3 mp -105.39 143.59 33.34 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.757 -0.656 . . . . 20.0 110.272 178.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.89 HG13 ' CD1' ' A' ' 60' ' ' TYR . 32.8 m -99.72 81.94 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-O 121.037 0.446 . . . . 20.0 110.632 179.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.424 ' SG ' ' O ' ' A' ' 80' ' ' CYS . 27.2 p -131.51 109.09 10.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.914 -0.585 . . . . 20.0 110.996 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -142.55 104.81 4.44 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.191 -0.459 . . . . 20.0 110.941 179.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.46 ' HA3' ' HD3' ' A' ' 108' ' ' ARG . . . -162.12 -172.95 30.2 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 120.632 -0.794 . . . . 20.0 112.317 179.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 85.4 mt-30 -131.29 146.23 52.21 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.624 0.25 . . . . 20.0 110.338 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.543 ' HA ' ' HA ' ' A' ' 107' ' ' PHE . 68.4 m -106.32 146.99 29.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.738 0.304 . . . . 20.0 110.467 179.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . 0.583 ' O ' ' CE1' ' A' ' 107' ' ' PHE . . . -156.91 173.32 34.56 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.856 -0.688 . . . . 20.0 112.267 -179.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -53.31 152.7 19.04 Favored 'Trans proline' 0 C--O 1.231 0.136 0 C-N-CA 122.844 2.362 . . . . 20.0 112.369 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.425 ' HB2' ' HE2' ' A' ' 107' ' ' PHE . . . -76.23 -1.17 25.13 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.154 -0.475 . . . . 20.0 111.498 -179.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.581 ' C ' HD13 ' A' ' 89' ' ' LEU . 27.4 tpt180 -71.61 133.83 45.99 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.944 0.402 . . . . 20.0 110.743 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.709 ' HB3' HG21 ' A' ' 97' ' ' VAL . 0.4 OUTLIER -113.01 124.23 52.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.934 -0.576 . . . . 20.0 110.119 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.605 ' O ' ' CH2' ' A' ' 100' ' ' TRP . 0.2 OUTLIER -119.45 85.16 31.08 Favored Pre-proline 0 C--N 1.33 -0.261 0 N-CA-C 111.866 0.321 . . . . 20.0 111.866 -179.485 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.478 ' HA ' ' CH2' ' A' ' 100' ' ' TRP . 88.7 Cg_endo -91.39 138.53 2.23 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 123.095 2.53 . . . . 20.0 112.002 179.216 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.46 ' OD1' ' O ' ' A' ' 91' ' ' PRO . 75.7 m-20 -138.87 13.13 2.68 Favored 'General case' 0 C--N 1.333 -0.137 0 C-N-CA 120.825 -0.35 . . . . 20.0 111.387 179.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.518 ' HB3' ' CH2' ' A' ' 99' ' ' TRP . . . -119.22 -81.74 0.63 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.23 0.538 . . . . 20.0 110.916 179.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.429 ' H ' HD12 ' A' ' 94' ' ' ILE . 2.8 mp -97.11 -4.92 9.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-N 115.369 -0.832 . . . . 20.0 111.105 179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 94.72 -1.48 65.97 Favored Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.927 -0.654 . . . . 20.0 111.652 -179.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.561 ' NE ' ' HD2' ' A' ' 98' ' ' LYS . 2.7 ptm180 -116.52 139.02 50.94 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.872 0.368 . . . . 20.0 110.934 -179.783 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.917 HG12 ' HD2' ' A' ' 101' ' ' ARG . 0.2 OUTLIER -106.48 110.47 31.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 115.982 -0.554 . . . . 20.0 109.739 179.702 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.589 ' HG3' ' CD1' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -161.74 20.65 0.11 Allowed 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.217 -0.901 . . . . 20.0 111.112 -177.123 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.711 ' CZ3' ' CE3' ' A' ' 100' ' ' TRP . 0.0 OUTLIER -148.6 -83.6 0.11 Allowed 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 109.117 -0.697 . . . . 20.0 109.117 -177.302 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' TRP . . . . . 0.711 ' CE3' ' CZ3' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -90.84 134.58 34.34 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.369 -0.975 . . . . 20.0 108.369 177.67 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.917 ' HD2' HG12 ' A' ' 97' ' ' VAL . 0.1 OUTLIER -139.52 97.58 8.3 Favored Pre-proline 0 C--N 1.32 -0.716 0 C-N-CA 120.662 -0.415 . . . . 20.0 110.981 -179.061 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.436 ' HG3' ' NE1' ' A' ' 100' ' ' TRP . 38.5 Cg_exo -58.41 -36.55 97.41 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 122.709 2.272 . . . . 20.0 112.552 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -94.58 5.65 51.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.252 -0.431 . . . . 20.0 110.748 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.448 ' HA2' ' HD3' ' A' ' 105' ' ' PRO . . . 93.44 145.38 17.19 Favored Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.925 -0.655 . . . . 20.0 112.061 -179.586 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.448 ' HD3' ' HA2' ' A' ' 104' ' ' GLY . 20.5 Cg_exo -65.81 163.85 29.17 Favored 'Trans proline' 0 C--N 1.343 0.24 0 C-N-CA 122.845 2.363 . . . . 20.0 112.281 -179.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 57.0 p30 -60.85 170.74 1.4 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.224 -0.444 . . . . 20.0 111.255 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.583 ' CE1' ' O ' ' A' ' 85' ' ' GLY . 59.5 m-85 -66.32 140.37 58.1 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.053 -0.522 . . . . 20.0 110.675 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 142' ' ' CYS . 62.2 ttt-85 -143.66 -116.57 0.1 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 120.986 -0.286 . . . . 20.0 111.271 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.508 ' HB2' ' HB3' ' A' ' 54' ' ' SER . 1.3 t -138.4 130.68 28.76 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.995 0.426 . . . . 20.0 111.547 -179.32 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.67 HD12 ' O ' ' A' ' 143' ' ' LYS . 2.0 mt -123.69 119.51 26.99 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 115.939 -0.573 . . . . 20.0 110.259 178.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.709 ' HB3' HG11 ' A' ' 137' ' ' VAL . 9.2 Cg_endo -53.07 138.03 62.56 Favored 'Trans proline' 0 N--CA 1.464 -0.256 0 C-N-CA 122.455 2.103 . . . . 20.0 111.549 -179.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 46.6 t0 -120.51 -60.14 1.7 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.511 -0.313 . . . . 20.0 111.538 -179.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.441 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 53.2 ttt85 -126.38 143.59 51.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.286 -0.415 . . . . 20.0 111.519 -179.678 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.818 ' CD1' HG13 ' A' ' 137' ' ' VAL . 2.3 m-85 -118.66 157.39 27.52 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.908 -0.587 . . . . 20.0 110.6 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.652 ' HB2' ' HB2' ' A' ' 138' ' ' ALA . 55.5 ttm-85 -93.74 139.84 30.36 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 108.602 -0.888 . . . . 20.0 108.602 178.024 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -77.01 131.68 38.58 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 120.302 -0.559 . . . . 20.0 110.684 -178.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.673 ' CD ' HD23 ' A' ' 136' ' ' LEU . 49.6 mt-30 -133.46 101.87 5.31 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.961 -0.563 . . . . 20.0 110.57 -179.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 43.2 ttt85 -109.21 99.54 8.8 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.967 0.413 . . . . 20.0 110.28 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.721 ' HB ' HD21 ' A' ' 64' ' ' LEU . 45.3 t -129.33 148.92 33.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 115.895 -0.593 . . . . 20.0 110.976 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.565 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 13.1 pt20 -92.21 134.82 34.52 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.391 -0.368 . . . . 20.0 110.223 179.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.697 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.2 OUTLIER -74.48 120.85 20.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.137 0.494 . . . . 20.0 111.134 -179.27 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.509 ' N ' ' O ' ' A' ' 70' ' ' ARG . 0.2 OUTLIER -89.69 138.77 31.19 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.469 -0.787 . . . . 20.0 111.114 -179.242 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . 0.565 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -106.64 119.39 51.74 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 116.06 -0.518 . . . . 20.0 111.02 179.914 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -67.8 103.11 0.81 Allowed 'Trans proline' 0 N--CA 1.46 -0.444 0 C-N-CA 122.023 1.815 . . . . 20.0 111.147 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 87.28 13.81 65.19 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.635 -0.793 . . . . 20.0 111.503 -179.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . 0.54 ' O ' ' HB3' ' A' ' 123' ' ' CYS . . . -145.4 116.95 0.95 Allowed Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.543 -0.623 . . . . 20.0 111.543 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.489 ' O ' ' HD2' ' A' ' 129' ' ' PRO . . . -83.46 42.95 0.86 Allowed 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 112.057 0.391 . . . . 20.0 112.057 -178.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.447 ' N ' ' CD ' ' A' ' 129' ' ' PRO . . . -113.44 53.89 0.56 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.125 0.488 . . . . 20.0 110.648 179.314 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . 0.49 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 36.9 Cg_endo -65.86 151.58 83.83 Favored 'Trans proline' 0 N--CA 1.464 -0.251 0 C-N-CA 122.977 2.451 . . . . 20.0 112.767 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.697 ' HB2' HD12 ' A' ' 121' ' ' LEU . 80.8 mtt85 -134.98 155.76 50.19 Favored 'General case' 0 C--O 1.224 -0.266 0 CA-C-N 116.004 -0.544 . . . . 20.0 110.634 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.45 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 13.2 p -103.52 133.46 48.52 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.86 0.362 . . . . 20.0 111.23 -179.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 60.6 ttt85 -140.37 143.57 35.79 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.094 -0.503 . . . . 20.0 111.593 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 17.5 pttp -97.02 149.31 22.06 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 115.884 -0.598 . . . . 20.0 110.44 179.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.722 HG12 HD21 ' A' ' 136' ' ' LEU . 3.2 t -147.68 123.92 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 CA-C-O 121.118 0.485 . . . . 20.0 111.768 -179.607 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.681 ' C ' HD22 ' A' ' 136' ' ' LEU . 93.9 mtt-85 -100.45 109.73 21.89 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.516 -0.765 . . . . 20.0 109.526 178.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.735 HD22 ' N ' ' A' ' 136' ' ' LEU . 1.1 mm? -111.57 125.69 54.2 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.1 0.476 . . . . 20.0 112.224 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.818 HG13 ' CD1' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -52.83 83.88 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.1 -0.5 . . . . 20.0 111.393 179.853 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.652 ' HB2' ' HB2' ' A' ' 115' ' ' ARG . . . -74.36 -8.83 57.6 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.082 0.468 . . . . 20.0 110.039 178.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.7 p -163.09 121.33 2.01 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.653 -0.703 . . . . 20.0 109.68 179.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' CYS . . . . . . . . . . . . . 12.5 p -137.01 162.46 33.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.979 0.418 . . . . 20.0 111.631 -179.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 75.6 mttt -143.67 159.68 42.03 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.924 -0.58 . . . . 20.0 111.198 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . 0.543 ' SG ' ' CE2' ' A' ' 53' ' ' TYR . 36.1 t -73.02 109.17 6.35 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.021 0.439 . . . . 20.0 110.208 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.67 ' O ' HD12 ' A' ' 110' ' ' ILE . 3.3 tmtm? -113.2 124.7 53.14 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.685 -0.689 . . . . 20.0 110.961 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.549 ' N ' ' HD3' ' A' ' 143' ' ' LYS . 3.4 mpt_? . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.315 -0.85 . . . . 20.0 110.874 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 92.1 mttt . . . . . 0 N--CA 1.485 1.32 0 CA-C-O 120.957 0.408 . . . . 20.0 111.025 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.484 ' HB2' ' CD ' ' A' ' 52' ' ' GLU . 39.8 p30 -84.84 16.22 3.47 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.892 -0.595 . . . . 20.0 111.691 -179.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 71.8 t -66.5 -31.12 52.13 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 116.229 -0.441 . . . . 20.0 111.344 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 16.1 p -87.39 -1.54 57.99 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 112.265 0.469 . . . . 20.0 112.265 -178.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.484 ' CD ' ' HB2' ' A' ' 49' ' ' ASP . 96.8 mt-10 -64.62 -35.5 81.22 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.867 0.365 . . . . 20.0 111.031 179.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.557 ' CE2' ' O ' ' A' ' 140' ' ' CYS . 40.0 p90 -101.3 -1.36 33.76 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.325 -0.398 . . . . 20.0 111.221 -179.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 73.9 m -80.42 141.31 35.42 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.294 0.569 . . . . 20.0 111.46 -179.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.518 ' HB3' ' HA3' ' A' ' 82' ' ' GLY . 0.0 OUTLIER -93.26 -36.85 12.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.149 -0.932 . . . . 20.0 110.977 -179.297 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.514 ' HD2' ' N ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -162.5 164.39 27.01 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.436 -0.347 . . . . 20.0 110.882 -179.875 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -56.22 85.35 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.155 0 N-CA-C 109.588 -0.523 . . . . 20.0 109.588 179.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 1.117 HD22 ' N ' ' A' ' 59' ' ' HIS . 0.0 OUTLIER -108.43 132.7 53.52 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.671 -0.695 . . . . 20.0 112.813 -178.133 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 1.117 ' N ' HD22 ' A' ' 58' ' ' LEU . 0.4 OUTLIER -169.29 101.39 0.35 Allowed 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 116.021 -0.536 . . . . 20.0 111.439 177.294 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.602 ' CD2' HG11 ' A' ' 79' ' ' VAL . 20.6 m-30 -110.67 150.06 29.57 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 112.698 0.629 . . . . 20.0 112.698 -179.018 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 24.0 p -118.88 84.99 2.28 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 115.051 -0.977 . . . . 20.0 110.293 178.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.876 ' O ' HG21 ' A' ' 75' ' ' VAL . 57.1 ttt85 -112.43 125.64 54.44 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 108.473 -0.936 . . . . 20.0 108.473 178.44 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.851 ' CD1' HG22 ' A' ' 75' ' ' VAL . 0.1 OUTLIER -110.01 -84.75 0.55 Allowed 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.555 0.576 . . . . 20.0 112.555 -177.935 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.916 HD21 ' CG2' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -164.5 132.55 3.38 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.888 0.375 . . . . 20.0 111.448 -178.68 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.977 HG22 ' HG3' ' A' ' 70' ' ' ARG . 44.2 p -131.44 132.92 44.69 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.95 -0.568 . . . . 20.0 110.603 179.512 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.762 ' CG ' HD13 ' A' ' 121' ' ' LEU . 20.1 p-10 -145.01 -161.36 1.28 Allowed 'General case' 0 C--O 1.237 0.426 0 N-CA-C 110.355 -0.239 . . . . 20.0 110.355 179.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.837 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -30.51 149.09 0.01 OUTLIER Glycine 0 C--N 1.342 0.902 0 CA-C-O 118.784 -1.009 . . . . 20.0 110.688 179.183 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.502 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 57.0 Cg_exo -16.67 53.42 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.657 1 C-N-CA 125.852 4.368 . . . . 20.0 115.613 -178.476 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.837 ' N ' ' O ' ' A' ' 67' ' ' GLY . 18.3 m -164.56 160.28 20.1 Favored 'General case' 0 C--O 1.234 0.246 0 N-CA-C 108.344 -0.984 . . . . 20.0 108.344 178.412 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.977 ' HG3' HG22 ' A' ' 65' ' ' THR . 71.5 ttt180 -153.58 140.46 19.16 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.865 0.364 . . . . 20.0 111.414 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.654 ' HA ' HD12 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -81.15 165.19 21.79 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.923 -0.581 . . . . 20.0 110.324 179.279 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -148.26 24.03 1.03 Allowed 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.672 0.619 . . . . 20.0 112.672 178.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.67 ' O ' HG13 ' A' ' 75' ' ' VAL . 1.8 mmpt? -67.3 128.97 93.84 Favored Pre-proline 0 C--N 1.325 -0.489 0 N-CA-C 109.786 -0.45 . . . . 20.0 109.786 179.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 76.8 Cg_exo -46.69 117.72 2.24 Favored 'Trans proline' 0 N--CA 1.463 -0.291 0 C-N-CA 122.411 2.074 . . . . 20.0 112.693 -179.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.876 HG21 ' O ' ' A' ' 62' ' ' ARG . 28.8 m -133.24 155.69 41.09 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.244 0 CA-C-N 116.14 -0.482 . . . . 20.0 110.893 179.484 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.424 HG22 HD11 ' A' ' 78' ' ' LEU . 14.3 m -116.54 121.24 41.21 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.786 -0.45 . . . . 20.0 109.786 177.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.569 ' C ' HD12 ' A' ' 78' ' ' LEU . 78.6 tt0 -120.53 124.07 44.45 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.945 -0.57 . . . . 20.0 110.414 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.873 ' HA ' HD11 ' A' ' 58' ' ' LEU . 3.9 mp -111.47 120.59 42.67 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-O 121.646 0.736 . . . . 20.0 111.61 -179.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.842 HG23 ' O ' ' A' ' 79' ' ' VAL . 3.9 m -106.12 79.87 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.311 -1.068 0 CA-C-N 114.544 -1.207 . . . . 20.0 109.509 178.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.478 ' O ' ' O ' ' A' ' 109' ' ' CYS . 0.8 OUTLIER -82.54 113.49 20.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.939 -0.573 . . . . 20.0 110.85 -179.071 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.494 ' O ' ' NH1' ' A' ' 56' ' ' ARG . 3.1 m -146.56 98.87 3.13 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.048 -0.523 . . . . 20.0 110.833 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.528 ' CA ' ' SG ' ' A' ' 109' ' ' CYS . . . -166.19 -146.53 4.86 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.633 -0.794 . . . . 20.0 112.051 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.478 ' HA ' ' HA ' ' A' ' 108' ' ' ARG . 88.1 mt-30 -126.18 145.98 50.15 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.709 0.29 . . . . 20.0 110.607 179.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.519 ' N ' ' O ' ' A' ' 107' ' ' PHE . 0.0 OUTLIER -131.3 160.6 34.47 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.334 -0.393 . . . . 20.0 111.454 179.498 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -129.12 70.51 0.51 Allowed Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.578 -0.82 . . . . 20.0 112.408 179.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . 0.516 ' HG2' ' CD2' ' A' ' 107' ' ' PHE . 53.3 Cg_exo -56.21 145.26 77.72 Favored 'Trans proline' 0 N--CA 1.471 0.165 0 C-N-CA 123.42 2.747 . . . . 20.0 112.426 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.515 ' O ' HD22 ' A' ' 89' ' ' LEU . . . -70.39 -8.39 50.36 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.374 -0.376 . . . . 20.0 110.438 179.095 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.515 ' C ' HD13 ' A' ' 89' ' ' LEU . 16.0 tpt180 -85.35 109.54 18.47 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 116.244 -0.434 . . . . 20.0 110.014 179.339 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.602 HD12 ' O ' ' A' ' 103' ' ' ASN . 0.4 OUTLIER -102.85 110.12 21.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.141 -0.482 . . . . 20.0 111.179 -179.457 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.482 ' HA ' HD23 ' A' ' 90' ' ' LEU . 0.8 OUTLIER -125.71 95.69 39.68 Favored Pre-proline 0 C--N 1.328 -0.328 0 N-CA-C 112.357 0.502 . . . . 20.0 112.357 179.948 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.6 ' HB2' ' NE1' ' A' ' 100' ' ' TRP . 69.2 Cg_exo -41.81 112.89 0.25 Allowed 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 122.117 1.878 . . . . 20.0 111.299 178.319 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.492 ' O ' ' CH2' ' A' ' 99' ' ' TRP . 52.9 t-20 -100.43 134.73 42.94 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.37 0.605 . . . . 20.0 112.244 -179.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.649 ' CB ' HG22 ' A' ' 97' ' ' VAL . . . -68.04 -20.37 64.97 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.998 -1.001 . . . . 20.0 111.735 179.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.875 HD12 ' CH2' ' A' ' 99' ' ' TRP . 6.4 mt 29.8 35.0 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.295 0 CA-C-O 121.438 0.637 . . . . 20.0 111.265 -179.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.556 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 111.3 -50.98 0.73 Allowed Glycine 0 CA--C 1.523 0.579 0 CA-C-N 114.998 -1.001 . . . . 20.0 113.611 179.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.501 ' O ' ' CZ2' ' A' ' 99' ' ' TRP . 13.5 tpt180 -126.3 143.69 51.07 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 117.08 0.44 . . . . 20.0 110.352 179.777 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 1.018 HG13 ' CZ3' ' A' ' 100' ' ' TRP . 5.8 t -119.94 136.33 57.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.543 0 CA-C-O 122.064 0.935 . . . . 20.0 112.805 -179.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.447 ' HG3' ' HD1' ' A' ' 99' ' ' TRP . 0.2 OUTLIER 164.77 -32.9 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 113.672 -1.604 . . . . 20.0 108.791 -179.933 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.875 ' CH2' HD12 ' A' ' 94' ' ' ILE . 24.6 p-90 -95.57 39.66 1.12 Allowed 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 113.336 -1.756 . . . . 20.0 109.732 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' TRP . . . . . 1.018 ' CZ3' HG13 ' A' ' 97' ' ' VAL . 0.0 OUTLIER -45.85 140.96 3.28 Favored 'General case' 0 CA--C 1.501 -0.907 0 N-CA-C 113.53 0.937 . . . . 20.0 113.53 -177.613 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.88 79.35 24.35 Favored Pre-proline 0 N--CA 1.44 -0.972 0 CA-C-N 113.974 -1.466 . . . . 20.0 110.173 179.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.559 ' HA ' ' HG3' ' A' ' 91' ' ' PRO . 9.5 Cg_endo -52.47 -18.12 7.72 Favored 'Trans proline' 0 N--CA 1.46 -0.497 0 C-N-CA 122.774 2.316 . . . . 20.0 111.736 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.602 ' O ' HD12 ' A' ' 89' ' ' LEU . 80.0 m-20 -83.83 2.34 38.73 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.21 -0.45 . . . . 20.0 111.197 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.489 ' HA3' ' HA ' ' A' ' 89' ' ' LEU . . . 62.33 147.71 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.906 -0.664 . . . . 20.0 112.729 179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -83.13 157.02 15.04 Favored 'Trans proline' 0 N--CA 1.458 -0.612 0 C-N-CA 122.994 2.463 . . . . 20.0 112.515 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 60.7 m-20 -74.01 135.93 43.13 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.239 -0.437 . . . . 20.0 109.938 179.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.519 ' O ' ' N ' ' A' ' 84' ' ' CYS . 86.8 m-85 -109.24 130.57 55.49 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.904 0.383 . . . . 20.0 111.758 -178.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.518 ' HA ' ' O ' ' A' ' 82' ' ' GLY . 93.6 mtm-85 -69.0 143.91 54.25 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 116.059 -0.519 . . . . 20.0 111.844 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.667 ' HA ' ' HA ' ' A' ' 142' ' ' CYS . 0.6 OUTLIER -80.26 102.15 9.32 Favored 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 109.31 -0.626 . . . . 20.0 109.31 178.26 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 1.2 pt -121.62 160.61 45.65 Favored Pre-proline 0 N--CA 1.463 0.211 0 CA-C-O 120.727 0.299 . . . . 20.0 111.784 -178.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.996 ' HB3' HG11 ' A' ' 137' ' ' VAL . 14.5 Cg_exo -66.6 157.31 61.43 Favored 'Trans proline' 0 C--N 1.347 0.458 0 C-N-CA 122.792 2.328 . . . . 20.0 112.112 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -137.2 -57.41 0.71 Allowed 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.508 0.558 . . . . 20.0 112.508 -179.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.539 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 57.5 ttt180 -117.63 154.15 32.07 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 120.542 0.211 . . . . 20.0 111.444 -179.159 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 1.01 ' CE2' HG13 ' A' ' 137' ' ' VAL . 2.3 m-85 -127.81 155.3 44.31 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.488 0.661 . . . . 20.0 111.82 179.441 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.529 ' NH2' ' HB1' ' A' ' 138' ' ' ALA . 27.3 ttm-85 -94.29 146.27 24.15 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 114.968 -1.014 . . . . 20.0 108.959 178.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -94.74 116.39 28.68 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.29 0.567 . . . . 20.0 110.65 -179.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -130.63 111.62 12.38 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.531 -0.759 . . . . 20.0 109.684 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 59.9 ttp180 -110.49 101.3 10.0 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.877 -0.601 . . . . 20.0 110.356 -179.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.916 ' CG2' HD21 ' A' ' 64' ' ' LEU . 35.4 m -125.42 162.95 27.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 120.872 0.368 . . . . 20.0 111.264 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.564 ' HA ' ' HA ' ' A' ' 131' ' ' SER . 14.4 pt20 -95.99 137.84 34.48 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-O 121.53 0.681 . . . . 20.0 112.17 -178.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.764 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -74.79 133.9 41.88 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 115.218 -0.901 . . . . 20.0 109.557 179.094 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.655 HD12 ' N ' ' A' ' 122' ' ' LEU . 2.3 mp -94.72 140.34 30.02 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-O 121.404 0.621 . . . . 20.0 111.638 -178.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . 0.531 ' SG ' ' HD2' ' A' ' 124' ' ' PRO . 0.3 OUTLIER -117.85 154.8 51.3 Favored Pre-proline 0 C--N 1.321 -0.639 0 CA-C-N 115.27 -0.877 . . . . 20.0 109.455 178.957 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.531 ' HD2' ' SG ' ' A' ' 123' ' ' CYS . 51.3 Cg_exo -53.32 114.1 1.59 Allowed 'Trans proline' 0 N--CA 1.463 -0.283 0 C-N-CA 121.958 1.772 . . . . 20.0 112.083 -179.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.423 ' O ' ' C ' ' A' ' 126' ' ' GLY . . . 100.64 2.64 55.35 Favored Glycine 0 N--CA 1.451 -0.349 0 CA-C-N 115.768 -0.651 . . . . 20.0 112.628 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . 0.423 ' C ' ' O ' ' A' ' 125' ' ' GLY . . . 36.38 61.93 0.8 Allowed Glycine 0 C--N 1.331 0.257 0 C-N-CA 120.667 -0.777 . . . . 20.0 111.811 -179.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -103.0 -56.62 2.19 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.519 0.563 . . . . 20.0 112.519 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -125.28 58.3 19.73 Favored Pre-proline 0 C--N 1.325 -0.484 0 C-N-CA 120.886 -0.326 . . . . 20.0 111.819 -178.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_endo -48.87 150.15 6.92 Favored 'Trans proline' 0 N--CA 1.461 -0.386 0 C-N-CA 122.477 2.118 . . . . 20.0 111.295 178.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.764 ' HB2' HD12 ' A' ' 121' ' ' LEU . 98.3 mtt180 -123.75 148.43 46.63 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 121.054 -0.258 . . . . 20.0 110.86 -179.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.564 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 22.9 t -100.46 134.61 43.16 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.004 0.431 . . . . 20.0 111.705 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . 0.542 ' HD3' ' CB ' ' A' ' 64' ' ' LEU . 47.4 ttt85 -141.2 141.77 34.04 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.854 -0.612 . . . . 20.0 111.194 179.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 16.7 pttm -92.91 145.2 24.56 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.783 0.325 . . . . 20.0 111.067 179.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.497 HG21 ' O ' ' A' ' 63' ' ' PHE . 41.2 t -147.66 130.62 8.0 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.799 0 CA-C-O 121.529 0.681 . . . . 20.0 112.295 -179.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.625 ' O ' HD23 ' A' ' 136' ' ' LEU . 36.5 ptt-85 -113.52 111.85 22.59 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.868 -1.06 . . . . 20.0 109.652 178.411 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.625 HD23 ' O ' ' A' ' 135' ' ' ARG . 8.7 mt -119.05 143.05 47.32 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.372 0.508 . . . . 20.0 112.372 -179.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 1.01 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -63.32 83.76 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 115.989 -0.551 . . . . 20.0 111.028 179.192 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.529 ' HB1' ' NH2' ' A' ' 115' ' ' ARG . . . -65.98 -19.82 65.99 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.881 0.372 . . . . 20.0 110.672 179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 38.6 t -161.82 133.45 5.46 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.06 -0.518 . . . . 20.0 110.372 -179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' CYS . . . . . 0.565 ' CB ' ' HA ' ' A' ' 111' ' ' PRO . 26.6 p -133.81 165.49 24.86 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.211 0.529 . . . . 20.0 112.09 -179.432 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 28.2 mttp -120.81 138.29 54.11 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.357 -0.838 . . . . 20.0 109.226 178.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . 0.667 ' HA ' ' HA ' ' A' ' 109' ' ' CYS . 24.5 p -80.38 92.39 5.81 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 120.475 -0.49 . . . . 20.0 111.15 -178.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . . . . . . . . . 11.3 tptp -138.38 157.9 45.32 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.116 -0.493 . . . . 20.0 111.069 179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . . . . . . . . . 39.0 mtp85 . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.352 -0.833 . . . . 20.0 110.717 -179.373 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.8 mttm . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.851 0.357 . . . . 20.0 111.086 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 67.6 m-20 -84.75 14.51 4.66 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.199 -0.455 . . . . 20.0 111.436 -179.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 70.3 t -66.2 -40.32 86.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.313 -0.403 . . . . 20.0 111.402 -179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 47.4 p -82.8 -7.94 59.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.378 -0.374 . . . . 20.0 110.951 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.483 ' HB3' ' HB2' ' A' ' 83' ' ' GLN . 71.9 mm-40 -79.96 4.84 15.61 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.307 -0.406 . . . . 20.0 110.707 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.567 ' CD2' ' SG ' ' A' ' 142' ' ' CYS . 3.3 m-85 -95.5 19.6 10.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.058 -0.519 . . . . 20.0 111.614 -179.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -56.79 107.35 0.39 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.377 0.608 . . . . 20.0 110.225 -179.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.493 ' HB3' ' SG ' ' A' ' 80' ' ' CYS . 3.2 m -155.06 22.01 0.43 Allowed 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.057 -0.974 . . . . 20.0 109.83 -179.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.755 HH11 HD23 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -48.33 -173.99 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.384 -0.826 . . . . 20.0 111.388 -179.195 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -78.15 91.96 4.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.79 -0.641 . . . . 20.0 110.751 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 1.076 HD22 HG23 ' A' ' 79' ' ' VAL . 0.0 OUTLIER -104.67 140.7 37.67 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.376 -0.829 . . . . 20.0 110.013 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.602 ' CG ' HG22 ' A' ' 76' ' ' THR . 48.2 m170 -125.52 130.75 52.38 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.546 -0.462 . . . . 20.0 111.486 -179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.634 ' CD1' HG13 ' A' ' 79' ' ' VAL . 0.2 OUTLIER -147.9 161.8 40.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.988 0.423 . . . . 20.0 111.28 179.483 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.555 HG23 ' CE1' ' A' ' 63' ' ' PHE . 52.8 m -76.11 136.22 39.85 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.609 0.719 . . . . 20.0 112.128 -178.67 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.893 ' O ' HG21 ' A' ' 75' ' ' VAL . 47.4 tpt85 174.86 109.61 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.59 -1.186 . . . . 20.0 108.799 179.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.584 ' HD1' HG13 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -116.41 -80.95 0.61 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 112.551 0.575 . . . . 20.0 112.551 -178.343 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.635 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -164.57 132.45 3.32 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 112.109 0.411 . . . . 20.0 112.109 -178.786 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.491 ' O ' ' NH1' ' A' ' 132' ' ' ARG . 72.6 p -129.12 136.62 50.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.067 -0.515 . . . . 20.0 110.232 178.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.868 ' OD2' HD13 ' A' ' 121' ' ' LEU . 31.4 p-10 -145.34 -164.33 1.92 Allowed 'General case' 0 C--O 1.237 0.426 0 CA-C-N 116.454 -0.339 . . . . 20.0 110.361 -179.789 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.845 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -31.72 147.99 0.01 OUTLIER Glycine 0 C--N 1.345 1.028 0 CA-C-O 118.453 -1.193 . . . . 20.0 110.152 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.547 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 56.3 Cg_exo -16.99 56.07 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.689 0 C-N-CA 125.167 3.911 . . . . 20.0 115.103 -178.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.845 ' N ' ' O ' ' A' ' 67' ' ' GLY . 34.4 m -163.22 157.68 20.69 Favored 'General case' 0 C--O 1.235 0.305 0 N-CA-C 108.272 -1.01 . . . . 20.0 108.272 178.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.517 ' O ' ' N ' ' A' ' 122' ' ' LEU . 80.6 mtt180 -149.26 143.95 26.2 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.679 0.622 . . . . 20.0 112.679 -179.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.635 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -89.02 159.01 17.8 Favored 'General case' 0 CA--C 1.514 -0.423 0 CA-C-N 115.478 -0.783 . . . . 20.0 109.521 177.938 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.578 ' HA ' ' CE2' ' A' ' 63' ' ' PHE . . . -145.85 22.7 1.41 Allowed 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 113.68 0.992 . . . . 20.0 113.68 -179.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.751 ' CB ' HG11 ' A' ' 119' ' ' VAL . 0.1 OUTLIER -67.11 139.74 95.41 Favored Pre-proline 0 C--N 1.326 -0.43 0 N-CA-C 109.433 -0.58 . . . . 20.0 109.433 178.999 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.46 ' HD2' ' HG3' ' A' ' 73' ' ' LYS . 54.1 Cg_exo -51.87 125.94 18.53 Favored 'Trans proline' 0 C--O 1.232 0.182 0 C-N-CA 122.353 2.035 . . . . 20.0 112.333 -179.127 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.893 HG21 ' O ' ' A' ' 62' ' ' ARG . 19.0 m -131.41 161.07 41.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 121.001 0.429 . . . . 20.0 111.248 -179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.602 HG22 ' CG ' ' A' ' 59' ' ' HIS . 0.0 OUTLIER -134.97 97.08 3.65 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.849 -0.614 . . . . 20.0 109.983 178.749 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.634 ' OE2' HD22 ' A' ' 136' ' ' LEU . 67.8 mt-10 -110.99 161.27 16.03 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.738 -0.664 . . . . 20.0 110.23 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.522 ' HA ' ' O ' ' A' ' 58' ' ' LEU . 8.7 mp -111.02 132.98 53.76 Favored 'General case' 0 CA--C 1.515 -0.388 0 CA-C-O 121.404 0.621 . . . . 20.0 111.494 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 1.076 HG23 HD22 ' A' ' 58' ' ' LEU . 23.4 m -87.05 78.16 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.587 0 CA-C-N 115.023 -0.989 . . . . 20.0 110.073 -179.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.493 ' SG ' ' HB3' ' A' ' 55' ' ' CYS . 0.1 OUTLIER -81.54 102.97 10.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.801 -0.636 . . . . 20.0 110.99 -179.084 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 2.0 m -146.3 104.91 3.83 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 115.866 -0.606 . . . . 20.0 111.045 179.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -161.43 -176.09 33.16 Favored Glycine 0 N--CA 1.453 -0.216 0 C-N-CA 120.513 -0.851 . . . . 20.0 112.7 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.483 ' HB2' ' HB3' ' A' ' 52' ' ' GLU . 93.3 mt-30 -120.27 117.05 26.82 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.86 0.362 . . . . 20.0 110.299 179.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.516 ' HA ' ' CE1' ' A' ' 53' ' ' TYR . 86.3 m -84.26 -16.06 44.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.969 -0.56 . . . . 20.0 111.444 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . 0.537 ' N ' ' HB2' ' A' ' 107' ' ' PHE . . . -141.96 172.07 24.25 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.622 -0.799 . . . . 20.0 112.651 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -52.66 -166.53 0.01 OUTLIER 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.804 2.336 . . . . 20.0 112.321 179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -86.98 34.11 0.67 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.068 -0.514 . . . . 20.0 111.174 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.548 ' NH2' ' CD1' ' A' ' 100' ' ' TRP . 25.5 tpt180 -56.25 131.91 49.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.085 0.469 . . . . 20.0 111.292 -179.284 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.718 HD22 ' N ' ' A' ' 89' ' ' LEU . 1.1 mm? -97.19 156.08 16.56 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.631 -0.713 . . . . 20.0 111.569 -179.411 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.511 ' CD1' ' HD2' ' A' ' 91' ' ' PRO . 4.5 mm? -68.23 165.15 36.28 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.934 -0.575 . . . . 20.0 110.636 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.61 ' HA ' ' CZ2' ' A' ' 100' ' ' TRP . 16.2 Cg_endo -57.44 107.93 0.33 Allowed 'Trans proline' 0 CA--C 1.528 0.223 0 C-N-CA 123.014 2.476 . . . . 20.0 113.375 -179.403 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.422 ' N ' ' CZ2' ' A' ' 100' ' ' TRP . 90.5 m-20 -126.04 59.68 1.31 Allowed 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 116.29 -0.414 . . . . 20.0 111.642 179.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.614 ' HA ' ' CZ3' ' A' ' 100' ' ' TRP . . . -59.87 -28.48 67.57 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.692 0.627 . . . . 20.0 112.692 -179.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.444 ' C ' ' O ' ' A' ' 93' ' ' ALA . 1.0 OUTLIER 36.7 29.95 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 121.122 0.487 . . . . 20.0 110.608 -178.74 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.507 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 98.7 -34.34 5.4 Favored Glycine 0 CA--C 1.522 0.484 0 CA-C-N 115.647 -0.706 . . . . 20.0 113.302 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.529 ' N ' ' O ' ' A' ' 93' ' ' ALA . 40.8 ttp180 -112.95 146.82 38.33 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.888 0.375 . . . . 20.0 111.869 -179.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 1.018 HG12 ' HD2' ' A' ' 101' ' ' ARG . 11.3 t -146.59 121.91 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.125 0 CA-C-N 116.078 -0.51 . . . . 20.0 110.477 178.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.691 ' HG3' ' CD1' ' A' ' 99' ' ' TRP . 3.1 ptpt 178.92 33.33 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.445 0.64 . . . . 20.0 110.747 -178.592 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.691 ' CD1' ' HG3' ' A' ' 98' ' ' LYS . 0.0 OUTLIER -151.11 -66.91 0.19 Allowed 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 107.647 -1.242 . . . . 20.0 107.647 -178.0 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' TRP . . . . . 0.639 ' O ' ' CE3' ' A' ' 100' ' ' TRP . 0.0 OUTLIER -99.39 129.06 45.56 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 107.146 -1.427 . . . . 20.0 107.146 176.34 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 1.018 ' HD2' HG12 ' A' ' 97' ' ' VAL . 0.2 OUTLIER -137.17 127.46 15.89 Favored Pre-proline 0 C--N 1.318 -0.793 0 C-N-CA 119.412 -0.915 . . . . 20.0 111.728 179.963 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.461 ' HD2' ' HA ' ' A' ' 101' ' ' ARG . 84.1 Cg_exo -26.75 61.3 0.0 OUTLIER 'Trans proline' 0 C--N 1.355 0.896 1 C-N-CA 126.092 4.528 . . . . 20.0 116.204 -179.01 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.657 ' N ' ' O ' ' A' ' 101' ' ' ARG . 79.3 m-20 -86.97 7.4 27.68 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.013 0.435 . . . . 20.0 110.254 178.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 129.18 147.48 6.36 Favored Glycine 0 N--CA 1.449 -0.488 0 CA-C-N 115.892 -0.595 . . . . 20.0 112.269 -179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -65.38 156.85 61.11 Favored 'Trans proline' 0 CA--C 1.528 0.176 0 C-N-CA 122.755 2.303 . . . . 20.0 112.562 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 57.1 p30 -52.88 164.65 0.36 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.052 -0.522 . . . . 20.0 111.015 -179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.537 ' HB2' ' N ' ' A' ' 85' ' ' GLY . 23.3 m-85 -120.06 148.51 43.49 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.21 -0.45 . . . . 20.0 111.544 -179.275 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.471 ' HA ' ' HA ' ' A' ' 83' ' ' GLN . 36.6 ttm180 -169.02 131.56 1.27 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.943 -0.571 . . . . 20.0 111.026 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.453 ' HB2' ' HB2' ' A' ' 142' ' ' CYS . 23.4 t -61.97 112.66 2.42 Favored 'General case' 0 C--N 1.33 -0.239 0 N-CA-C 109.049 -0.723 . . . . 20.0 109.049 179.376 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.561 ' CG1' ' HD2' ' A' ' 111' ' ' PRO . 10.8 tt -127.3 144.82 52.08 Favored Pre-proline 0 C--N 1.33 -0.273 0 N-CA-C 112.403 0.52 . . . . 20.0 112.403 -178.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 1.038 ' HB3' HG11 ' A' ' 137' ' ' VAL . 47.1 Cg_exo -56.61 154.71 29.55 Favored 'Trans proline' 0 C--N 1.345 0.352 0 C-N-CA 123.126 2.551 . . . . 20.0 111.85 179.609 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -124.67 -60.74 1.36 Allowed 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.539 0.57 . . . . 20.0 112.539 -179.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.813 ' O ' HG12 ' A' ' 137' ' ' VAL . 56.9 ttm-85 -111.98 156.66 21.78 Favored 'General case' 0 N--CA 1.464 0.252 0 N-CA-C 112.104 0.409 . . . . 20.0 112.104 -178.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.979 ' CE2' HG13 ' A' ' 137' ' ' VAL . 4.4 m-85 -134.51 165.49 25.08 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.681 -0.69 . . . . 20.0 112.188 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.514 ' N ' ' O ' ' A' ' 136' ' ' LEU . 14.2 ttm180 -103.3 151.31 22.86 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.611 -1.177 . . . . 20.0 108.358 177.739 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -90.52 124.84 35.33 Favored 'General case' 0 C--N 1.319 -0.761 0 C-N-CA 120.482 -0.487 . . . . 20.0 111.597 -179.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.435 ' NE2' ' HG2' ' A' ' 115' ' ' ARG . 83.1 mm-40 -131.44 131.3 43.44 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.889 -0.596 . . . . 20.0 110.71 179.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.414 ' HA ' ' O ' ' A' ' 132' ' ' ARG . 50.9 mtm180 -127.35 95.68 4.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.203 -0.453 . . . . 20.0 110.156 178.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.751 HG11 ' CB ' ' A' ' 73' ' ' LYS . 41.5 t -119.22 145.44 25.33 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.431 0 CA-C-N 115.813 -0.631 . . . . 20.0 111.2 -179.45 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.524 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 20.4 pt20 -79.27 131.23 36.09 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.174 -0.467 . . . . 20.0 109.803 179.53 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.9 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -78.46 125.49 29.44 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 121.088 0.471 . . . . 20.0 109.785 179.91 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.517 ' N ' ' O ' ' A' ' 70' ' ' ARG . 0.3 OUTLIER -85.77 131.96 34.22 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.435 -0.802 . . . . 20.0 111.665 -178.35 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . 0.566 ' CB ' ' HB3' ' A' ' 128' ' ' ALA . 0.5 OUTLIER -108.71 159.96 29.03 Favored Pre-proline 0 C--N 1.323 -0.572 0 CA-C-N 115.16 -0.927 . . . . 20.0 109.035 179.028 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.556 ' HD2' ' SG ' ' A' ' 123' ' ' CYS . 73.8 Cg_exo -50.71 111.11 0.48 Allowed 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 121.605 1.537 . . . . 20.0 111.913 -179.144 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 96.41 -11.11 67.14 Favored Glycine 0 N--CA 1.448 -0.501 0 CA-C-N 115.715 -0.675 . . . . 20.0 112.232 -179.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 72.26 23.39 78.03 Favored Glycine 0 C--N 1.332 0.347 0 C-N-CA 120.751 -0.737 . . . . 20.0 112.298 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -92.9 -5.86 49.92 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.333 0.494 . . . . 20.0 112.333 -179.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.566 ' HB3' ' CB ' ' A' ' 123' ' ' CYS . . . -133.12 51.02 6.25 Favored Pre-proline 0 C--N 1.331 -0.23 0 N-CA-C 112.727 0.64 . . . . 20.0 112.727 -179.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . 0.47 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 45.6 Cg_endo -68.97 140.16 44.9 Favored 'Trans proline' 0 CA--C 1.528 0.177 0 C-N-CA 122.421 2.081 . . . . 20.0 112.528 179.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.9 ' HB2' HD12 ' A' ' 121' ' ' LEU . 70.1 mtp85 -142.11 134.22 27.54 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.406 -0.361 . . . . 20.0 110.659 179.34 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 22.3 t -85.02 135.46 34.01 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.791 0.329 . . . . 20.0 110.701 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . 0.491 ' NH1' ' O ' ' A' ' 65' ' ' THR . 66.8 ttt180 -143.53 140.9 30.49 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 112.158 0.429 . . . . 20.0 112.158 -179.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.413 ' HA ' ' O ' ' A' ' 117' ' ' GLN . 2.5 pttp -98.41 139.13 34.62 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.473 -0.566 . . . . 20.0 109.473 178.246 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.411 HG21 ' O ' ' A' ' 63' ' ' PHE . 13.1 m -145.33 128.57 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 CA-C-O 121.401 0.619 . . . . 20.0 111.364 -179.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.724 ' C ' HD23 ' A' ' 136' ' ' LEU . 55.9 mtm180 -81.59 122.15 27.23 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.939 -1.028 . . . . 20.0 110.007 179.17 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.724 HD23 ' C ' ' A' ' 135' ' ' ARG . 9.2 mt -117.5 126.19 52.17 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.878 0.37 . . . . 20.0 111.998 -179.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 1.038 HG11 ' HB3' ' A' ' 111' ' ' PRO . 0.2 OUTLIER -71.33 89.48 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.403 -0.362 . . . . 20.0 111.909 179.692 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -78.44 -9.38 59.28 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.176 0.512 . . . . 20.0 109.809 178.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.3 p -158.35 120.0 3.54 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.575 -0.739 . . . . 20.0 110.353 179.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' CYS . . . . . 0.527 ' CB ' ' HA ' ' A' ' 111' ' ' PRO . 4.0 p -134.46 157.54 46.22 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.999 0.428 . . . . 20.0 111.746 -179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 42.6 mttt -125.43 146.69 49.51 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.716 -0.675 . . . . 20.0 110.046 179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . 0.567 ' SG ' ' CD2' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -75.87 99.64 4.55 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.093 0.473 . . . . 20.0 110.462 179.995 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.521 ' O ' ' HB2' ' A' ' 144' ' ' ARG . 17.8 mmtm -138.04 158.83 43.52 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.68 -0.691 . . . . 20.0 111.027 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.521 ' HB2' ' O ' ' A' ' 143' ' ' LYS . 72.3 mtt180 . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.23 -0.89 . . . . 20.0 110.925 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 72.3 mttt . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.797 0.332 . . . . 20.0 111.301 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 64.4 m-20 -85.9 17.24 3.56 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.371 -0.377 . . . . 20.0 111.258 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 78.1 t -66.09 -30.01 48.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 116.139 -0.482 . . . . 20.0 111.895 -179.657 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 37.8 p -82.11 -4.06 56.09 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.609 -0.268 . . . . 20.0 111.558 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 81.5 mm-40 -65.73 -37.0 85.17 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 111.728 0.269 . . . . 20.0 111.728 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.59 ' CD1' ' SG ' ' A' ' 142' ' ' CYS . 0.0 OUTLIER -104.27 -68.67 0.84 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.223 0.535 . . . . 20.0 110.826 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.48 ' HB2' ' HA3' ' A' ' 82' ' ' GLY . 0.1 OUTLIER -139.93 -155.91 0.63 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.391 -0.822 . . . . 20.0 110.588 -179.253 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.403 ' SG ' ' C ' ' A' ' 54' ' ' SER . 0.0 OUTLIER 48.57 93.68 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.22 -0.445 . . . . 20.0 109.831 179.751 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.574 ' HB2' HD22 ' A' ' 58' ' ' LEU . 3.5 mtt180 -120.64 -157.06 0.7 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.272 -0.422 . . . . 20.0 111.463 -178.66 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 -89.64 5.23 46.68 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.868 -0.606 . . . . 20.0 111.563 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.661 ' CG ' HG22 ' A' ' 79' ' ' VAL . 0.9 OUTLIER -81.49 123.83 28.95 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.031 0.443 . . . . 20.0 110.34 179.985 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.611 ' CD2' ' HG ' ' A' ' 78' ' ' LEU . 56.1 m80 -117.91 160.12 21.96 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.064 -0.516 . . . . 20.0 111.631 -178.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.613 ' CE1' HG11 ' A' ' 79' ' ' VAL . 13.3 m-30 -120.22 154.92 34.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.193 0.52 . . . . 20.0 111.519 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.406 ' O ' ' OG1' ' A' ' 61' ' ' THR . 0.2 OUTLIER -100.81 86.43 3.09 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.511 -0.768 . . . . 20.0 111.435 -179.298 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.99 ' O ' HG21 ' A' ' 75' ' ' VAL . 37.4 ttp180 -117.66 119.73 35.85 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 108.606 -0.887 . . . . 20.0 108.606 178.373 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.779 ' O ' HD23 ' A' ' 64' ' ' LEU . 0.1 OUTLIER -106.75 -80.03 0.57 Allowed 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.851 0.685 . . . . 20.0 112.851 -177.755 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.862 HD21 ' HB ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -174.37 146.21 1.05 Allowed 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 120.692 -0.403 . . . . 20.0 112.035 -178.479 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 71.0 p -137.97 148.57 45.34 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.084 -0.507 . . . . 20.0 111.379 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.518 ' O ' ' C ' ' A' ' 67' ' ' GLY . 7.9 t0 -154.13 -167.5 2.66 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 116.108 -0.496 . . . . 20.0 109.835 179.051 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.835 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -32.56 149.17 0.01 OUTLIER Glycine 0 C--N 1.345 1.036 0 CA-C-O 118.171 -1.349 . . . . 20.0 110.197 179.093 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.503 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 77.6 Cg_exo -18.27 57.72 0.0 OUTLIER 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 124.742 3.628 . . . . 20.0 114.949 -178.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.835 ' N ' ' O ' ' A' ' 67' ' ' GLY . 55.7 m -163.82 154.24 15.43 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 108.164 -1.05 . . . . 20.0 108.164 178.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.604 ' O ' HD12 ' A' ' 122' ' ' LEU . 74.1 mtt85 -151.84 144.3 24.14 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 112.61 0.596 . . . . 20.0 112.61 -179.409 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.621 ' CA ' ' HA ' ' A' ' 121' ' ' LEU . 0.3 OUTLIER -83.17 164.39 20.22 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.318 -0.856 . . . . 20.0 110.14 178.659 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -152.16 34.52 0.52 Allowed 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 113.309 0.855 . . . . 20.0 113.309 -179.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.719 ' HB2' HG11 ' A' ' 119' ' ' VAL . 21.8 mttm -82.35 148.55 59.52 Favored Pre-proline 0 C--N 1.329 -0.283 0 N-CA-C 109.193 -0.669 . . . . 20.0 109.193 178.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_endo -58.42 120.11 7.78 Favored 'Trans proline' 0 CA--C 1.525 0.072 0 C-N-CA 122.314 2.009 . . . . 20.0 112.871 -178.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.99 HG21 ' O ' ' A' ' 62' ' ' ARG . 16.4 m -133.99 143.74 37.56 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-N 115.672 -0.695 . . . . 20.0 110.813 179.531 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 73.4 m -125.29 129.56 50.24 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.955 0.407 . . . . 20.0 111.55 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.525 ' O ' ' HA ' ' A' ' 59' ' ' HIS . 15.0 pt-20 -144.23 154.92 43.6 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.91 -0.586 . . . . 20.0 109.633 178.466 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.611 ' HG ' ' CD2' ' A' ' 59' ' ' HIS . 6.4 mp -88.18 148.38 24.43 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.377 0.608 . . . . 20.0 112.095 -179.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.668 ' O ' ' CG2' ' A' ' 79' ' ' VAL . 0.8 OUTLIER -109.08 84.63 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.762 0 CA-C-N 114.909 -1.041 . . . . 20.0 109.119 179.082 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.455 ' HB3' ' SG ' ' A' ' 109' ' ' CYS . 0.0 OUTLIER -93.92 108.96 20.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.581 -0.736 . . . . 20.0 111.026 -178.729 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.466 ' C ' ' OG ' ' A' ' 54' ' ' SER . 29.2 t -147.45 98.05 2.94 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.917 -0.583 . . . . 20.0 110.695 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.48 ' HA3' ' HB2' ' A' ' 54' ' ' SER . . . -161.02 -153.44 7.0 Favored Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.696 -0.764 . . . . 20.0 112.68 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.535 ' HA ' ' HA ' ' A' ' 108' ' ' ARG . 97.5 mt-30 -122.44 147.22 46.58 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.892 0.377 . . . . 20.0 111.033 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.461 ' O ' ' HB3' ' A' ' 107' ' ' PHE . 84.6 m -118.63 154.84 32.0 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.149 -0.478 . . . . 20.0 110.704 179.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . 0.441 ' O ' ' O ' ' A' ' 84' ' ' CYS . . . 51.78 173.76 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.366 -0.921 . . . . 20.0 111.554 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -52.99 140.07 59.86 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.194 1.929 . . . . 20.0 111.431 179.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -77.53 0.55 22.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.417 -0.356 . . . . 20.0 111.581 -179.492 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.648 ' C ' HD13 ' A' ' 89' ' ' LEU . 19.7 mmm180 -70.15 138.29 51.74 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.962 0.41 . . . . 20.0 110.26 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.648 HD13 ' C ' ' A' ' 88' ' ' ARG . 0.3 OUTLIER -108.93 119.03 38.36 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.88 -0.6 . . . . 20.0 111.401 -179.177 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 10.8 mt -107.2 121.35 44.88 Favored Pre-proline 0 N--CA 1.462 0.15 0 CA-C-O 120.849 0.357 . . . . 20.0 111.258 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.566 ' HG2' ' NE1' ' A' ' 100' ' ' TRP . 58.0 Cg_endo -70.35 96.39 0.64 Allowed 'Trans proline' 0 CA--C 1.532 0.415 0 C-N-CA 122.784 2.322 . . . . 20.0 111.603 179.218 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -158.6 78.1 0.78 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 120.991 0.424 . . . . 20.0 110.74 -179.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.5 ' HB3' ' CZ3' ' A' ' 99' ' ' TRP . . . -66.67 -46.83 74.4 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.901 -0.59 . . . . 20.0 112.515 -179.161 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.48 HD12 ' CZ2' ' A' ' 99' ' ' TRP . 0.2 OUTLIER -138.15 -16.73 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 N-CA-C 113.253 0.834 . . . . 20.0 113.253 -178.452 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 126.58 -30.68 4.17 Favored Glycine 0 N--CA 1.453 -0.191 0 C-N-CA 120.592 -0.813 . . . . 20.0 112.039 -178.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.591 ' O ' ' CZ3' ' A' ' 100' ' ' TRP . 73.0 mtt180 -67.17 -161.59 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.208 -0.664 . . . . 20.0 109.208 178.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 1.005 ' O ' ' CD1' ' A' ' 99' ' ' TRP . 2.1 t -146.52 -138.74 0.02 OUTLIER 'Isoleucine or valine' 0 C--O 1.198 -1.637 0 CA-C-N 117.73 0.241 . . . . 20.0 111.525 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.569 ' CG ' ' O ' ' A' ' 97' ' ' VAL . 1.4 ptpt 42.51 18.41 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 N-CA-C 113.851 1.056 . . . . 20.0 113.851 179.097 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 1.005 ' CD1' ' O ' ' A' ' 97' ' ' VAL . 18.7 p-90 -157.0 14.68 0.27 Allowed 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 109.959 -0.385 . . . . 20.0 109.959 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' TRP . . . . . 0.745 ' HA ' ' CE3' ' A' ' 100' ' ' TRP . 0.0 OUTLIER -33.09 138.79 0.06 Allowed 'General case' 0 CA--C 1.493 -1.222 0 CA-C-O 122.702 1.239 . . . . 20.0 114.038 -177.552 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.474 ' CZ ' ' CB ' ' A' ' 93' ' ' ALA . 1.6 mpp_? -127.45 82.98 67.24 Favored Pre-proline 0 N--CA 1.431 -1.387 0 CA-C-N 112.572 -2.104 . . . . 20.0 109.289 179.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -57.08 -10.21 5.62 Favored 'Trans proline' 0 N--CA 1.464 -0.226 0 C-N-CA 123.202 2.601 . . . . 20.0 112.611 -179.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -57.35 -35.74 70.32 Favored 'General case' 0 C--N 1.333 -0.113 0 CA-C-O 120.98 0.419 . . . . 20.0 110.005 179.154 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.447 ' HA3' ' HB3' ' A' ' 89' ' ' LEU . . . 64.22 173.67 3.23 Favored Glycine 0 N--CA 1.449 -0.453 0 C-N-CA 120.907 -0.664 . . . . 20.0 112.825 179.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -73.48 135.74 22.67 Favored 'Trans proline' 0 N--CA 1.464 -0.25 0 C-N-CA 122.794 2.33 . . . . 20.0 111.857 179.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -80.16 138.52 36.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.833 0.349 . . . . 20.0 111.102 179.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.461 ' HB3' ' O ' ' A' ' 84' ' ' CYS . 94.2 m-85 -120.83 147.09 45.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 20.0 110.746 179.303 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.535 ' HA ' ' HA ' ' A' ' 83' ' ' GLN . 35.2 ptt180 -178.42 163.22 1.56 Allowed 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.266 -0.425 . . . . 20.0 110.981 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.54 ' HA ' ' HA ' ' A' ' 142' ' ' CYS . 42.5 t -80.88 129.41 34.52 Favored 'General case' 0 C--N 1.333 -0.14 0 N-CA-C 109.266 -0.642 . . . . 20.0 109.266 179.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.558 HG21 ' HD2' ' A' ' 144' ' ' ARG . 5.6 tt -123.09 140.45 33.6 Favored Pre-proline 0 C--N 1.326 -0.427 0 CA-C-O 120.837 0.351 . . . . 20.0 111.54 -179.178 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.994 ' HB3' HG11 ' A' ' 137' ' ' VAL . 17.9 Cg_endo -56.2 152.58 37.51 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.394 2.063 . . . . 20.0 110.948 178.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 48.8 t0 -120.21 -61.26 1.61 Allowed 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.798 -0.361 . . . . 20.0 111.468 -179.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.477 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 57.9 ttp180 -127.22 146.12 50.53 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.881 0.372 . . . . 20.0 111.393 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 1.166 ' CE2' HG13 ' A' ' 137' ' ' VAL . 2.9 m-85 -120.89 154.68 35.55 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.842 -0.617 . . . . 20.0 111.562 -179.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.63 ' HB2' ' HB2' ' A' ' 138' ' ' ALA . 58.9 ttm-85 -92.13 147.44 22.93 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 108.646 -0.872 . . . . 20.0 108.646 178.338 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -82.41 123.0 28.73 Favored 'General case' 0 C--N 1.319 -0.724 0 C-N-CA 120.814 -0.355 . . . . 20.0 111.206 -179.132 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.586 ' HG2' HD23 ' A' ' 136' ' ' LEU . 82.9 mm-40 -126.4 125.44 42.19 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-N 116.308 -0.405 . . . . 20.0 110.352 179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 67.2 ttp85 -124.34 100.17 6.56 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.248 0.547 . . . . 20.0 110.553 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.862 ' HB ' HD21 ' A' ' 64' ' ' LEU . 86.2 t -125.1 147.66 29.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 115.372 -0.831 . . . . 20.0 111.093 -179.481 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.586 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 10.8 pt20 -92.12 133.87 35.37 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 109.858 -0.423 . . . . 20.0 109.858 179.541 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.902 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -78.24 135.16 37.52 Favored 'General case' 0 CA--C 1.52 -0.197 0 CA-C-O 121.25 0.547 . . . . 20.0 111.759 -178.82 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.604 HD12 ' O ' ' A' ' 70' ' ' ARG . 0.3 OUTLIER -82.39 146.84 29.12 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.248 -0.887 . . . . 20.0 110.282 179.801 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . 0.573 ' HB2' ' O ' ' A' ' 126' ' ' GLY . 3.5 m -106.64 104.91 53.09 Favored Pre-proline 0 N--CA 1.45 -0.428 0 CA-C-O 120.975 0.417 . . . . 20.0 110.768 -178.483 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.547 ' CD ' ' HA ' ' A' ' 69' ' ' CYS . 23.4 Cg_exo -60.06 104.41 0.24 Allowed 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.45 2.1 . . . . 20.0 111.913 -179.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 84.69 21.08 56.98 Favored Glycine 0 N--CA 1.452 -0.254 0 C-N-CA 120.645 -0.788 . . . . 20.0 111.955 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . 0.573 ' O ' ' HB2' ' A' ' 123' ' ' CYS . . . -159.07 127.85 1.92 Allowed Glycine 0 N--CA 1.442 -0.915 0 N-CA-C 111.051 -0.82 . . . . 20.0 111.051 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -85.9 46.42 1.32 Allowed 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 111.872 0.323 . . . . 20.0 111.872 -178.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . 0.426 ' O ' ' SG ' ' A' ' 123' ' ' CYS . . . -120.85 63.89 11.54 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 121.117 0.484 . . . . 20.0 110.624 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 16.0 Cg_endo -57.93 151.01 60.13 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.98 2.453 . . . . 20.0 112.015 179.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.902 ' HB2' HD12 ' A' ' 121' ' ' LEU . 73.8 mtp85 -124.12 154.75 39.55 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 116.3 -0.409 . . . . 20.0 110.915 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.445 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 47.0 t -106.2 133.12 51.4 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 120.786 0.327 . . . . 20.0 111.789 -179.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 58.0 ttt85 -147.8 138.3 23.08 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 112.223 0.453 . . . . 20.0 112.223 179.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 12.5 pttp -94.45 146.84 23.8 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.08 -0.509 . . . . 20.0 109.706 178.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.603 HG21 ' O ' ' A' ' 63' ' ' PHE . 4.9 t -147.28 127.84 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.71 0 CA-C-O 121.485 0.659 . . . . 20.0 111.95 -179.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.777 ' C ' HD22 ' A' ' 136' ' ' LEU . 31.4 ptt180 -93.13 121.2 34.24 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.87 -1.059 . . . . 20.0 109.966 179.193 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.777 HD22 ' C ' ' A' ' 135' ' ' ARG . 0.7 OUTLIER -114.45 126.55 55.09 Favored 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 112.395 0.517 . . . . 20.0 112.395 -178.497 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 1.166 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -53.43 84.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.551 -0.295 . . . . 20.0 111.713 179.794 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.63 ' HB2' ' HB2' ' A' ' 115' ' ' ARG . . . -64.72 -20.32 66.26 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.303 0.573 . . . . 20.0 110.152 179.28 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 36.1 t -160.45 127.97 4.45 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.404 -0.816 . . . . 20.0 110.483 179.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' CYS . . . . . 0.517 ' HB2' ' HA ' ' A' ' 111' ' ' PRO . 27.9 p -134.66 156.22 49.13 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.833 0.349 . . . . 20.0 110.575 179.653 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -129.95 154.94 46.85 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.211 -0.449 . . . . 20.0 110.387 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . 0.59 ' SG ' ' CD1' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -83.84 99.69 10.48 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.254 0.549 . . . . 20.0 111.148 -179.131 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.566 ' O ' ' HB2' ' A' ' 144' ' ' ARG . 8.4 tptt -137.29 145.8 43.91 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.468 -0.787 . . . . 20.0 109.938 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.566 ' HB2' ' O ' ' A' ' 143' ' ' LYS . 83.9 mtt-85 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.311 -0.852 . . . . 20.0 110.88 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 18.2 mttt . . . . . 0 N--CA 1.485 1.297 0 CA-C-O 120.801 0.334 . . . . 20.0 110.799 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -85.9 17.51 3.43 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.208 -0.451 . . . . 20.0 111.465 -179.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 43.4 t -70.3 -26.69 29.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.265 -0.425 . . . . 20.0 111.022 -179.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 96.8 p -80.7 -8.99 59.82 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.231 -0.44 . . . . 20.0 110.987 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 62.0 mm-40 -64.58 -31.45 72.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.256 -0.429 . . . . 20.0 111.517 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.604 ' CZ ' ' O ' ' A' ' 140' ' ' CYS . 21.1 p90 -108.96 -11.81 14.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.778 0.323 . . . . 20.0 111.174 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 44.7 m -72.97 150.63 42.32 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.131 0.491 . . . . 20.0 111.338 -179.017 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.462 ' CB ' ' HA3' ' A' ' 82' ' ' GLY . 0.0 OUTLIER -99.94 -29.23 12.68 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.628 -0.715 . . . . 20.0 109.14 179.03 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.539 ' HD2' ' N ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -155.21 160.21 40.69 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.16 -0.927 . . . . 20.0 110.179 179.76 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -70.62 98.02 1.43 Allowed 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.602 -0.518 . . . . 20.0 109.602 179.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.887 ' O ' HD12 ' A' ' 58' ' ' LEU . 4.6 pp -109.0 127.1 53.79 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.428 0.632 . . . . 20.0 112.654 -178.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.486 ' CD2' ' O ' ' A' ' 58' ' ' LEU . 1.4 m170 -163.58 100.44 0.92 Allowed 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 114.89 -1.05 . . . . 20.0 109.014 178.119 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 1.033 ' CE1' HG13 ' A' ' 79' ' ' VAL . 5.7 p90 -126.64 157.69 38.31 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.948 0.404 . . . . 20.0 111.711 -177.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.0 p -105.1 95.11 5.62 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 115.941 -0.572 . . . . 20.0 111.981 -179.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.733 ' O ' HG21 ' A' ' 75' ' ' VAL . 55.0 ttm-85 -116.98 125.11 50.9 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 108.263 -1.014 . . . . 20.0 108.263 177.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.712 ' C ' HD23 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -116.9 -79.81 0.59 Allowed 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 113.442 0.904 . . . . 20.0 113.442 -177.13 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.914 HD21 ' HB ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -171.21 141.15 1.57 Allowed 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.443 -0.503 . . . . 20.0 112.293 -177.269 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.783 HG22 ' HG3' ' A' ' 70' ' ' ARG . 30.6 p -134.42 133.59 40.69 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.483 . . . . 20.0 110.395 178.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.507 ' O ' ' C ' ' A' ' 67' ' ' GLY . 15.0 t0 -148.86 -162.31 1.53 Allowed 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.365 -0.379 . . . . 20.0 110.056 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.841 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -31.2 148.25 0.01 OUTLIER Glycine 0 C--N 1.344 1.015 0 CA-C-O 118.343 -1.254 . . . . 20.0 110.485 179.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.488 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 19.5 Cg_exo -16.51 60.21 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.696 0 C-N-CA 124.75 3.633 . . . . 20.0 113.993 -178.818 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.841 ' N ' ' O ' ' A' ' 67' ' ' GLY . 59.9 m -163.14 150.77 13.25 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 114.923 -1.035 . . . . 20.0 109.251 179.824 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.783 ' HG3' HG22 ' A' ' 65' ' ' THR . 57.3 ttt180 -145.68 124.55 12.69 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 120.84 0.352 . . . . 20.0 110.672 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.626 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.1 OUTLIER -74.71 156.59 36.47 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 116.109 -0.496 . . . . 20.0 110.324 179.669 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -150.45 31.94 0.65 Allowed 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 113.305 0.854 . . . . 20.0 113.305 -179.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.655 ' O ' HG13 ' A' ' 75' ' ' VAL . 6.8 ttmt -75.24 144.97 79.46 Favored Pre-proline 0 C--N 1.326 -0.435 0 N-CA-C 109.985 -0.376 . . . . 20.0 109.985 179.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.459 ' HD2' ' CG ' ' A' ' 73' ' ' LYS . 50.2 Cg_exo -53.11 113.1 1.12 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.169 1.913 . . . . 20.0 112.002 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.733 HG21 ' O ' ' A' ' 62' ' ' ARG . 24.1 m -132.13 149.4 32.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 115.971 -0.559 . . . . 20.0 111.567 -179.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 6.1 m -115.01 118.13 32.55 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.568 -0.53 . . . . 20.0 109.568 178.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.662 ' CD ' HD12 ' A' ' 136' ' ' LEU . 44.1 mm-40 -125.04 151.12 46.03 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.521 -0.308 . . . . 20.0 110.769 -179.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.683 ' HA ' HD13 ' A' ' 58' ' ' LEU . 6.0 mp -119.34 125.55 49.3 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 113.054 0.761 . . . . 20.0 113.054 -179.014 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 1.033 HG13 ' CE1' ' A' ' 60' ' ' TYR . 2.5 m -109.8 76.61 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 CA-C-N 114.473 -1.24 . . . . 20.0 109.698 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.461 ' N ' HD22 ' A' ' 58' ' ' LEU . 1.0 OUTLIER -86.52 109.22 18.95 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.96 -0.564 . . . . 20.0 111.923 -178.794 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 30.1 t -148.32 103.62 3.45 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-N 115.799 -0.637 . . . . 20.0 110.507 179.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.499 ' O ' ' HB2' ' A' ' 108' ' ' ARG . . . -165.69 -160.87 13.56 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.516 -0.85 . . . . 20.0 112.838 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.52 ' HA ' ' HA ' ' A' ' 108' ' ' ARG . 94.9 mt-30 -114.92 140.34 49.07 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.693 0.282 . . . . 20.0 110.339 179.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.46 ' HB3' ' HD3' ' A' ' 86' ' ' PRO . 0.9 OUTLIER -109.14 152.61 24.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.393 -0.367 . . . . 20.0 110.455 179.703 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -129.79 61.2 0.66 Allowed Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 120.302 -0.951 . . . . 20.0 112.998 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . 0.46 ' HD3' ' HB3' ' A' ' 84' ' ' CYS . 21.6 Cg_endo -61.44 149.2 90.63 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.801 2.334 . . . . 20.0 111.988 179.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.477 ' O ' HD22 ' A' ' 89' ' ' LEU . . . -82.0 -3.11 53.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.27 -0.423 . . . . 20.0 111.607 -179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 54.0 mmm-85 -95.95 86.78 4.41 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.905 0.383 . . . . 20.0 110.359 179.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.562 HD22 ' N ' ' A' ' 89' ' ' LEU . 0.5 OUTLIER -96.87 124.48 40.86 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.014 -0.539 . . . . 20.0 110.407 -179.804 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.451 ' HA ' HD12 ' A' ' 90' ' ' LEU . 3.9 tp -110.96 112.0 55.95 Favored Pre-proline 0 C--N 1.327 -0.412 0 CA-C-N 116.269 -0.423 . . . . 20.0 111.705 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.608 ' HG2' ' CD1' ' A' ' 100' ' ' TRP . 3.0 Cg_exo -71.56 124.03 9.96 Favored 'Trans proline' 0 N--CA 1.464 -0.262 0 C-N-CA 122.963 2.442 . . . . 20.0 111.038 178.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -103.25 142.06 34.82 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 120.912 0.386 . . . . 20.0 111.416 -179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.733 ' HB2' ' CH2' ' A' ' 100' ' ' TRP . . . -83.71 -10.42 58.16 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 112.552 0.575 . . . . 20.0 112.552 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.934 HD12 ' CH2' ' A' ' 99' ' ' TRP . 1.0 OUTLIER 31.8 34.15 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.436 0.636 . . . . 20.0 111.513 179.583 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.543 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 116.23 -52.76 0.65 Allowed Glycine 0 CA--C 1.521 0.424 0 CA-C-N 114.921 -1.036 . . . . 20.0 112.499 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.731 ' O ' ' HB1' ' A' ' 93' ' ' ALA . 83.6 mtt85 -108.97 169.53 8.62 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.12 -0.326 . . . . 20.0 110.12 179.225 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 1.096 HG13 ' CZ3' ' A' ' 100' ' ' TRP . 2.3 t -126.46 -134.28 0.04 OUTLIER 'Isoleucine or valine' 0 C--O 1.199 -1.575 0 N-CA-C 112.818 0.673 . . . . 20.0 112.818 -179.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.62 ' CG ' ' O ' ' A' ' 97' ' ' VAL . 0.1 OUTLIER 54.71 -55.45 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 112.84 0.681 . . . . 20.0 112.84 -178.688 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.934 ' CH2' HD12 ' A' ' 94' ' ' ILE . 24.9 p-90 -75.44 45.69 0.31 Allowed 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 122.812 0.445 . . . . 20.0 110.6 179.014 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' TRP . . . . . 1.096 ' CZ3' HG13 ' A' ' 97' ' ' VAL . 0.0 OUTLIER -48.53 136.75 12.58 Favored 'General case' 0 CA--C 1.504 -0.818 0 CA-C-O 121.887 0.851 . . . . 20.0 112.943 -177.855 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.403 ' O ' ' HA ' ' A' ' 91' ' ' PRO . 0.0 OUTLIER -113.63 84.06 7.77 Favored Pre-proline 0 N--CA 1.438 -1.064 0 CA-C-N 113.96 -1.473 . . . . 20.0 110.948 -179.653 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.535 ' O ' ' CB ' ' A' ' 89' ' ' LEU . 44.7 Cg_endo -67.98 -1.93 7.85 Favored 'Trans proline' 0 C--N 1.34 0.125 0 C-N-CA 123.28 2.653 . . . . 20.0 112.326 179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 97.1 m-20 -59.18 -28.8 66.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.888 0.375 . . . . 20.0 110.727 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 84.19 159.45 29.48 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.701 -0.761 . . . . 20.0 112.677 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 40.7 Cg_endo -67.78 160.23 49.23 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.937 2.424 . . . . 20.0 112.12 179.688 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -67.34 137.42 56.01 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.229 -0.442 . . . . 20.0 110.81 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.432 ' HB3' ' HB2' ' A' ' 84' ' ' CYS . 97.4 m-85 -120.54 160.82 22.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.127 -0.488 . . . . 20.0 110.942 179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.52 ' HA ' ' HA ' ' A' ' 83' ' ' GLN . 39.7 ptt180 -172.56 161.18 4.91 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.013 0.435 . . . . 20.0 111.605 -179.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 142' ' ' CYS . 3.9 m -77.97 120.59 23.03 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.727 -0.669 . . . . 20.0 110.048 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.468 HG22 ' O ' ' A' ' 143' ' ' LYS . 2.9 tt -137.46 126.57 15.03 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.063 0.459 . . . . 20.0 111.571 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 1.041 ' HB3' HG11 ' A' ' 137' ' ' VAL . 51.6 Cg_exo -54.29 157.11 12.04 Favored 'Trans proline' 0 C--O 1.231 0.139 0 C-N-CA 123.079 2.519 . . . . 20.0 111.967 179.624 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -131.02 -63.66 0.85 Allowed 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 112.69 0.626 . . . . 20.0 112.69 -179.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.475 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 39.2 ttm180 -119.31 151.0 39.18 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.732 0.301 . . . . 20.0 111.72 -178.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.836 ' CE2' HG13 ' A' ' 137' ' ' VAL . 4.4 m-85 -122.71 141.99 51.18 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.942 -0.572 . . . . 20.0 111.539 -179.712 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.598 ' HB3' ' HB2' ' A' ' 138' ' ' ALA . 30.7 ttp180 -93.15 143.85 25.85 Favored 'General case' 0 N--CA 1.441 -0.915 0 CA-C-N 115.757 -0.656 . . . . 20.0 109.402 178.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -76.13 132.88 40.29 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.012 0.434 . . . . 20.0 111.198 -178.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.434 ' N ' ' O ' ' A' ' 134' ' ' VAL . 95.1 mm-40 -125.31 137.39 54.06 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.829 -0.623 . . . . 20.0 110.723 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 70.6 ttt-85 -130.2 106.9 8.9 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.11 -0.495 . . . . 20.0 110.863 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.914 ' HB ' HD21 ' A' ' 64' ' ' LEU . 21.5 t -135.03 152.16 32.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-N 116.062 -0.517 . . . . 20.0 111.358 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.544 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 11.1 pt20 -92.24 130.27 37.98 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.512 -0.313 . . . . 20.0 110.406 179.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.619 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.2 OUTLIER -77.0 126.61 31.26 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.005 0.431 . . . . 20.0 110.8 -179.982 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.54 HD12 ' O ' ' A' ' 70' ' ' ARG . 0.3 OUTLIER -90.64 134.83 34.11 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.93 -0.577 . . . . 20.0 111.419 -179.388 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . 0.501 ' HB3' ' HD2' ' A' ' 124' ' ' PRO . 0.0 OUTLIER -109.87 166.0 11.6 Favored Pre-proline 0 C--N 1.327 -0.389 0 CA-C-N 115.849 -0.614 . . . . 20.0 109.981 179.367 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.501 ' HD2' ' HB3' ' A' ' 123' ' ' CYS . 11.8 Cg_endo -56.3 109.45 0.44 Allowed 'Trans proline' 0 N--CA 1.463 -0.297 0 C-N-CA 122.012 1.808 . . . . 20.0 111.674 179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 96.95 -9.73 65.83 Favored Glycine 0 CA--C 1.517 0.21 0 C-N-CA 120.914 -0.66 . . . . 20.0 112.512 -179.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 57.23 56.93 22.41 Favored Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.733 -0.746 . . . . 20.0 112.235 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.416 ' O ' ' HD2' ' A' ' 129' ' ' PRO . . . -92.69 -62.47 1.39 Allowed 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 111.896 0.332 . . . . 20.0 111.896 -179.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -116.61 62.48 2.62 Favored Pre-proline 0 C--N 1.327 -0.391 0 N-CA-C 112.232 0.456 . . . . 20.0 112.232 -179.02 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . 0.416 ' HD2' ' O ' ' A' ' 127' ' ' ALA . 9.7 Cg_endo -49.91 146.7 16.01 Favored 'Trans proline' 0 N--CA 1.463 -0.295 0 C-N-CA 122.511 2.14 . . . . 20.0 110.898 178.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.551 ' HB2' HD12 ' A' ' 121' ' ' LEU . 14.6 mtp-105 -127.84 154.3 45.62 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 121.01 -0.276 . . . . 20.0 111.467 -179.056 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 99.7 p -105.18 139.85 39.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.326 -0.397 . . . . 20.0 111.303 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 53.9 ttt85 -145.51 138.9 26.41 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-O 121.085 0.469 . . . . 20.0 112.045 179.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -91.38 141.93 28.23 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.696 -0.684 . . . . 20.0 109.404 178.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.456 HG21 ' HB3' ' A' ' 64' ' ' LEU . 2.8 t -145.47 125.72 6.85 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 CA-C-O 121.318 0.58 . . . . 20.0 111.812 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.64 ' O ' HD23 ' A' ' 136' ' ' LEU . 49.5 ptt85 -99.21 113.82 26.29 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.155 -0.929 . . . . 20.0 110.175 179.015 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.662 HD12 ' CD ' ' A' ' 77' ' ' GLU . 32.5 mt -127.61 148.99 50.37 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.067 0.46 . . . . 20.0 111.311 -179.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 1.041 HG11 ' HB3' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -57.55 92.75 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 CA-C-N 115.728 -0.669 . . . . 20.0 112.397 -179.451 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.598 ' HB2' ' HB3' ' A' ' 115' ' ' ARG . . . -73.94 -13.06 60.83 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.142 0.496 . . . . 20.0 109.825 178.462 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 96.3 p -167.92 137.84 2.65 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 115.697 -0.683 . . . . 20.0 110.089 179.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' CYS . . . . . 0.604 ' O ' ' CZ ' ' A' ' 53' ' ' TYR . 24.4 p -144.18 166.42 25.08 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.834 0.349 . . . . 20.0 111.214 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 30.7 mttt -129.69 137.2 50.48 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-N 116.042 -0.526 . . . . 20.0 109.675 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . 0.534 ' HA ' ' HA ' ' A' ' 109' ' ' CYS . 9.0 t -80.65 94.86 6.41 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.839 0.352 . . . . 20.0 110.233 -179.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.522 ' O ' ' HB2' ' A' ' 144' ' ' ARG . 34.4 tptt -136.48 155.66 49.68 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.988 -0.551 . . . . 20.0 110.656 -179.374 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.522 ' HB2' ' O ' ' A' ' 143' ' ' LYS . 76.6 mtt-85 . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.286 -0.864 . . . . 20.0 110.908 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 83.4 mttt . . . . . 0 N--CA 1.483 1.193 0 CA-C-O 121.149 0.499 . . . . 20.0 111.125 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.439 ' HB3' ' HG3' ' A' ' 52' ' ' GLU . 94.1 m-20 -86.6 20.38 2.52 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.636 -0.711 . . . . 20.0 111.587 -179.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 79.0 t -63.64 -29.95 48.62 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 CA-C-N 116.377 -0.374 . . . . 20.0 111.448 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 82.6 p -83.33 4.03 29.04 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 116.422 -0.354 . . . . 20.0 111.36 -179.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.439 ' HG3' ' HB3' ' A' ' 49' ' ' ASP . 77.3 mm-40 -75.56 -1.73 25.76 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 112.029 0.381 . . . . 20.0 112.029 -179.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 -89.06 9.05 26.75 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 111.94 0.348 . . . . 20.0 111.94 -179.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 21.8 m -74.77 119.79 19.44 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 110.055 -0.35 . . . . 20.0 110.055 179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.525 ' HB2' ' HD2' ' A' ' 56' ' ' ARG . 2.0 m -67.89 -33.62 75.09 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.227 -0.442 . . . . 20.0 110.075 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.561 ' O ' ' N ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -162.68 171.57 16.65 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.717 -0.674 . . . . 20.0 110.083 179.738 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -53.76 82.59 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.102 0.477 . . . . 20.0 109.759 179.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 1.012 HD22 ' N ' ' A' ' 59' ' ' HIS . 0.1 OUTLIER -115.51 124.94 52.35 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.565 -0.743 . . . . 20.0 112.361 -178.061 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 1.012 ' N ' HD22 ' A' ' 58' ' ' LEU . 4.2 m170 -164.02 115.83 1.36 Allowed 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.879 -0.601 . . . . 20.0 110.991 178.108 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.688 ' HE1' HD23 ' A' ' 58' ' ' LEU . 79.5 m-85 -119.83 159.32 24.82 Favored 'General case' 0 N--CA 1.465 0.286 0 N-CA-C 112.432 0.53 . . . . 20.0 112.432 -178.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 42.5 p -123.62 83.85 2.19 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-N 115.705 -0.679 . . . . 20.0 110.442 179.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.689 ' O ' HG21 ' A' ' 75' ' ' VAL . 63.9 mtm180 -118.55 123.84 46.05 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 107.857 -1.164 . . . . 20.0 107.857 178.092 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.732 ' CD2' HG22 ' A' ' 75' ' ' VAL . 0.0 OUTLIER -108.07 -78.71 0.58 Allowed 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 112.609 0.596 . . . . 20.0 112.609 -177.189 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.734 HD21 ' HB ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -169.09 138.43 2.12 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.539 -0.464 . . . . 20.0 112.133 -178.246 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.67 HG22 ' HG3' ' A' ' 70' ' ' ARG . 40.6 p -129.26 143.57 50.9 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.514 -0.55 . . . . 20.0 109.514 177.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.552 ' O ' ' C ' ' A' ' 67' ' ' GLY . 5.9 t0 -153.0 -162.69 1.54 Allowed 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.94 -0.393 . . . . 20.0 109.94 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.872 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -29.05 141.64 0.01 OUTLIER Glycine 0 C--N 1.345 1.039 0 CA-C-O 118.424 -1.209 . . . . 20.0 110.301 179.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.513 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 56.2 Cg_exo -15.77 55.02 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.719 0 C-N-CA 125.287 3.991 . . . . 20.0 114.514 -178.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.872 ' N ' ' O ' ' A' ' 67' ' ' GLY . 19.6 m -162.81 167.34 23.0 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.005 -0.998 . . . . 20.0 108.537 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.67 ' HG3' HG22 ' A' ' 65' ' ' THR . 65.0 ttt180 -161.35 143.86 12.2 Favored 'General case' 0 C--N 1.326 -0.42 0 C-N-CA 120.965 -0.294 . . . . 20.0 111.523 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.824 ' HA ' HD12 ' A' ' 122' ' ' LEU . 0.9 OUTLIER -83.86 171.17 13.34 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 116.442 -0.345 . . . . 20.0 110.253 178.996 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -152.29 25.54 0.61 Allowed 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 113.44 0.904 . . . . 20.0 113.44 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.579 ' HB2' HG11 ' A' ' 119' ' ' VAL . 0.2 OUTLIER -68.49 144.19 96.13 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 109.165 -0.679 . . . . 20.0 109.165 178.901 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.92 114.64 1.99 Allowed 'Trans proline' 0 CA--C 1.527 0.17 0 C-N-CA 122.411 2.074 . . . . 20.0 112.329 -179.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.732 HG22 ' CD2' ' A' ' 63' ' ' PHE . 16.1 m -130.85 155.36 41.84 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.167 0 CA-C-O 120.955 0.407 . . . . 20.0 111.518 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.521 HG22 HD11 ' A' ' 78' ' ' LEU . 70.4 m -116.36 123.93 48.82 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.99 -0.55 . . . . 20.0 110.601 179.015 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.602 ' OE1' HD13 ' A' ' 136' ' ' LEU . 52.6 tp10 -121.73 127.51 50.77 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 116.193 -0.458 . . . . 20.0 110.4 179.255 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.872 ' HA ' HD11 ' A' ' 58' ' ' LEU . 1.7 mp -112.91 122.89 48.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.413 0.625 . . . . 20.0 111.551 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.816 HG23 ' O ' ' A' ' 79' ' ' VAL . 1.5 m -108.89 76.81 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 122.065 0.936 . . . . 20.0 108.891 178.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.481 ' O ' ' HA ' ' A' ' 110' ' ' ILE . 1.3 p -83.48 112.73 20.23 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.153 -0.93 . . . . 20.0 111.518 -178.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.422 ' HA ' ' O ' ' A' ' 109' ' ' CYS . 65.6 p -146.21 96.85 2.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.764 -0.653 . . . . 20.0 110.479 179.294 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.521 ' CA ' ' SG ' ' A' ' 109' ' ' CYS . . . -158.85 -157.35 8.46 Favored Glycine 0 N--CA 1.451 -0.345 0 CA-C-N 115.752 -0.658 . . . . 20.0 112.171 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.477 ' HA ' ' HA ' ' A' ' 108' ' ' ARG . 91.9 mt-30 -116.15 148.19 40.59 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.59 0.233 . . . . 20.0 110.459 -179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -128.96 157.88 40.4 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 120.766 0.317 . . . . 20.0 111.161 -179.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -128.99 68.01 0.55 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.654 -0.784 . . . . 20.0 112.679 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . 0.502 ' HG2' ' CE2' ' A' ' 107' ' ' PHE . 25.4 Cg_endo -60.25 148.49 89.73 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.925 2.416 . . . . 20.0 112.356 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -72.46 -1.93 17.64 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.404 -0.362 . . . . 20.0 111.41 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.565 ' C ' HD13 ' A' ' 89' ' ' LEU . 20.1 tpt180 -73.33 120.88 19.55 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.882 0.372 . . . . 20.0 110.316 -179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.605 ' N ' HD13 ' A' ' 89' ' ' LEU . 0.1 OUTLIER -101.99 111.46 23.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.144 -0.48 . . . . 20.0 111.312 -179.414 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.469 ' HA ' HD22 ' A' ' 90' ' ' LEU . 0.2 OUTLIER -123.85 88.6 52.15 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.013 0.435 . . . . 20.0 110.983 179.511 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.647 ' HB2' ' CD2' ' A' ' 100' ' ' TRP . 61.0 Cg_endo -71.32 96.87 0.74 Allowed 'Trans proline' 0 CA--C 1.53 0.301 0 C-N-CA 122.708 2.272 . . . . 20.0 111.439 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 33.2 p-10 -147.31 44.16 1.13 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.049 0.452 . . . . 20.0 111.096 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.963 ' HB3' ' CH2' ' A' ' 99' ' ' TRP . . . -60.56 -55.76 29.55 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.895 -0.593 . . . . 20.0 112.481 -179.177 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.408 HD12 ' CZ2' ' A' ' 99' ' ' TRP . 0.8 OUTLIER -122.04 -28.02 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.163 0 N-CA-C 112.403 0.52 . . . . 20.0 112.403 -179.054 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 124.67 -43.67 1.36 Allowed Glycine 0 C--N 1.328 0.086 0 C-N-CA 120.696 -0.764 . . . . 20.0 111.796 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.518 ' O ' ' NE1' ' A' ' 99' ' ' TRP . 90.8 mtt180 -66.79 148.63 51.67 Favored 'General case' 0 CA--C 1.514 -0.418 0 N-CA-C 108.94 -0.763 . . . . 20.0 108.94 178.224 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.993 HG13 ' CD2' ' A' ' 100' ' ' TRP . 1.9 t -122.42 132.41 71.19 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.074 0 CA-C-O 122.279 1.038 . . . . 20.0 112.501 -179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.432 ' HG2' ' C ' ' A' ' 97' ' ' VAL . 0.8 OUTLIER 165.66 -36.57 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.192 0 CA-C-N 113.159 -1.837 . . . . 20.0 107.136 -179.306 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.963 ' CH2' ' HB3' ' A' ' 93' ' ' ALA . 60.6 p-90 -98.19 8.45 44.78 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 112.668 -2.06 . . . . 20.0 110.129 178.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' TRP . . . . . 0.993 ' CD2' HG13 ' A' ' 97' ' ' VAL . 0.0 OUTLIER -22.97 137.77 0.01 OUTLIER 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 114.753 1.39 . . . . 20.0 114.753 -176.392 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.432 ' HD2' ' CE3' ' A' ' 99' ' ' TRP . 5.6 mtt85 -130.23 86.95 52.45 Favored Pre-proline 0 N--CA 1.444 -0.765 0 CA-C-N 113.354 -1.748 . . . . 20.0 111.552 -179.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.422 ' HD2' ' HA ' ' A' ' 101' ' ' ARG . 33.5 Cg_endo -64.57 -0.75 3.26 Favored 'Trans proline' 0 CA--C 1.53 0.293 0 C-N-CA 123.581 2.854 . . . . 20.0 113.681 -179.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 58.3 t-20 -56.35 -32.5 64.76 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.027 0.442 . . . . 20.0 110.375 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 85.27 161.44 34.35 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.827 -0.702 . . . . 20.0 112.472 179.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -66.39 167.5 18.52 Favored 'Trans proline' 0 N--CA 1.464 -0.263 0 C-N-CA 122.739 2.293 . . . . 20.0 112.209 179.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 57.7 t0 -75.09 123.12 24.64 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.985 -0.552 . . . . 20.0 110.262 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.502 ' CE2' ' HG2' ' A' ' 86' ' ' PRO . 96.4 m-85 -107.68 136.29 47.68 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.854 0.359 . . . . 20.0 111.355 -179.122 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.477 ' HA ' ' HA ' ' A' ' 83' ' ' GLN . 78.8 mtp180 -119.03 150.29 40.21 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.041 -0.527 . . . . 20.0 110.606 179.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.716 ' HA ' ' HA ' ' A' ' 142' ' ' CYS . 0.9 OUTLIER -90.67 103.27 15.98 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 120.319 -0.552 . . . . 20.0 110.893 179.231 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.793 HD12 ' O ' ' A' ' 111' ' ' PRO . 0.9 OUTLIER -126.07 155.74 72.99 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.809 -0.632 . . . . 20.0 110.633 179.419 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.888 ' CB ' HG11 ' A' ' 137' ' ' VAL . 19.0 Cg_endo -59.89 147.17 93.67 Favored 'Trans proline' 0 C--N 1.344 0.324 0 C-N-CA 122.913 2.409 . . . . 20.0 112.438 -179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -130.75 -46.36 1.05 Allowed 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 111.957 0.354 . . . . 20.0 111.957 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.558 ' O ' HG12 ' A' ' 137' ' ' VAL . 40.9 ttm180 -124.61 151.8 44.37 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.968 0.358 . . . . 20.0 111.968 -179.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.906 ' CZ ' HG13 ' A' ' 137' ' ' VAL . 0.9 OUTLIER -130.11 152.92 49.03 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.609 -0.723 . . . . 20.0 111.724 -179.693 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.585 ' O ' ' HA ' ' A' ' 135' ' ' ARG . 18.3 ttm-85 -93.98 137.61 33.0 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 115.868 -0.605 . . . . 20.0 109.7 178.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -82.1 120.86 25.84 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 120.756 0.312 . . . . 20.0 110.847 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.491 ' CG ' ' O ' ' A' ' 134' ' ' VAL . 9.2 pt20 -133.55 139.55 46.66 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.98 0.419 . . . . 20.0 111.269 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.411 ' HG2' ' CB ' ' A' ' 133' ' ' LYS . 71.7 mtp85 -123.14 108.81 13.26 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.926 -0.579 . . . . 20.0 110.841 179.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.734 ' HB ' HD21 ' A' ' 64' ' ' LEU . 74.8 t -120.36 145.06 27.28 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 115.786 -0.643 . . . . 20.0 110.773 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.565 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 26.9 mp0 -88.0 127.82 35.39 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.208 -0.451 . . . . 20.0 110.445 -179.748 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.78 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.2 OUTLIER -76.68 126.99 31.94 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.393 0.616 . . . . 20.0 111.589 -178.61 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.824 HD12 ' HA ' ' A' ' 71' ' ' SER . 3.1 mp -89.38 141.99 28.06 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.083 -0.962 . . . . 20.0 111.713 -179.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . 0.513 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.2 OUTLIER -118.06 153.81 51.37 Favored Pre-proline 0 C--N 1.322 -0.626 0 CA-C-N 115.563 -0.744 . . . . 20.0 109.248 178.271 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.494 ' HD2' ' SG ' ' A' ' 123' ' ' CYS . 88.9 Cg_exo -47.75 112.31 0.54 Allowed 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 122.046 1.831 . . . . 20.0 111.928 -179.442 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.429 ' O ' ' C ' ' A' ' 126' ' ' GLY . . . 91.85 6.31 65.54 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.552 -0.833 . . . . 20.0 112.268 -179.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . 0.429 ' C ' ' O ' ' A' ' 125' ' ' GLY . . . 34.23 73.13 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 121.041 -0.6 . . . . 20.0 112.858 179.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -111.2 -51.73 2.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.559 0.219 . . . . 20.0 111.567 179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -121.52 60.77 10.88 Favored Pre-proline 0 C--N 1.332 -0.18 0 CA-C-O 120.944 0.402 . . . . 20.0 111.895 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_endo -48.57 152.6 3.98 Favored 'Trans proline' 0 CA--C 1.528 0.213 0 C-N-CA 123.48 2.787 . . . . 20.0 112.483 179.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.78 ' HB2' HD12 ' A' ' 121' ' ' LEU . 80.5 mtt-85 -125.43 158.58 34.03 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.352 -0.385 . . . . 20.0 111.088 -179.249 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 9.7 t -114.66 136.67 52.79 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.511 -0.313 . . . . 20.0 110.742 179.888 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . 0.426 ' HD3' ' HB2' ' A' ' 64' ' ' LEU . 52.9 ttt85 -148.74 136.05 20.25 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.848 0.356 . . . . 20.0 111.793 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.411 ' CB ' ' HG2' ' A' ' 118' ' ' ARG . 25.1 pttm -96.45 140.53 30.96 Favored 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 109.69 -0.485 . . . . 20.0 109.69 178.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.491 ' O ' ' CG ' ' A' ' 117' ' ' GLN . 7.8 t -145.44 125.96 7.17 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 CA-C-O 121.198 0.523 . . . . 20.0 111.779 -178.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.598 ' HG2' ' HB2' ' A' ' 114' ' ' TYR . 39.1 ttt180 -99.03 111.9 24.17 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.561 -0.745 . . . . 20.0 109.43 178.325 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.602 HD13 ' OE1' ' A' ' 77' ' ' GLU . 22.0 mt -113.31 140.04 48.34 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.749 0.648 . . . . 20.0 112.749 -178.426 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.906 HG13 ' CZ ' ' A' ' 114' ' ' TYR . 0.0 OUTLIER -58.93 84.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.16 0 CA-C-N 116.219 -0.446 . . . . 20.0 111.455 179.43 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.418 ' HB1' HH21 ' A' ' 115' ' ' ARG . . . -74.14 -12.06 60.48 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.94 0.4 . . . . 20.0 110.43 179.34 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 48.5 t -164.98 124.86 1.88 Allowed 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 115.89 -0.595 . . . . 20.0 110.358 179.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' CYS . . . . . 0.593 ' CB ' ' HA ' ' A' ' 111' ' ' PRO . 23.1 p -125.46 159.41 32.01 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 121.103 0.477 . . . . 20.0 112.023 -179.404 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 22.2 mttm -115.58 145.82 42.32 Favored 'General case' 0 N--CA 1.455 -0.196 0 CA-C-N 115.705 -0.68 . . . . 20.0 109.391 178.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . 0.716 ' HA ' ' HA ' ' A' ' 109' ' ' CYS . 18.4 p -86.57 99.78 11.94 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.056 0.455 . . . . 20.0 110.773 -179.549 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.555 ' O ' ' HB2' ' A' ' 144' ' ' ARG . 7.8 tptt -146.0 146.75 31.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.856 -0.611 . . . . 20.0 111.043 -179.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.555 ' HB2' ' O ' ' A' ' 143' ' ' LYS . 49.7 mtp85 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.319 -0.848 . . . . 20.0 110.83 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 54.7 mttp . . . . . 0 N--CA 1.489 1.493 0 CA-C-O 121.015 0.436 . . . . 20.0 111.374 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -82.23 14.5 2.88 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.789 -0.641 . . . . 20.0 111.691 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.415 ' O ' ' O ' ' A' ' 54' ' ' SER . 61.8 t -66.16 -34.57 71.09 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 N-CA-C 112.149 0.425 . . . . 20.0 112.149 -179.503 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 53.5 m -82.19 0.23 41.99 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 111.916 0.339 . . . . 20.0 111.916 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 90.7 mt-10 -67.22 -37.39 83.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.789 0.328 . . . . 20.0 111.045 179.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.556 ' CD1' ' SG ' ' A' ' 142' ' ' CYS . 0.0 OUTLIER -101.66 -72.39 0.68 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 109.588 -0.523 . . . . 20.0 109.588 178.983 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.551 ' HB2' ' HA3' ' A' ' 82' ' ' GLY . 0.5 OUTLIER -145.24 -159.84 1.06 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.927 -0.579 . . . . 20.0 109.974 178.664 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.458 ' SG ' ' C ' ' A' ' 54' ' ' SER . 0.0 OUTLIER 50.62 54.05 11.87 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.167 0.508 . . . . 20.0 109.844 -179.941 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.94 -152.85 0.48 Allowed 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.329 -0.851 . . . . 20.0 110.862 -179.567 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 94.4 mt-10 -72.6 58.67 0.43 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-O 120.937 0.399 . . . . 20.0 111.09 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.859 HD11 HD23 ' A' ' 78' ' ' LEU . 0.3 OUTLIER -96.8 135.82 38.21 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.94 -0.573 . . . . 20.0 111.469 -179.642 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.503 ' CD2' ' O ' ' A' ' 58' ' ' LEU . 5.9 m170 -150.56 131.05 13.84 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.807 -0.633 . . . . 20.0 110.576 178.35 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.774 ' CE1' HG13 ' A' ' 79' ' ' VAL . 0.5 OUTLIER -143.5 163.07 34.17 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 116.212 -0.449 . . . . 20.0 110.362 -179.858 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 30.1 p -106.99 93.32 4.49 Favored 'General case' 0 C--O 1.232 0.167 0 N-CA-C 112.862 0.69 . . . . 20.0 112.862 -178.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.936 ' O ' HG21 ' A' ' 75' ' ' VAL . 23.1 mtt-85 -127.26 127.71 44.83 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 108.043 -1.095 . . . . 20.0 108.043 176.678 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.586 ' C ' HD23 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -118.47 -79.51 0.6 Allowed 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 113.053 0.76 . . . . 20.0 113.053 -177.0 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 1.076 HD11 HG23 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -166.43 136.96 3.36 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.014 0.435 . . . . 20.0 111.984 -178.314 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 59.9 p -129.88 140.01 51.06 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.719 -0.673 . . . . 20.0 110.356 178.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.535 ' O ' ' C ' ' A' ' 67' ' ' GLY . 11.7 t0 -147.86 -164.32 1.98 Allowed 'General case' 0 C--O 1.236 0.353 0 N-CA-C 109.968 -0.382 . . . . 20.0 109.968 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.866 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -30.67 146.04 0.01 OUTLIER Glycine 0 C--N 1.343 0.963 0 N-CA-C 110.2 -1.16 . . . . 20.0 110.2 179.48 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.493 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 59.4 Cg_exo -16.43 55.19 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 125.256 3.971 . . . . 20.0 115.037 -178.365 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.866 ' N ' ' O ' ' A' ' 67' ' ' GLY . 33.4 m -163.89 163.8 23.59 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.476 -0.935 . . . . 20.0 108.476 178.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.474 ' HG3' ' O ' ' A' ' 69' ' ' CYS . 82.1 mtt85 -157.71 148.02 20.68 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.342 0.591 . . . . 20.0 112.357 -179.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.814 ' HA ' HD12 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -88.26 164.06 15.79 Favored 'General case' 0 CA--C 1.508 -0.643 0 CA-C-N 115.302 -0.863 . . . . 20.0 109.952 178.568 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.411 ' HA ' ' CE1' ' A' ' 63' ' ' PHE . . . -149.73 26.77 0.82 Allowed 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 119.957 -0.697 . . . . 20.0 112.734 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.724 ' CB ' HG11 ' A' ' 119' ' ' VAL . 1.3 mptp? -73.58 145.7 85.1 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-O 120.888 0.375 . . . . 20.0 110.277 179.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -49.84 123.03 9.98 Favored 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.797 2.331 . . . . 20.0 112.79 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.936 HG21 ' O ' ' A' ' 62' ' ' ARG . 23.9 m -137.73 145.53 28.9 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.162 0 CA-C-N 116.053 -0.521 . . . . 20.0 111.503 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 21.3 m -123.18 115.27 21.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.915 -0.584 . . . . 20.0 109.625 178.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.577 ' CD ' HD12 ' A' ' 136' ' ' LEU . 48.1 mt-10 -130.26 163.43 26.77 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.629 0.252 . . . . 20.0 110.818 -179.527 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.859 HD23 HD11 ' A' ' 58' ' ' LEU . 6.0 mp -118.11 136.69 53.43 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 121.139 0.495 . . . . 20.0 111.578 179.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.81 HG23 ' O ' ' A' ' 79' ' ' VAL . 19.7 m -102.94 81.88 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-N 115.677 -0.692 . . . . 20.0 110.287 -179.657 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.521 ' CB ' ' SG ' ' A' ' 109' ' ' CYS . 0.0 OUTLIER -93.44 108.5 20.17 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.735 -0.666 . . . . 20.0 112.006 -178.974 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 19.5 m -152.28 99.77 2.54 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 115.824 -0.625 . . . . 20.0 110.282 179.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.551 ' HA3' ' HB2' ' A' ' 54' ' ' SER . . . -154.97 -151.33 5.81 Favored Glycine 0 C--N 1.331 0.261 0 C-N-CA 120.359 -0.924 . . . . 20.0 112.736 -179.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.524 ' HA ' ' HA ' ' A' ' 108' ' ' ARG . 91.5 mt-30 -124.69 140.61 52.78 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-O 120.858 0.361 . . . . 20.0 110.135 179.693 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.448 ' C ' ' HD3' ' A' ' 86' ' ' PRO . 89.7 m -111.26 151.24 28.53 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.854 0.359 . . . . 20.0 110.638 179.907 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . 0.401 ' N ' ' HD3' ' A' ' 86' ' ' PRO . . . -127.85 64.0 0.6 Allowed Glycine 0 N--CA 1.448 -0.526 0 C-N-CA 120.594 -0.812 . . . . 20.0 112.166 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . 0.554 ' HD2' ' CD2' ' A' ' 107' ' ' PHE . 24.3 Cg_exo -62.31 143.04 93.34 Favored 'Trans proline' 0 N--CA 1.458 -0.603 0 C-N-CA 122.145 1.897 . . . . 20.0 111.271 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.545 ' O ' HD22 ' A' ' 89' ' ' LEU . . . -73.69 3.62 6.17 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.799 -0.637 . . . . 20.0 111.221 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 26.0 mmm180 -90.95 93.39 9.18 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 120.866 0.365 . . . . 20.0 110.697 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.545 HD22 ' O ' ' A' ' 87' ' ' ALA . 0.7 OUTLIER -100.21 133.16 45.02 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 115.861 -0.609 . . . . 20.0 110.621 179.934 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.656 HD22 ' N ' ' A' ' 90' ' ' LEU . 1.8 mm? -111.24 91.82 14.4 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 120.851 0.358 . . . . 20.0 111.054 179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.658 ' HA ' ' CZ2' ' A' ' 100' ' ' TRP . 52.6 Cg_endo -70.16 88.57 0.58 Allowed 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.776 2.317 . . . . 20.0 111.573 179.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.481 ' O ' ' CH2' ' A' ' 99' ' ' TRP . 80.8 m-20 -139.83 65.92 1.41 Allowed 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 112.27 0.471 . . . . 20.0 112.27 -179.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.691 ' HB1' ' CG2' ' A' ' 97' ' ' VAL . . . -57.2 -18.9 17.76 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 111.386 0.143 . . . . 20.0 111.386 179.666 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.52 HG22 ' O ' ' A' ' 94' ' ' ILE . 3.5 mt 30.35 34.6 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.22 0 CA-C-O 121.143 0.497 . . . . 20.0 111.419 179.154 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.556 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 90.17 -42.5 2.94 Favored Glycine 0 N--CA 1.45 -0.379 0 CA-C-N 115.722 -0.672 . . . . 20.0 111.844 -179.34 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.485 ' N ' ' O ' ' A' ' 93' ' ' ALA . 41.7 ttm180 -106.27 128.86 54.28 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.857 0.36 . . . . 20.0 110.923 179.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.691 ' CG2' ' HB1' ' A' ' 93' ' ' ALA . 25.1 t -130.24 136.65 58.18 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.855 0 CA-C-O 121.467 0.651 . . . . 20.0 110.357 179.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt 176.17 -32.33 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.986 -1.006 . . . . 20.0 110.005 -179.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.578 ' CE3' ' HB3' ' A' ' 100' ' ' TRP . 0.1 OUTLIER -77.37 -79.75 0.11 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 114.742 -1.117 . . . . 20.0 110.713 -179.848 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' TRP . . . . . 0.658 ' CZ2' ' HA ' ' A' ' 91' ' ' PRO . 0.0 OUTLIER -89.59 177.69 6.48 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 120.92 0.391 . . . . 20.0 110.598 179.319 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.635 ' NE ' ' CZ2' ' A' ' 100' ' ' TRP . 0.0 OUTLIER 154.46 158.8 0.0 OUTLIER Pre-proline 0 CA--C 1.519 -0.228 0 CA-C-N 115.383 -0.826 . . . . 20.0 111.339 178.048 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.456 ' HD2' ' NE ' ' A' ' 101' ' ' ARG . 3.7 Cg_exo -40.76 -23.31 0.14 Allowed 'Trans proline' 0 N--CA 1.458 -0.562 0 C-N-CA 123.501 2.801 . . . . 20.0 112.311 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.405 ' N ' ' O ' ' A' ' 101' ' ' ARG . 24.8 p-10 -77.4 2.53 15.72 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.851 0.358 . . . . 20.0 110.583 179.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.463 ' HA2' ' HD3' ' A' ' 105' ' ' PRO . . . 91.94 138.67 8.3 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.974 -0.631 . . . . 20.0 112.976 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.588 ' HB2' ' CE2' ' A' ' 107' ' ' PHE . 12.0 Cg_exo -72.12 161.88 43.38 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 123.036 2.491 . . . . 20.0 111.518 179.4 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -74.36 98.61 3.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.766 0.317 . . . . 20.0 110.911 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.588 ' CE2' ' HB2' ' A' ' 105' ' ' PRO . 32.9 m-85 -123.55 162.22 23.37 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 116.457 -0.338 . . . . 20.0 111.566 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.524 ' HA ' ' HA ' ' A' ' 83' ' ' GLN . 35.2 ptt-85 -154.95 156.92 36.91 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.45 -0.341 . . . . 20.0 111.338 179.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.54 ' HA ' ' HA ' ' A' ' 142' ' ' CYS . 17.2 t -69.74 123.63 21.9 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 121.018 0.437 . . . . 20.0 110.208 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.728 HG23 ' HD2' ' A' ' 111' ' ' PRO . 39.3 mm -123.4 143.46 41.39 Favored Pre-proline 0 C--N 1.326 -0.453 0 CA-C-N 115.765 -0.652 . . . . 20.0 112.047 -178.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 1.033 ' CB ' HG11 ' A' ' 137' ' ' VAL . 14.8 Cg_endo -59.89 154.59 49.19 Favored 'Trans proline' 0 C--N 1.347 0.469 0 C-N-CA 123.437 2.758 . . . . 20.0 112.771 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 80.3 m-20 -124.25 -59.14 1.5 Allowed 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 111.922 0.342 . . . . 20.0 111.922 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.543 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 24.9 ttm105 -125.93 145.18 50.38 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 120.525 0.202 . . . . 20.0 111.224 -179.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.874 ' CD1' HG13 ' A' ' 137' ' ' VAL . 0.8 OUTLIER -118.57 159.82 22.88 Favored 'General case' 0 CA--C 1.518 -0.263 0 CA-C-O 121.448 0.642 . . . . 20.0 111.941 -179.513 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.62 ' HB2' ' HB2' ' A' ' 138' ' ' ALA . 38.5 ttm-85 -100.89 140.45 35.16 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 114.768 -1.105 . . . . 20.0 108.702 178.191 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -80.45 123.32 27.96 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 116.116 -0.493 . . . . 20.0 111.394 -178.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.69 ' HG2' HD23 ' A' ' 136' ' ' LEU . 80.1 mm-40 -124.93 124.77 42.74 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.971 -0.559 . . . . 20.0 109.887 179.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 67.0 ttp85 -130.28 92.43 3.28 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.025 0.441 . . . . 20.0 111.055 -179.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 1.076 HG23 HD11 ' A' ' 64' ' ' LEU . 35.1 m -126.3 170.22 16.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.562 -0.745 . . . . 20.0 110.666 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.555 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 13.0 pt20 -110.94 138.58 47.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.998 0.428 . . . . 20.0 110.946 179.618 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.827 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -75.82 125.04 28.32 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.975 -0.557 . . . . 20.0 110.928 -179.608 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.814 HD12 ' HA ' ' A' ' 71' ' ' SER . 1.9 mp -91.45 142.96 27.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.478 -0.783 . . . . 20.0 111.742 -178.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . 0.506 ' SG ' ' HD2' ' A' ' 124' ' ' PRO . 0.4 OUTLIER -119.23 152.3 52.16 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 115.372 -0.831 . . . . 20.0 110.538 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.506 ' HD2' ' SG ' ' A' ' 123' ' ' CYS . 76.4 Cg_exo -49.33 110.86 0.4 Allowed 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.525 2.15 . . . . 20.0 111.85 -179.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 91.83 3.9 67.89 Favored Glycine 0 N--CA 1.446 -0.695 0 CA-C-N 115.381 -0.827 . . . . 20.0 111.499 -178.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 38.42 86.07 0.01 OUTLIER Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.758 -0.734 . . . . 20.0 112.024 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -117.19 -53.36 2.46 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.053 0.39 . . . . 20.0 112.053 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -125.87 56.36 15.25 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 120.905 0.383 . . . . 20.0 111.506 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -52.82 146.92 33.97 Favored 'Trans proline' 0 N--CA 1.462 -0.378 0 C-N-CA 122.642 2.228 . . . . 20.0 111.458 179.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.827 ' HB2' HD12 ' A' ' 121' ' ' LEU . 79.8 mtt85 -125.69 150.6 47.51 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.16 -0.473 . . . . 20.0 111.112 -179.126 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.541 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 14.1 p -102.94 133.76 47.5 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.955 -0.566 . . . . 20.0 110.449 179.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 67.6 ttt180 -144.8 141.48 29.21 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.002 -0.545 . . . . 20.0 111.269 -179.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 14.4 pttp -103.3 149.65 24.52 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.18 -0.464 . . . . 20.0 110.414 179.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.557 HG23 ' HB2' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -151.88 130.28 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 CA-C-O 121.195 0.521 . . . . 20.0 111.399 -179.279 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.67 ' C ' HD22 ' A' ' 136' ' ' LEU . 86.1 mtm-85 -91.15 122.6 33.93 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.603 -0.726 . . . . 20.0 109.719 178.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.83 HD22 ' N ' ' A' ' 136' ' ' LEU . 0.7 OUTLIER -121.23 127.01 51.02 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.252 0.549 . . . . 20.0 112.341 -178.655 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 1.033 HG11 ' CB ' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -55.49 92.0 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.937 -0.574 . . . . 20.0 111.803 179.639 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.62 ' HB2' ' HB2' ' A' ' 115' ' ' ARG . . . -81.48 -5.72 58.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.196 -0.456 . . . . 20.0 110.616 179.303 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 22.6 t -159.36 115.63 2.58 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.756 -0.656 . . . . 20.0 109.677 179.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' CYS . . . . . . . . . . . . . 24.6 p -136.12 157.15 47.51 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.12 0.486 . . . . 20.0 112.076 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -131.82 145.82 51.78 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 115.655 -0.702 . . . . 20.0 110.81 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . 0.556 ' SG ' ' CD1' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -74.22 98.32 3.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.248 0.547 . . . . 20.0 110.158 179.628 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.464 ' O ' ' HB2' ' A' ' 144' ' ' ARG . 27.5 tptt -145.31 154.76 42.68 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.445 -0.798 . . . . 20.0 110.819 179.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.464 ' HB2' ' O ' ' A' ' 143' ' ' LYS . 64.9 mtp180 . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.239 -0.886 . . . . 20.0 110.723 179.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 58.5 mttp . . . . . 0 N--CA 1.487 1.381 0 CA-C-O 120.887 0.375 . . . . 20.0 111.19 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.431 ' OD1' ' C ' ' A' ' 49' ' ' ASP . 32.7 p30 -88.95 14.17 11.12 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.169 -0.469 . . . . 20.0 111.627 -179.234 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.42 ' O ' ' O ' ' A' ' 54' ' ' SER . 28.0 m -97.58 -18.26 6.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.359 0 CA-C-N 116.096 -0.502 . . . . 20.0 111.074 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.447 ' HA ' ' O ' ' A' ' 54' ' ' SER . 51.4 p -80.59 -9.19 59.79 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.728 -0.669 . . . . 20.0 110.919 -179.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -60.99 -33.25 72.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.897 0.38 . . . . 20.0 110.29 179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.629 ' CD2' ' HB2' ' A' ' 54' ' ' SER . 35.0 p90 -107.2 -57.11 2.12 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.237 -0.438 . . . . 20.0 111.77 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.629 ' HB2' ' CD2' ' A' ' 53' ' ' TYR . 0.4 OUTLIER -151.37 -166.57 2.56 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.706 -0.479 . . . . 20.0 109.706 179.973 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.9 m 61.52 55.1 2.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.135 0.493 . . . . 20.0 110.161 179.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.51 ' HD3' ' O ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -126.02 152.76 45.33 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.564 -0.744 . . . . 20.0 111.171 -179.907 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.503 ' O ' ' HG2' ' A' ' 57' ' ' GLU . 83.2 tt0 28.12 43.66 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 121.282 0.563 . . . . 20.0 110.61 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.927 ' O ' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -124.18 117.54 24.85 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.646 -0.706 . . . . 20.0 111.781 -178.861 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.574 ' CD2' ' O ' ' A' ' 58' ' ' LEU . 24.0 m170 -151.16 133.55 15.43 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.979 -0.555 . . . . 20.0 110.717 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.66 ' CD1' HG13 ' A' ' 79' ' ' VAL . 2.7 m-85 -132.06 150.08 52.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.194 -0.457 . . . . 20.0 111.381 -179.007 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -97.51 96.99 8.7 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-N 115.984 -0.553 . . . . 20.0 111.75 -179.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.943 ' O ' HG21 ' A' ' 75' ' ' VAL . 23.2 tpt180 -126.28 121.6 33.11 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 107.714 -1.217 . . . . 20.0 107.714 177.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.606 ' CD2' ' O ' ' A' ' 73' ' ' LYS . 0.0 OUTLIER -112.48 -81.28 0.59 Allowed 'General case' 0 C--N 1.32 -0.68 0 C-N-CA 120.003 -0.679 . . . . 20.0 112.702 -177.445 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.922 HD21 ' HB ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -169.06 137.6 2.02 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.214 -0.594 . . . . 20.0 112.203 -178.192 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.923 HG22 ' HG3' ' A' ' 70' ' ' ARG . 51.9 p -129.74 136.42 49.63 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.721 -0.672 . . . . 20.0 109.246 178.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.527 ' O ' ' C ' ' A' ' 67' ' ' GLY . 8.6 t0 -148.82 -158.31 0.9 Allowed 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 120.606 -0.438 . . . . 20.0 111.008 -179.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.864 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -31.37 141.5 0.04 OUTLIER Glycine 0 C--N 1.346 1.118 0 N-CA-C 109.718 -1.353 . . . . 20.0 109.718 179.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.521 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 20.1 Cg_exo -15.54 53.16 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.889 1 C-N-CA 125.409 4.072 . . . . 20.0 115.48 -178.207 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.864 ' N ' ' O ' ' A' ' 67' ' ' GLY . 65.4 m -159.29 162.85 36.1 Favored 'General case' 0 C--O 1.236 0.383 0 N-CA-C 107.885 -1.154 . . . . 20.0 107.885 178.093 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.923 ' HG3' HG22 ' A' ' 65' ' ' THR . 62.5 ttt180 -148.41 137.94 22.1 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 112.567 0.58 . . . . 20.0 112.567 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.637 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.6 OUTLIER -81.15 162.91 23.46 Favored 'General case' 0 CA--C 1.514 -0.419 0 CA-C-N 115.931 -0.577 . . . . 20.0 110.278 178.543 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -151.7 27.83 0.63 Allowed 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.942 0.719 . . . . 20.0 112.942 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.611 ' HB2' ' CG1' ' A' ' 119' ' ' VAL . 9.9 tttt -71.17 150.5 94.56 Favored Pre-proline 0 C--N 1.327 -0.379 0 N-CA-C 109.85 -0.426 . . . . 20.0 109.85 179.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.557 ' HD2' ' CG ' ' A' ' 73' ' ' LYS . 41.9 Cg_exo -59.85 115.07 2.37 Favored 'Trans proline' 0 N--CA 1.464 -0.247 0 C-N-CA 122.175 1.917 . . . . 20.0 112.241 -179.258 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.943 HG21 ' O ' ' A' ' 62' ' ' ARG . 4.9 m -134.77 155.42 38.43 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.202 0 CA-C-N 115.676 -0.693 . . . . 20.0 111.062 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 18.7 m -126.76 121.76 32.89 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.717 -0.674 . . . . 20.0 109.813 179.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.511 ' CB ' HD13 ' A' ' 136' ' ' LEU . 6.1 pt-20 -130.58 150.78 51.62 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.041 0.448 . . . . 20.0 111.404 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.665 ' HB3' HD21 ' A' ' 58' ' ' LEU . 5.2 mp -102.6 141.09 35.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.884 -0.598 . . . . 20.0 111.104 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.778 ' H ' HD23 ' A' ' 58' ' ' LEU . 5.8 m -90.91 87.84 2.73 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 N-CA-C 109.207 -0.664 . . . . 20.0 109.207 178.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.554 ' SG ' ' HB3' ' A' ' 109' ' ' CYS . 33.4 m -94.2 116.22 28.59 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.38 -0.827 . . . . 20.0 110.498 -178.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.728 ' O ' ' N ' ' A' ' 109' ' ' CYS . 4.2 m -114.78 154.88 27.75 Favored 'General case' 0 C--O 1.219 -0.535 0 CA-C-O 121.349 0.595 . . . . 20.0 111.938 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.477 ' O ' ' HA ' ' A' ' 107' ' ' PHE . . . -64.25 113.15 5.61 Favored Glycine 0 CA--C 1.522 0.521 0 C-N-CA 119.098 -1.525 . . . . 20.0 113.356 -178.163 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.587 ' HB2' ' N ' ' A' ' 108' ' ' ARG . 60.5 tt0 -156.56 152.3 27.1 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-O 121.038 0.447 . . . . 20.0 112.009 179.012 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.524 ' HB2' ' O ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER 162.71 40.29 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.687 -0.688 . . . . 20.0 111.165 178.931 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 109.87 -81.54 0.29 Allowed Glycine 0 CA--C 1.521 0.418 0 C-N-CA 120.625 -0.797 . . . . 20.0 113.396 179.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . 0.571 ' O ' ' CZ ' ' A' ' 144' ' ' ARG . 80.7 Cg_exo -38.38 113.19 0.14 Allowed 'Trans proline' 0 CA--C 1.531 0.327 0 C-N-CA 123.612 2.875 . . . . 20.0 113.826 -178.841 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -101.9 26.99 6.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.762 -0.653 . . . . 20.0 111.147 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.99 107.03 0.66 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.961 0.41 . . . . 20.0 110.351 -179.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.547 HD22 ' HA3' ' A' ' 104' ' ' GLY . 31.2 mt -87.28 151.42 23.15 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.87 -0.604 . . . . 20.0 110.396 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.477 ' O ' ' HA ' ' A' ' 102' ' ' PRO . 0.6 OUTLIER -92.29 115.13 64.18 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 120.767 0.318 . . . . 20.0 110.421 -179.822 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.408 ' HA ' ' HB3' ' A' ' 102' ' ' PRO . 25.6 Cg_endo -61.27 -162.43 0.03 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 122.759 2.306 . . . . 20.0 112.269 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -74.3 129.33 37.59 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.387 0.613 . . . . 20.0 112.007 -178.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.675 ' HB3' ' HH2' ' A' ' 99' ' ' TRP . . . -94.39 -6.75 43.46 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 114.993 -1.003 . . . . 20.0 112.413 -179.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.5 HG13 ' C ' ' A' ' 93' ' ' ALA . 9.6 mt -155.09 -36.01 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 N-CA-C 113.087 0.773 . . . . 20.0 113.087 -178.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 115.93 -30.19 6.72 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.508 -0.853 . . . . 20.0 111.175 -178.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.427 ' CD ' ' HE3' ' A' ' 98' ' ' LYS . 29.1 ptt180 -105.81 137.81 43.06 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 109.226 -0.657 . . . . 20.0 109.226 178.519 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.931 HG21 ' NE ' ' A' ' 101' ' ' ARG . 3.7 t -109.67 123.48 65.6 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.667 0 CA-C-O 122.075 0.94 . . . . 20.0 111.642 -179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.469 ' CG ' ' HD1' ' A' ' 99' ' ' TRP . 10.9 ptpt -158.99 20.16 0.2 Allowed 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 113.672 -1.604 . . . . 20.0 110.302 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.723 ' CZ2' ' CZ3' ' A' ' 100' ' ' TRP . 0.4 OUTLIER -153.75 -66.29 0.14 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.994 0.426 . . . . 20.0 112.125 -177.757 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' TRP . . . . . 0.723 ' CZ3' ' CZ2' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -123.02 -165.7 1.35 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.852 -0.613 . . . . 20.0 110.8 -178.856 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.931 ' NE ' HG21 ' A' ' 97' ' ' VAL . 0.5 OUTLIER -168.0 143.82 3.2 Favored Pre-proline 0 N--CA 1.453 -0.321 0 CA-C-O 120.974 0.416 . . . . 20.0 111.309 179.769 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.539 ' CD ' ' HD2' ' A' ' 101' ' ' ARG . 29.0 Cg_exo -63.09 1.36 1.2 Allowed 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 123.161 2.574 . . . . 20.0 114.068 -178.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -50.93 -28.54 9.95 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.62 -0.511 . . . . 20.0 109.62 178.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.547 ' HA3' HD22 ' A' ' 89' ' ' LEU . . . 124.12 153.69 8.7 Favored Glycine 0 C--N 1.334 0.471 0 C-N-CA 120.905 -0.664 . . . . 20.0 113.756 178.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.604 ' HD2' ' CZ ' ' A' ' 107' ' ' PHE . 2.8 Cg_endo -81.06 171.48 14.02 Favored 'Trans proline' 0 C--N 1.351 0.699 0 C-N-CA 123.34 2.693 . . . . 20.0 111.139 178.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.511 ' O ' ' HB3' ' A' ' 81' ' ' SER . 54.6 t0 -75.35 122.24 23.45 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.979 0.419 . . . . 20.0 110.897 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.604 ' CZ ' ' HD2' ' A' ' 105' ' ' PRO . 16.8 m-30 -109.6 131.7 54.82 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.003 -0.544 . . . . 20.0 110.508 -179.758 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.587 ' N ' ' HB2' ' A' ' 83' ' ' GLN . 41.6 ttm180 178.86 -46.16 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 113.599 0.963 . . . . 20.0 113.599 179.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.728 ' N ' ' O ' ' A' ' 81' ' ' SER . 1.1 m -167.36 146.2 4.98 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 113.455 0.909 . . . . 20.0 113.455 -178.054 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.907 HG22 ' O ' ' A' ' 141' ' ' LYS . 3.5 tp -105.82 132.66 20.69 Favored Pre-proline 0 N--CA 1.464 0.271 0 O-C-N 121.691 -0.631 . . . . 20.0 110.436 177.405 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.598 ' HA ' ' HB3' ' A' ' 140' ' ' CYS . 9.0 Cg_endo -53.58 139.51 66.45 Favored 'Trans proline' 0 C--O 1.232 0.189 0 C-N-CA 122.848 2.366 . . . . 20.0 111.913 -179.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -132.49 -68.75 0.6 Allowed 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 120.666 -0.414 . . . . 20.0 111.232 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.528 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 21.4 ttm180 -125.92 141.93 51.75 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.088 -0.506 . . . . 20.0 111.008 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.867 ' CE2' HG13 ' A' ' 137' ' ' VAL . 0.8 OUTLIER -116.59 159.39 22.21 Favored 'General case' 0 CA--C 1.513 -0.47 0 CA-C-O 121.677 0.751 . . . . 20.0 112.098 -179.477 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.426 ' HD2' ' NE2' ' A' ' 117' ' ' GLN . 47.2 ttm-85 -97.5 146.49 25.19 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 114.423 -1.262 . . . . 20.0 108.413 177.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . 0.503 ' O ' ' NE2' ' A' ' 117' ' ' GLN . . . -83.31 136.42 34.38 Favored 'General case' 0 C--N 1.315 -0.906 0 C-N-CA 120.717 -0.393 . . . . 20.0 111.691 -178.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.767 ' HB2' HG23 ' A' ' 134' ' ' VAL . 91.0 mm-40 -134.47 135.26 42.35 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.984 -0.553 . . . . 20.0 110.81 179.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 58.3 ttt-85 -128.38 93.96 3.77 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.359 -0.382 . . . . 20.0 110.298 179.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.922 ' HB ' HD21 ' A' ' 64' ' ' LEU . 25.1 t -129.17 144.69 37.39 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 N-CA-C 112.501 0.556 . . . . 20.0 112.501 -178.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.501 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 19.0 pt20 -88.24 131.15 34.88 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.169 -0.469 . . . . 20.0 110.711 179.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.594 ' HA ' ' CA ' ' A' ' 71' ' ' SER . 0.1 OUTLIER -77.26 116.15 17.63 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.08 -0.509 . . . . 20.0 111.163 -179.932 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.469 HD12 ' HA ' ' A' ' 71' ' ' SER . 0.2 OUTLIER -80.27 150.67 29.92 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.6 -0.727 . . . . 20.0 111.107 -179.922 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . 0.521 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -111.25 112.2 55.04 Favored Pre-proline 0 C--N 1.332 -0.184 0 CA-C-O 120.827 0.346 . . . . 20.0 110.81 179.433 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -54.99 108.13 0.28 Allowed 'Trans proline' 0 N--CA 1.464 -0.229 0 C-N-CA 122.502 2.135 . . . . 20.0 111.58 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 74.12 23.77 75.21 Favored Glycine 0 N--CA 1.452 -0.274 0 N-CA-C 110.853 -0.899 . . . . 20.0 110.853 -178.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . 0.5 ' O ' ' HB3' ' A' ' 123' ' ' CYS . . . -150.61 119.37 1.0 Allowed Glycine 0 N--CA 1.449 -0.448 0 N-CA-C 111.412 -0.675 . . . . 20.0 111.412 -179.53 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.465 ' C ' ' HD3' ' A' ' 129' ' ' PRO . . . -85.42 43.33 1.01 Allowed 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 112.968 0.729 . . . . 20.0 112.968 -178.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -114.16 60.52 1.0 Allowed Pre-proline 0 C--N 1.327 -0.375 0 CA-C-O 121.093 0.473 . . . . 20.0 110.533 178.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . 0.465 ' HD3' ' C ' ' A' ' 127' ' ' ALA . 41.3 Cg_endo -68.62 146.88 68.79 Favored 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 123.38 2.72 . . . . 20.0 112.71 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.563 ' HB2' HD12 ' A' ' 121' ' ' LEU . 83.2 mtt85 -134.35 148.36 50.7 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.874 -0.603 . . . . 20.0 110.46 179.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.495 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 57.8 p -89.8 141.12 28.93 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 121.096 -0.241 . . . . 20.0 110.869 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . 0.425 ' HB3' HD13 ' A' ' 64' ' ' LEU . 53.4 ttt85 -146.86 148.39 31.8 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-O 121.135 0.493 . . . . 20.0 112.135 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 1.9 pttt -101.39 145.72 28.55 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 115.382 -0.826 . . . . 20.0 109.884 178.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.767 HG23 ' HB2' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -149.29 126.54 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.438 0 CA-C-O 121.399 0.619 . . . . 20.0 111.448 179.86 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.595 ' C ' HD23 ' A' ' 136' ' ' LEU . 85.1 mtm180 -95.42 112.76 24.42 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.061 -0.972 . . . . 20.0 109.771 179.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.595 HD23 ' C ' ' A' ' 135' ' ' ARG . 1.7 mt -113.99 125.35 53.92 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.524 0.678 . . . . 20.0 112.677 -179.489 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.867 HG13 ' CE2' ' A' ' 114' ' ' TYR . 2.3 m -55.39 90.77 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.088 -0.96 . . . . 20.0 112.835 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -65.53 -25.46 67.46 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.488 -0.93 . . . . 20.0 108.488 177.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 26.3 p -161.94 129.11 3.88 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 114.992 -1.004 . . . . 20.0 110.632 179.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' CYS . . . . . 0.598 ' HB3' ' HA ' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -121.73 -174.93 2.98 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 120.803 0.335 . . . . 20.0 111.5 179.862 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.907 ' O ' HG22 ' A' ' 110' ' ' ILE . 15.5 tttp -118.56 168.55 10.58 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 116.315 -0.402 . . . . 20.0 111.698 -179.387 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . 0.558 ' N ' ' HG2' ' A' ' 141' ' ' LYS . 43.4 t -86.74 103.27 15.03 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.232 -0.44 . . . . 20.0 112.022 -179.254 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.896 ' CB ' HG21 ' A' ' 110' ' ' ILE . 12.0 tptm -142.94 142.39 31.68 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.078 -0.51 . . . . 20.0 110.247 178.446 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.571 ' CZ ' ' O ' ' A' ' 86' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.972 0 CA-C-O 118.311 -0.852 . . . . 20.0 110.414 179.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.9 mtmm . . . . . 0 N--CA 1.485 1.279 0 CA-C-O 120.904 0.383 . . . . 20.0 111.183 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -82.11 14.3 2.93 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.046 -0.525 . . . . 20.0 111.684 -179.214 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.472 HG11 ' HG2' ' A' ' 141' ' ' LYS . 29.2 m -99.42 -17.6 6.64 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.366 0 CA-C-O 121.075 0.464 . . . . 20.0 110.917 179.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 89.8 p -84.81 -1.58 56.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.607 -0.724 . . . . 20.0 111.268 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -61.57 -30.43 70.66 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.843 0.354 . . . . 20.0 110.444 -179.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.55 ' CD1' ' SG ' ' A' ' 142' ' ' CYS . 0.0 OUTLIER -111.47 -74.27 0.65 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.176 0.512 . . . . 20.0 110.366 179.118 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.566 ' CB ' ' HA3' ' A' ' 82' ' ' GLY . 20.3 t -143.05 -158.55 0.88 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.332 -0.849 . . . . 20.0 110.053 179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.476 ' O ' ' O ' ' A' ' 56' ' ' ARG . 0.0 OUTLIER 61.73 35.1 17.03 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.108 -0.496 . . . . 20.0 110.852 179.738 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.554 ' O ' HD13 ' A' ' 58' ' ' LEU . 0.1 OUTLIER -57.45 -146.33 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 20.0 110.209 179.423 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.46 ' N ' ' HG2' ' A' ' 56' ' ' ARG . 93.8 mt-10 -92.46 96.52 10.29 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.93 0.395 . . . . 20.0 110.756 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.863 ' O ' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -125.4 138.82 54.04 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.994 -0.548 . . . . 20.0 110.194 179.596 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.417 ' C ' ' CD1' ' A' ' 60' ' ' TYR . 9.0 m170 -139.0 132.6 30.48 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.052 0.453 . . . . 20.0 111.181 -179.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.655 ' CD1' HG13 ' A' ' 79' ' ' VAL . 10.2 m-85 -133.77 148.74 51.4 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.732 -0.667 . . . . 20.0 111.697 -178.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 73.2 p -103.29 82.46 2.06 Favored 'General case' 0 C--N 1.333 -0.114 0 CA-C-N 116.178 -0.465 . . . . 20.0 111.318 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.904 ' O ' HG21 ' A' ' 75' ' ' VAL . 68.0 ttt180 -114.93 123.19 48.5 Favored 'General case' 0 CA--C 1.516 -0.364 0 N-CA-C 108.405 -0.961 . . . . 20.0 108.405 177.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.931 ' O ' HG11 ' A' ' 134' ' ' VAL . 0.1 OUTLIER -110.6 -80.24 0.58 Allowed 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.154 0.427 . . . . 20.0 112.154 -177.859 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.675 ' O ' HD23 ' A' ' 121' ' ' LEU . 0.0 OUTLIER -166.92 133.97 2.43 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.62 -0.432 . . . . 20.0 111.089 -178.887 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 49.4 p -131.04 141.68 50.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.355 -0.384 . . . . 20.0 110.756 179.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.525 ' O ' ' C ' ' A' ' 67' ' ' GLY . 9.3 t0 -152.37 -163.92 1.84 Allowed 'General case' 0 C--O 1.236 0.382 0 N-CA-C 109.785 -0.45 . . . . 20.0 109.785 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.861 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -31.85 148.17 0.01 OUTLIER Glycine 0 C--N 1.345 1.058 0 CA-C-O 118.098 -1.39 . . . . 20.0 110.167 179.135 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.524 ' O ' ' SG ' ' A' ' 69' ' ' CYS . 41.6 Cg_exo -18.14 54.44 0.0 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.492 0 C-N-CA 124.971 3.78 . . . . 20.0 115.289 -178.255 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.861 ' N ' ' O ' ' A' ' 67' ' ' GLY . 59.1 m -162.66 153.76 17.45 Favored 'General case' 0 C--O 1.232 0.138 0 CA-C-N 115.603 -0.726 . . . . 20.0 109.117 179.118 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.526 ' O ' ' N ' ' A' ' 122' ' ' LEU . 95.5 mtt180 -150.29 150.01 30.92 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.213 0.53 . . . . 20.0 112.335 -179.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.633 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -90.21 161.52 15.68 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 115.445 -0.798 . . . . 20.0 110.105 178.496 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -146.18 35.17 0.99 Allowed 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 114.276 1.213 . . . . 20.0 114.276 -179.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.985 ' HB2' HG11 ' A' ' 119' ' ' VAL . 0.9 OUTLIER -80.19 157.75 72.89 Favored Pre-proline 0 C--N 1.327 -0.387 0 C-N-CA 120.632 -0.427 . . . . 20.0 109.989 178.736 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.408 ' HD2' ' HG3' ' A' ' 73' ' ' LYS . 28.7 Cg_endo -61.92 116.27 3.35 Favored 'Trans proline' 0 C--N 1.345 0.364 0 C-N-CA 122.479 2.12 . . . . 20.0 112.513 -179.363 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.904 HG21 ' O ' ' A' ' 62' ' ' ARG . 8.3 m -133.71 154.44 38.51 Favored 'Isoleucine or valine' 0 C--O 1.23 0.037 0 CA-C-O 120.857 0.36 . . . . 20.0 111.675 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 45.4 m -117.93 121.49 40.83 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.96 -0.563 . . . . 20.0 109.98 178.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.661 ' C ' HD12 ' A' ' 78' ' ' LEU . 81.0 tt0 -123.92 141.52 51.97 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.962 0.41 . . . . 20.0 111.814 -179.742 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 1.02 HD13 ' O ' ' A' ' 137' ' ' VAL . 1.5 mp -117.57 125.68 51.23 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.864 -0.607 . . . . 20.0 110.965 179.297 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.814 ' H ' HD23 ' A' ' 58' ' ' LEU . 18.5 m -95.13 86.56 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-N 115.779 -0.646 . . . . 20.0 110.746 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.444 ' HB3' ' SG ' ' A' ' 109' ' ' CYS . 0.0 OUTLIER -90.11 101.89 14.61 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.907 0.384 . . . . 20.0 110.698 179.962 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 9.5 t -143.57 106.06 4.44 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.097 -0.502 . . . . 20.0 110.379 179.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.566 ' HA3' ' CB ' ' A' ' 54' ' ' SER . . . -164.6 -153.67 7.56 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.682 -0.771 . . . . 20.0 112.355 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.472 ' HA ' ' HA ' ' A' ' 108' ' ' ARG . 91.0 mt-30 -129.14 151.51 49.74 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.819 0.343 . . . . 20.0 110.948 179.659 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.41 ' SG ' ' O ' ' A' ' 142' ' ' CYS . 81.4 m -108.56 159.71 16.5 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.189 -0.46 . . . . 20.0 110.328 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -121.01 63.91 0.49 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.596 -0.812 . . . . 20.0 112.272 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -70.97 167.69 25.27 Favored 'Trans proline' 0 N--CA 1.462 -0.363 0 C-N-CA 122.731 2.287 . . . . 20.0 111.853 179.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -74.89 3.75 7.66 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.295 -0.411 . . . . 20.0 111.179 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.5 mmm180 -58.57 135.63 57.38 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.068 0.461 . . . . 20.0 110.677 -179.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.583 HD22 ' N ' ' A' ' 89' ' ' LEU . 1.3 mm? -98.83 135.89 39.64 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.797 -0.638 . . . . 20.0 110.465 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.954 HD13 ' HD2' ' A' ' 91' ' ' PRO . 0.2 OUTLIER -97.07 148.96 35.16 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-N 116.245 -0.434 . . . . 20.0 111.173 -179.442 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.954 ' HD2' HD13 ' A' ' 90' ' ' LEU . 9.3 Cg_endo -51.42 104.61 0.09 OUTLIER 'Trans proline' 0 N--CA 1.465 -0.194 0 C-N-CA 122.764 2.309 . . . . 20.0 111.251 178.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.572 ' O ' ' CH2' ' A' ' 99' ' ' TRP . 80.2 m-20 -107.72 139.68 41.93 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.071 0.462 . . . . 20.0 111.943 -179.205 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.691 ' HA ' HG22 ' A' ' 97' ' ' VAL . . . -61.81 -29.5 70.2 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 115.703 -0.681 . . . . 20.0 111.581 179.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.792 HG22 ' O ' ' A' ' 94' ' ' ILE . 5.1 mt 31.46 35.45 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-O 121.485 0.659 . . . . 20.0 111.497 179.23 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.513 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 108.89 -52.98 0.61 Allowed Glycine 0 CA--C 1.52 0.347 0 CA-C-N 115.122 -0.945 . . . . 20.0 113.111 179.41 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.515 ' O ' ' CZ2' ' A' ' 99' ' ' TRP . 58.1 mtp180 -118.61 143.14 47.0 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 110.422 -0.214 . . . . 20.0 110.422 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 1.11 HG13 ' CZ3' ' A' ' 100' ' ' TRP . 12.8 t -129.16 132.82 66.72 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 CA-C-O 121.974 0.892 . . . . 20.0 112.197 179.219 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.465 ' HG2' ' C ' ' A' ' 97' ' ' VAL . 1.2 ptpt 161.82 -32.77 0.0 OUTLIER 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 113.944 -1.48 . . . . 20.0 108.468 -179.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.73 ' HH2' HD12 ' A' ' 94' ' ' ILE . 34.7 p-90 -92.06 24.93 3.05 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 113.146 -1.843 . . . . 20.0 110.396 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' TRP . . . . . 1.11 ' CZ3' HG13 ' A' ' 97' ' ' VAL . 0.0 OUTLIER -30.3 143.32 0.01 OUTLIER 'General case' 0 CA--C 1.499 -1.007 0 CA-C-O 121.858 0.837 . . . . 20.0 112.925 -177.881 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.441 ' O ' ' HD3' ' A' ' 91' ' ' PRO . 65.1 mtp180 -111.77 74.47 1.29 Allowed Pre-proline 0 N--CA 1.433 -1.285 0 CA-C-N 114.156 -1.384 . . . . 20.0 109.961 179.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -64.61 46.44 0.15 Allowed 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 123.436 2.757 . . . . 20.0 113.408 -179.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -52.96 -26.11 14.13 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.919 0.39 . . . . 20.0 110.324 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . 0.551 ' O ' ' CD2' ' A' ' 90' ' ' LEU . . . 130.24 146.56 5.99 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.897 -0.668 . . . . 20.0 112.868 179.257 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.83 ' HA ' HD21 ' A' ' 90' ' ' LEU . 56.6 Cg_endo -81.08 170.3 15.26 Favored 'Trans proline' 0 N--CA 1.463 -0.268 0 C-N-CA 123.232 2.622 . . . . 20.0 113.127 -179.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -59.84 153.45 20.78 Favored 'General case' 0 C--N 1.334 -0.109 0 CA-C-N 116.094 -0.503 . . . . 20.0 110.569 179.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.467 ' HA ' ' O ' ' A' ' 144' ' ' ARG . 91.5 m-85 -100.56 129.83 46.55 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.029 0.442 . . . . 20.0 111.369 -179.367 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.472 ' HA ' ' HA ' ' A' ' 83' ' ' GLN . 88.4 mtt180 -74.97 156.99 35.71 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.791 -0.64 . . . . 20.0 111.468 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 142' ' ' CYS . 4.7 t -74.35 100.44 3.77 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 109.27 -0.641 . . . . 20.0 109.27 178.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.658 HG23 ' HD2' ' A' ' 111' ' ' PRO . 25.4 mm -114.58 139.74 24.39 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-O 121.088 0.471 . . . . 20.0 111.713 -179.052 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 1.047 ' CB ' HG11 ' A' ' 137' ' ' VAL . 12.1 Cg_endo -55.79 143.3 81.4 Favored 'Trans proline' 0 C--O 1.231 0.138 0 C-N-CA 123.131 2.554 . . . . 20.0 112.285 179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -107.83 -61.63 1.55 Allowed 'General case' 0 C--N 1.333 -0.144 0 N-CA-C 112.327 0.491 . . . . 20.0 112.327 -179.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.447 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 42.3 ttm180 -121.69 147.87 45.32 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.033 0.444 . . . . 20.0 112.002 -178.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 1.019 ' CE2' HG13 ' A' ' 137' ' ' VAL . 0.1 OUTLIER -125.76 158.72 34.19 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.822 -0.626 . . . . 20.0 111.3 179.844 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 62.0 ttm-85 -93.51 142.53 27.24 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.661 -0.866 . . . . 20.0 108.661 178.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -80.78 132.81 35.55 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-O 121.138 0.494 . . . . 20.0 111.771 -178.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.83 ' HB2' HG23 ' A' ' 134' ' ' VAL . 92.1 mm-40 -129.62 144.32 51.22 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.457 -0.792 . . . . 20.0 109.967 179.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 48.7 ttp180 -139.65 91.08 2.45 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.507 -0.315 . . . . 20.0 110.7 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.985 HG11 ' HB2' ' A' ' 73' ' ' LYS . 0.6 OUTLIER -125.57 164.37 25.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 116.387 -0.37 . . . . 20.0 110.885 -179.869 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.553 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 14.0 pt20 -106.22 138.37 42.51 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.155 0.503 . . . . 20.0 111.137 -179.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.832 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -79.43 126.91 31.45 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.573 -0.739 . . . . 20.0 111.443 -179.787 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.526 ' N ' ' O ' ' A' ' 70' ' ' ARG . 0.3 OUTLIER -76.2 144.53 40.41 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.236 -0.893 . . . . 20.0 109.773 179.29 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . 0.576 ' HB2' ' O ' ' A' ' 126' ' ' GLY . 3.0 m -104.96 107.96 60.03 Favored Pre-proline 0 C--N 1.324 -0.505 0 CA-C-N 116.104 -0.498 . . . . 20.0 110.113 -178.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.473 ' HD2' ' HA ' ' A' ' 69' ' ' CYS . 37.7 Cg_endo -66.01 103.06 0.58 Allowed 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 122.08 1.853 . . . . 20.0 111.912 -179.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 87.87 18.15 56.74 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.631 -0.795 . . . . 20.0 111.496 -179.398 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . 0.576 ' O ' ' HB2' ' A' ' 123' ' ' CYS . . . -152.99 123.63 1.47 Allowed Glycine 0 N--CA 1.442 -0.919 0 N-CA-C 110.407 -1.077 . . . . 20.0 110.407 179.781 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -88.26 44.53 1.21 Allowed 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 112.382 0.512 . . . . 20.0 112.382 -178.418 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -120.44 66.28 12.38 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-O 121.096 0.474 . . . . 20.0 110.393 179.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_endo -52.05 148.88 22.57 Favored 'Trans proline' 0 N--CA 1.464 -0.218 0 C-N-CA 123.101 2.534 . . . . 20.0 112.635 -179.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.832 ' HB2' HD12 ' A' ' 121' ' ' LEU . 56.7 mtp85 -125.75 151.55 46.54 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.039 -0.528 . . . . 20.0 110.496 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.44 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 47.5 t -102.72 135.88 43.57 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.682 0.277 . . . . 20.0 110.392 179.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 25.7 tpt180 -144.72 144.82 31.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.169 0.509 . . . . 20.0 111.745 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 18.2 pttp -99.19 143.7 29.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.473 -0.785 . . . . 20.0 109.664 178.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.931 HG11 ' O ' ' A' ' 63' ' ' PHE . 3.1 m -146.33 130.0 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 CA-C-O 121.349 0.595 . . . . 20.0 111.252 -179.599 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.825 ' C ' HD22 ' A' ' 136' ' ' LEU . 83.2 mtt-85 -92.79 127.79 38.42 Favored 'General case' 0 C--N 1.313 -0.998 0 CA-C-N 115.128 -0.942 . . . . 20.0 110.207 179.424 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.825 HD22 ' C ' ' A' ' 135' ' ' ARG . 0.8 OUTLIER -117.6 114.38 23.33 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.005 0.372 . . . . 20.0 112.005 -178.871 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 1.047 HG11 ' CB ' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -59.74 76.51 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 120.798 0.333 . . . . 20.0 110.349 178.832 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.538 ' N ' ' O ' ' A' ' 136' ' ' LEU . . . -66.47 -10.46 44.55 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.196 -0.456 . . . . 20.0 110.832 -179.64 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 51.6 p -161.04 120.82 2.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.882 -0.599 . . . . 20.0 110.108 179.28 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' CYS . . . . . 0.528 ' HB2' ' HA ' ' A' ' 111' ' ' PRO . 26.7 p -139.44 155.06 47.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.283 0.563 . . . . 20.0 111.728 -179.688 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.472 ' HG2' HG11 ' A' ' 50' ' ' VAL . 22.1 mttt -125.77 157.12 38.27 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.091 -0.959 . . . . 20.0 108.778 178.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . 0.553 ' O ' ' SG ' ' A' ' 142' ' ' CYS . 0.1 OUTLIER -76.35 101.88 5.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.944 0.878 . . . . 20.0 111.42 -179.099 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.433 ' C ' ' HG2' ' A' ' 144' ' ' ARG . 44.7 mmtm -146.61 149.55 33.75 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.167 -0.924 . . . . 20.0 110.665 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.511 ' HD2' ' N ' ' A' ' 144' ' ' ARG . 14.9 mmm180 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.224 -0.894 . . . . 20.0 111.423 179.016 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 24.7 mttm . . . . . 0 N--CA 1.489 1.494 0 CA-C-O 120.7 0.286 . . . . 20.0 111.231 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.459 ' HB2' ' OE1' ' A' ' 52' ' ' GLU . 51.7 p30 -89.11 16.25 7.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.245 -0.434 . . . . 20.0 111.4 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.464 ' O ' ' CZ ' ' A' ' 53' ' ' TYR . 84.7 t -70.11 -37.83 73.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.339 -0.391 . . . . 20.0 111.639 -179.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 60.4 p -83.88 5.08 26.64 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.274 -0.421 . . . . 20.0 110.972 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.593 ' HG2' ' CD1' ' A' ' 53' ' ' TYR . 15.7 pt-20 -67.65 -25.97 65.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.329 -0.396 . . . . 20.0 112.052 -178.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.593 ' CD1' ' HG2' ' A' ' 52' ' ' GLU . 0.1 OUTLIER -97.97 -84.21 0.39 Allowed 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.134 0.492 . . . . 20.0 111.18 179.853 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.554 ' HB3' ' CB ' ' A' ' 109' ' ' CYS . 0.3 OUTLIER -147.14 -165.01 2.13 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.667 -0.697 . . . . 20.0 110.297 -179.962 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 42.2 m 65.18 44.04 3.43 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.081 0.467 . . . . 20.0 110.398 179.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.735 ' N ' HD12 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -137.15 145.58 43.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.548 -0.751 . . . . 20.0 111.051 179.901 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.467 ' C ' ' O ' ' A' ' 56' ' ' ARG . 58.9 mm-40 31.02 36.32 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 121.335 0.588 . . . . 20.0 110.702 -179.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.951 ' O ' HD22 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -115.95 122.14 44.4 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.166 -0.925 . . . . 20.0 110.903 -179.792 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.42 ' CD2' ' O ' ' A' ' 58' ' ' LEU . 0.5 OUTLIER -152.64 127.85 9.81 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.19 -0.459 . . . . 20.0 110.706 179.838 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.74 ' CD1' HG13 ' A' ' 79' ' ' VAL . 12.7 m-85 -127.58 149.02 50.35 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.201 -0.454 . . . . 20.0 112.002 -179.078 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 57.8 p -107.95 90.46 3.3 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 115.802 -0.636 . . . . 20.0 111.518 -179.446 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.945 ' O ' HG21 ' A' ' 75' ' ' VAL . 40.7 mmt180 -120.52 125.03 46.83 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.524 -0.917 . . . . 20.0 108.524 178.079 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.575 ' CD1' ' O ' ' A' ' 73' ' ' LYS . 0.0 OUTLIER -112.88 -82.88 0.59 Allowed 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.729 0.64 . . . . 20.0 112.729 -178.185 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.625 ' CD1' ' CB ' ' A' ' 71' ' ' SER . 0.0 OUTLIER -168.84 141.83 2.84 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.475 -0.49 . . . . 20.0 112.136 -178.201 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.683 HG22 ' HG3' ' A' ' 70' ' ' ARG . 81.1 p -134.98 134.61 40.7 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.265 -0.425 . . . . 20.0 110.681 178.515 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.73 ' HB2' HD13 ' A' ' 121' ' ' LEU . 92.1 m-20 -141.32 -165.52 1.99 Allowed 'General case' 0 C--O 1.237 0.426 0 N-CA-C 109.7 -0.481 . . . . 20.0 109.7 179.411 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.786 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -30.32 143.98 0.01 OUTLIER Glycine 0 C--N 1.345 1.055 0 N-CA-C 110.243 -1.143 . . . . 20.0 110.243 179.334 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.505 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 14.1 Cg_exo -16.07 58.73 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.672 0 C-N-CA 125.193 3.929 . . . . 20.0 115.412 -178.077 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.786 ' N ' ' O ' ' A' ' 67' ' ' GLY . 59.8 m -164.11 158.86 19.74 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 108.168 -1.049 . . . . 20.0 108.168 178.201 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.683 ' HG3' HG22 ' A' ' 65' ' ' THR . 49.4 ttp180 -150.81 143.16 24.26 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 112.93 0.715 . . . . 20.0 112.93 -179.312 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.625 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -84.28 160.77 20.67 Favored 'General case' 0 CA--C 1.514 -0.431 0 CA-C-N 115.202 -0.908 . . . . 20.0 110.36 178.554 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -147.51 28.05 0.99 Allowed 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 113.47 0.915 . . . . 20.0 113.47 -179.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 1.048 ' HB2' HG11 ' A' ' 119' ' ' VAL . 1.0 OUTLIER -72.95 155.8 90.22 Favored Pre-proline 0 C--N 1.324 -0.509 0 C-N-CA 120.548 -0.461 . . . . 20.0 110.09 179.268 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -61.3 119.45 6.6 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.352 2.035 . . . . 20.0 111.97 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.945 HG21 ' O ' ' A' ' 62' ' ' ARG . 11.1 m -135.71 147.01 28.75 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 CA-C-N 116.422 -0.354 . . . . 20.0 111.191 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 41.2 m -113.79 123.95 51.07 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.021 0.438 . . . . 20.0 110.294 178.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.613 ' C ' HD12 ' A' ' 78' ' ' LEU . 40.0 tp10 -128.67 138.36 52.12 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.713 -0.676 . . . . 20.0 110.401 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.887 HD13 ' O ' ' A' ' 137' ' ' VAL . 1.4 mp -115.39 134.21 55.31 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.43 -0.35 . . . . 20.0 110.56 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.844 ' H ' HD23 ' A' ' 58' ' ' LEU . 15.1 m -97.58 86.56 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 CA-C-O 121.005 0.431 . . . . 20.0 111.335 -179.777 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.534 ' O ' ' HD3' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -100.98 111.94 24.26 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.063 -0.517 . . . . 20.0 110.358 179.389 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 7.1 t -145.17 109.03 4.73 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.102 0.408 . . . . 20.0 112.102 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.499 ' O ' ' HA ' ' A' ' 144' ' ' ARG . . . -174.99 -179.88 45.85 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 120.545 -0.836 . . . . 20.0 113.381 179.129 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.688 ' HA ' ' HA ' ' A' ' 144' ' ' ARG . 59.4 tt0 -109.08 144.79 36.64 Favored 'General case' 0 CA--C 1.528 0.103 0 C-N-CA 123.011 0.524 . . . . 20.0 110.616 179.261 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.482 ' SG ' ' C ' ' A' ' 142' ' ' CYS . 95.4 m -106.39 128.45 54.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.019 0.438 . . . . 20.0 110.133 179.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . 0.632 ' N ' ' CD ' ' A' ' 86' ' ' PRO . . . 69.99 35.32 71.7 Favored Glycine 0 N--CA 1.45 -0.414 0 C-N-CA 120.863 -0.684 . . . . 20.0 112.059 -178.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . 0.632 ' CD ' ' N ' ' A' ' 85' ' ' GLY . 90.9 Cg_endo -76.9 135.33 15.58 Favored 'Trans proline' 0 C--N 1.347 0.495 0 C-N-CA 122.721 2.281 . . . . 20.0 112.395 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.629 ' O ' HD22 ' A' ' 89' ' ' LEU . . . -109.32 -25.0 10.8 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.202 -0.454 . . . . 20.0 110.644 179.185 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.403 ' C ' HD13 ' A' ' 89' ' ' LEU . 20.4 tpt180 -85.08 97.54 9.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.819 -0.628 . . . . 20.0 110.529 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.629 HD22 ' O ' ' A' ' 87' ' ' ALA . 0.3 OUTLIER -96.42 118.14 32.34 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.89 -0.595 . . . . 20.0 110.052 179.888 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 5.4 mt -113.0 117.3 46.25 Favored Pre-proline 0 CA--C 1.533 0.315 0 N-CA-C 112.331 0.493 . . . . 20.0 112.331 -178.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.609 ' CG ' ' CD1' ' A' ' 100' ' ' TRP . 25.7 Cg_endo -62.03 136.63 62.1 Favored 'Trans proline' 0 C--N 1.345 0.378 0 C-N-CA 122.742 2.295 . . . . 20.0 111.1 178.481 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.599 ' O ' ' CH2' ' A' ' 99' ' ' TRP . 26.3 m120 -100.65 148.23 25.08 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 113.279 0.844 . . . . 20.0 113.279 -178.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.704 ' HA ' ' CZ3' ' A' ' 100' ' ' TRP . . . -84.06 -18.39 37.15 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.073 -0.967 . . . . 20.0 112.315 179.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 1.118 HD12 ' CH2' ' A' ' 99' ' ' TRP . 22.4 mt 27.68 35.19 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.306 0 CA-C-O 121.225 0.536 . . . . 20.0 111.565 179.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.601 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 96.99 -50.72 1.49 Allowed Glycine 0 CA--C 1.521 0.445 0 CA-C-N 115.714 -0.676 . . . . 20.0 112.829 -179.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.598 ' O ' ' CZ2' ' A' ' 99' ' ' TRP . 42.9 mmt180 -114.13 142.92 45.61 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.6 0.2 . . . . 20.0 110.465 179.558 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.987 HG13 ' CZ3' ' A' ' 100' ' ' TRP . 10.9 t -122.05 134.18 66.12 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.78 0 CA-C-O 121.829 0.823 . . . . 20.0 111.924 179.509 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.437 ' HG2' ' C ' ' A' ' 97' ' ' VAL . 0.4 OUTLIER 162.91 -30.4 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.039 0 CA-C-N 114.003 -1.453 . . . . 20.0 108.877 -179.481 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 1.118 ' CH2' HD12 ' A' ' 94' ' ' ILE . 25.0 p-90 -96.76 28.8 3.27 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 113.482 -1.69 . . . . 20.0 110.243 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' TRP . . . . . 0.987 ' CZ3' HG13 ' A' ' 97' ' ' VAL . 0.0 OUTLIER -34.52 136.0 0.16 Allowed 'General case' 0 CA--C 1.501 -0.916 0 CA-C-O 121.978 0.894 . . . . 20.0 112.883 -177.213 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -122.56 82.55 47.59 Favored Pre-proline 0 N--CA 1.437 -1.111 0 CA-C-N 113.871 -1.513 . . . . 20.0 110.616 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.557 ' O ' ' CB ' ' A' ' 89' ' ' LEU . 24.3 Cg_exo -62.62 -6.56 9.12 Favored 'Trans proline' 0 N--CA 1.461 -0.395 0 C-N-CA 122.606 2.204 . . . . 20.0 112.071 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.448 ' C ' ' HB3' ' A' ' 89' ' ' LEU . 21.1 t-20 -59.68 -34.15 72.49 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.888 0.375 . . . . 20.0 110.304 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 102.95 153.18 24.23 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.894 -0.67 . . . . 20.0 112.991 179.543 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -61.92 168.53 8.71 Favored 'Trans proline' 0 C--O 1.233 0.259 0 C-N-CA 123.243 2.628 . . . . 20.0 112.016 179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -63.94 97.91 0.19 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.944 0.402 . . . . 20.0 110.918 -179.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.631 ' O ' ' CB ' ' A' ' 108' ' ' ARG . 13.2 m-85 -112.85 138.07 50.25 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.932 -0.576 . . . . 20.0 111.6 -179.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.631 ' CB ' ' O ' ' A' ' 107' ' ' PHE . 42.0 ttm180 112.22 67.18 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.354 0 O-C-N 124.112 0.882 . . . . 20.0 111.316 179.084 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.554 ' CB ' ' HB3' ' A' ' 54' ' ' SER . 0.5 OUTLIER 170.94 110.51 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.442 -0.344 . . . . 20.0 111.439 179.613 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.544 ' CG2' ' HB2' ' A' ' 143' ' ' LYS . 0.1 OUTLIER -147.83 141.61 15.8 Favored Pre-proline 0 CA--C 1.531 0.237 0 CA-C-O 120.888 0.375 . . . . 20.0 110.686 179.189 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.776 ' CB ' HG11 ' A' ' 137' ' ' VAL . 13.4 Cg_endo -55.44 138.99 81.66 Favored 'Trans proline' 0 N--CA 1.466 -0.137 0 C-N-CA 122.93 2.42 . . . . 20.0 111.896 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.476 ' OD2' ' HB3' ' A' ' 141' ' ' LYS . 83.4 m-20 -125.59 -56.1 1.51 Allowed 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.935 -0.306 . . . . 20.0 111.668 -179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.536 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 38.9 ttm180 -118.07 151.95 36.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.734 0.302 . . . . 20.0 111.493 -179.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.919 ' CE2' HG13 ' A' ' 137' ' ' VAL . 2.5 m-85 -127.82 164.18 22.76 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-O 121.611 0.72 . . . . 20.0 111.699 179.697 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.417 ' N ' ' O ' ' A' ' 136' ' ' LEU . 49.0 ttm-85 -99.21 145.27 27.42 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 114.732 -1.122 . . . . 20.0 108.078 177.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -90.59 115.11 27.47 Favored 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 120.164 -0.614 . . . . 20.0 111.187 -179.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -132.22 137.3 47.51 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.068 -0.514 . . . . 20.0 111.352 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.499 ' HG2' ' HA ' ' A' ' 133' ' ' LYS . 87.6 mtt-85 -127.94 111.9 14.09 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 115.686 -0.688 . . . . 20.0 109.946 179.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 1.048 HG11 ' HB2' ' A' ' 73' ' ' LYS . 38.8 t -127.46 146.23 33.57 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 CA-C-N 116.188 -0.46 . . . . 20.0 111.89 -178.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.579 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 28.3 mp0 -78.15 131.34 37.17 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 116.208 -0.451 . . . . 20.0 111.13 -179.799 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.905 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.3 OUTLIER -79.3 122.13 25.96 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 20.0 109.984 179.569 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.75 136.71 34.06 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.383 0.611 . . . . 20.0 111.851 -178.421 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . 0.533 ' SG ' ' HD2' ' A' ' 124' ' ' PRO . 0.1 OUTLIER -111.39 158.52 35.98 Favored Pre-proline 0 C--N 1.325 -0.497 0 CA-C-N 115.359 -0.837 . . . . 20.0 109.986 179.289 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.533 ' HD2' ' SG ' ' A' ' 123' ' ' CYS . 51.3 Cg_exo -52.23 110.71 0.48 Allowed 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 121.942 1.761 . . . . 20.0 111.347 -179.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 98.7 -13.17 62.66 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 120.941 -0.647 . . . . 20.0 111.732 -179.003 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 66.03 56.4 14.44 Favored Glycine 0 C--N 1.333 0.397 0 C-N-CA 120.987 -0.625 . . . . 20.0 112.912 179.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -120.12 -23.47 6.29 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.399 0.518 . . . . 20.0 112.399 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -121.29 57.08 6.42 Favored Pre-proline 0 C--N 1.33 -0.254 0 N-CA-C 112.269 0.47 . . . . 20.0 112.269 -179.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . 0.499 ' HA ' ' O ' ' A' ' 121' ' ' LEU . 37.7 Cg_endo -67.4 141.46 56.24 Favored 'Trans proline' 0 CA--C 1.528 0.221 0 C-N-CA 122.512 2.141 . . . . 20.0 111.722 178.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.905 ' HB2' HD12 ' A' ' 121' ' ' LEU . 84.5 mtt180 -139.64 136.47 34.36 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 121.019 -0.272 . . . . 20.0 111.511 -179.578 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 28.1 t -88.1 133.75 33.92 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.85 0.357 . . . . 20.0 111.43 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . 0.495 ' HD3' ' HB2' ' A' ' 64' ' ' LEU . 58.1 ttt85 -139.94 138.08 35.29 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 116.119 -0.491 . . . . 20.0 111.783 -179.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.499 ' HA ' ' HG2' ' A' ' 118' ' ' ARG . 12.0 pttt -87.08 142.94 27.55 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.103 -0.498 . . . . 20.0 110.122 179.015 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.611 HG12 ' CD2' ' A' ' 136' ' ' LEU . 15.6 t -142.58 126.03 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.687 0 CA-C-O 121.284 0.564 . . . . 20.0 111.477 -179.611 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.48 ' O ' ' CD2' ' A' ' 114' ' ' TYR . 99.7 mtt180 -95.13 99.07 11.11 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.152 -0.931 . . . . 20.0 109.265 178.148 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.611 ' CD2' HG12 ' A' ' 134' ' ' VAL . 5.3 mt -104.78 133.85 48.91 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.461 0.648 . . . . 20.0 112.502 -179.335 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.919 HG13 ' CE2' ' A' ' 114' ' ' TYR . 0.3 OUTLIER -68.93 89.34 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 CA-C-N 115.286 -0.87 . . . . 20.0 112.106 -179.587 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -72.32 -12.6 61.21 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.333 0.587 . . . . 20.0 109.481 178.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 5.6 t -161.31 129.88 4.45 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 115.246 -0.888 . . . . 20.0 110.303 179.048 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' CYS . . . . . 0.54 ' HB3' ' HA ' ' A' ' 111' ' ' PRO . 26.0 p -126.42 159.99 31.74 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.789 0.328 . . . . 20.0 110.968 179.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.476 ' HB3' ' OD2' ' A' ' 112' ' ' ASP . 12.4 ttpt -123.55 158.95 30.22 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.305 -0.407 . . . . 20.0 110.651 -179.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . 0.537 ' O ' ' HD3' ' A' ' 143' ' ' LYS . 0.0 OUTLIER -55.78 109.23 0.54 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.981 0.419 . . . . 20.0 110.729 -179.263 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.544 ' HB2' ' CG2' ' A' ' 110' ' ' ILE . 25.8 mmtt -139.42 144.64 38.19 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.474 -0.785 . . . . 20.0 110.659 178.363 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.688 ' HA ' ' HA ' ' A' ' 83' ' ' GLN . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.045 -0.979 . . . . 20.0 111.042 -179.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.444 ' O ' ' HG2' ' A' ' 48' ' ' LYS . 81.6 tttt . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.915 0.388 . . . . 20.0 111.025 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 89.7 m-20 -86.74 17.09 4.19 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.033 -0.53 . . . . 20.0 111.831 -179.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 34.7 m -81.1 -13.78 12.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 121.126 0.488 . . . . 20.0 110.299 178.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 88.2 p -81.92 -8.94 59.71 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.4 -0.818 . . . . 20.0 110.891 179.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.477 ' OE1' ' OE1' ' A' ' 83' ' ' GLN . 78.9 mt-10 -88.1 3.25 49.79 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.259 -0.428 . . . . 20.0 110.934 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.564 ' CD2' ' SG ' ' A' ' 142' ' ' CYS . 3.5 m-85 -85.92 25.73 1.08 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.101 -0.5 . . . . 20.0 111.353 -179.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.434 ' C ' ' SG ' ' A' ' 55' ' ' CYS . 34.7 t -60.27 108.33 0.78 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.103 0.478 . . . . 20.0 111.145 -179.058 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.434 ' SG ' ' C ' ' A' ' 54' ' ' SER . 3.5 m -159.44 26.04 0.19 Allowed 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.573 -0.74 . . . . 20.0 110.265 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.485 ' O ' ' N ' ' A' ' 58' ' ' LEU . 0.0 OUTLIER -57.46 155.18 9.74 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.058 -0.519 . . . . 20.0 111.623 -179.46 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.802 ' HA ' HD23 ' A' ' 78' ' ' LEU . 85.4 tt0 -52.04 85.44 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.152 0 CA-C-N 115.896 -0.593 . . . . 20.0 111.08 -179.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.923 HD13 ' CG2' ' A' ' 79' ' ' VAL . 8.3 tt -96.42 151.46 19.54 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.017 -0.538 . . . . 20.0 110.934 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.603 ' CG ' HG22 ' A' ' 76' ' ' THR . 30.0 m170 -128.02 133.24 49.1 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 112.022 0.379 . . . . 20.0 112.022 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.655 ' CZ ' HG12 ' A' ' 79' ' ' VAL . 0.2 OUTLIER -153.55 168.67 25.38 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 116.24 -0.436 . . . . 20.0 111.198 179.514 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.627 ' CG2' ' CZ ' ' A' ' 63' ' ' PHE . 32.3 m -93.8 126.58 39.07 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 121.87 0.843 . . . . 20.0 112.912 -178.434 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.862 ' O ' HG21 ' A' ' 75' ' ' VAL . 40.7 mtm180 -169.43 121.01 0.72 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.21 -1.359 . . . . 20.0 108.038 177.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.627 ' CZ ' ' CG2' ' A' ' 61' ' ' THR . 0.0 OUTLIER -120.28 -81.04 0.63 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 113.027 0.751 . . . . 20.0 113.027 -178.047 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.913 HD21 ' HB ' ' A' ' 119' ' ' VAL . 0.0 OUTLIER -166.58 139.68 3.85 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.169 0.433 . . . . 20.0 112.169 -177.756 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.466 ' O ' ' OD1' ' A' ' 66' ' ' ASP . 68.9 p -133.42 128.29 35.21 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.805 -0.634 . . . . 20.0 110.232 178.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.918 ' HB2' HD13 ' A' ' 121' ' ' LEU . 73.6 m-20 -139.42 -165.06 1.79 Allowed 'General case' 0 C--O 1.236 0.346 0 N-CA-C 110.011 -0.366 . . . . 20.0 110.011 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.833 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -29.59 144.61 0.01 OUTLIER Glycine 0 C--N 1.344 0.988 0 CA-C-O 118.798 -1.001 . . . . 20.0 110.733 179.47 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.504 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 39.0 Cg_exo -14.91 54.51 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.723 1 C-N-CA 125.949 4.433 . . . . 20.0 115.106 -178.756 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.833 ' N ' ' O ' ' A' ' 67' ' ' GLY . 17.1 m -163.27 157.67 20.55 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.138 -1.06 . . . . 20.0 108.138 178.677 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 98.1 mtt180 -145.98 146.92 31.19 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.091 0.472 . . . . 20.0 112.042 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.623 ' CB ' ' CD1' ' A' ' 64' ' ' LEU . 0.3 OUTLIER -89.23 160.72 16.79 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 115.512 -0.767 . . . . 20.0 109.955 178.861 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -149.87 28.49 0.76 Allowed 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 114.21 1.189 . . . . 20.0 114.21 -179.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.589 ' O ' ' CD2' ' A' ' 63' ' ' PHE . 17.3 tttt -73.72 140.48 78.18 Favored Pre-proline 0 C--N 1.328 -0.332 0 C-N-CA 120.551 -0.459 . . . . 20.0 110.164 178.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.531 ' HD2' ' HG2' ' A' ' 73' ' ' LYS . 63.9 Cg_exo -51.34 125.87 17.7 Favored 'Trans proline' 0 CA--C 1.531 0.333 0 C-N-CA 122.392 2.061 . . . . 20.0 112.419 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.862 HG21 ' O ' ' A' ' 62' ' ' ARG . 26.3 m -133.63 163.25 37.97 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.159 0 CA-C-O 121.123 0.487 . . . . 20.0 112.033 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.603 HG22 ' CG ' ' A' ' 59' ' ' HIS . 0.2 OUTLIER -136.76 100.37 4.3 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.635 -0.711 . . . . 20.0 109.916 178.944 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.598 ' CD ' HD12 ' A' ' 136' ' ' LEU . 83.5 mt-10 -114.43 162.98 15.96 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.1 -0.5 . . . . 20.0 111.568 -178.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.834 HD13 ' O ' ' A' ' 137' ' ' VAL . 5.6 mp -111.1 142.35 43.39 Favored 'General case' 0 CA--C 1.512 -0.498 0 CA-C-O 121.355 0.598 . . . . 20.0 111.302 179.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.923 ' CG2' HD13 ' A' ' 58' ' ' LEU . 7.7 m -103.26 84.81 0.87 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 115.294 -0.866 . . . . 20.0 110.718 -179.279 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -86.15 106.97 17.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.944 -0.571 . . . . 20.0 110.801 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 25.6 p -141.08 113.76 8.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.008 -0.542 . . . . 20.0 110.7 179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -169.77 -173.92 37.64 Favored Glycine 0 N--CA 1.45 -0.386 0 C-N-CA 120.382 -0.913 . . . . 20.0 112.756 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.522 ' HA ' ' HA ' ' A' ' 108' ' ' ARG . 62.6 tt0 -117.83 139.77 50.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.66 0.267 . . . . 20.0 110.415 179.047 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.495 ' O ' ' O ' ' A' ' 85' ' ' GLY . 38.6 m -120.59 154.38 35.49 Favored 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 120.938 0.399 . . . . 20.0 111.732 -179.205 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . 0.495 ' O ' ' O ' ' A' ' 84' ' ' CYS . . . 48.98 167.94 0.01 OUTLIER Glycine 0 C--N 1.332 0.358 0 CA-C-N 115.732 -0.667 . . . . 20.0 112.957 179.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_exo -62.25 162.5 23.19 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.801 2.334 . . . . 20.0 112.208 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -85.95 12.24 9.76 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.096 -0.502 . . . . 20.0 111.496 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 20.8 tpt180 -70.56 131.52 44.1 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.55 -0.295 . . . . 20.0 110.31 179.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.631 HD22 ' N ' ' A' ' 89' ' ' LEU . 1.1 mm? -100.0 122.7 43.3 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.531 -0.304 . . . . 20.0 110.859 -179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.426 ' HA ' ' HD2' ' A' ' 91' ' ' PRO . 5.6 tp -114.14 109.31 49.43 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-O 120.731 0.3 . . . . 20.0 111.408 179.661 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.521 ' HB2' ' CG ' ' A' ' 100' ' ' TRP . 18.6 Cg_endo -60.35 113.88 1.87 Allowed 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.765 2.31 . . . . 20.0 111.474 179.113 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -97.48 141.31 30.7 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.828 0.347 . . . . 20.0 111.872 -178.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.999 ' CB ' HG22 ' A' ' 97' ' ' VAL . . . -87.16 0.86 54.64 Favored 'General case' 0 CA--C 1.518 -0.259 0 CA-C-N 116.265 -0.425 . . . . 20.0 111.818 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.809 HD12 ' CH2' ' A' ' 99' ' ' TRP . 2.3 mp 34.69 31.63 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-O 121.516 0.674 . . . . 20.0 111.657 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.521 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 120.15 -49.76 0.86 Allowed Glycine 0 CA--C 1.524 0.62 0 CA-C-N 114.926 -1.034 . . . . 20.0 113.576 179.339 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.839 ' O ' ' HB1' ' A' ' 93' ' ' ALA . 31.6 ttp180 -116.12 150.46 37.34 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.742 0.271 . . . . 20.0 110.278 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 1.06 HG13 ' CZ3' ' A' ' 100' ' ' TRP . 2.2 t -123.93 116.96 49.52 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.355 0 CA-C-O 121.778 0.799 . . . . 20.0 111.943 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.613 ' HG3' ' HD1' ' A' ' 99' ' ' TRP . 0.5 OUTLIER 171.88 38.49 0.0 OUTLIER 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 114.368 -1.287 . . . . 20.0 108.772 -179.218 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.809 ' CH2' HD12 ' A' ' 94' ' ' ILE . 4.0 p-90 -178.63 52.12 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.142 -0.935 . . . . 20.0 109.328 -177.216 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' TRP . . . . . 1.06 ' CZ3' HG13 ' A' ' 97' ' ' VAL . 0.0 OUTLIER -53.92 138.26 37.02 Favored 'General case' 0 CA--C 1.498 -1.026 0 CA-C-O 122.494 1.14 . . . . 20.0 113.983 -176.82 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.403 ' C ' ' HB3' ' A' ' 91' ' ' PRO . 0.0 OUTLIER -122.47 83.22 47.16 Favored Pre-proline 0 N--CA 1.435 -1.184 0 CA-C-N 113.144 -1.844 . . . . 20.0 109.855 179.528 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.448 ' O ' ' CB ' ' A' ' 89' ' ' LEU . 13.2 Cg_endo -56.67 -10.52 5.38 Favored 'Trans proline' 0 CA--C 1.53 0.312 0 C-N-CA 123.293 2.662 . . . . 20.0 112.72 -179.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.434 ' C ' ' HB3' ' A' ' 89' ' ' LEU . 29.2 m120 -58.06 -34.26 69.91 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.303 -0.408 . . . . 20.0 111.726 -179.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 67.36 157.45 0.74 Allowed Glycine 0 N--CA 1.453 -0.208 0 C-N-CA 120.406 -0.902 . . . . 20.0 112.201 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.579 ' O ' ' CE2' ' A' ' 107' ' ' PHE . 10.0 Cg_exo -70.11 143.5 49.37 Favored 'Trans proline' 0 C--N 1.343 0.259 0 C-N-CA 122.701 2.267 . . . . 20.0 111.943 179.798 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -70.04 127.76 33.98 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.119 -0.326 . . . . 20.0 110.119 179.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.579 ' CE2' ' O ' ' A' ' 105' ' ' PRO . 55.8 m-85 -113.1 136.05 53.13 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.769 0.319 . . . . 20.0 111.543 -179.299 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.522 ' HA ' ' HA ' ' A' ' 83' ' ' GLN . 29.6 ptt-85 -173.12 175.45 3.2 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.35 -0.386 . . . . 20.0 110.957 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.484 ' HA ' ' HA ' ' A' ' 142' ' ' CYS . 46.5 t -70.02 112.21 6.25 Favored 'General case' 0 C--N 1.332 -0.165 0 N-CA-C 109.204 -0.665 . . . . 20.0 109.204 179.07 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.509 HD12 ' HB2' ' A' ' 144' ' ' ARG . 7.9 mt -109.49 138.39 20.55 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.115 0.483 . . . . 20.0 111.721 -178.615 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.923 ' HB3' HG11 ' A' ' 137' ' ' VAL . 20.3 Cg_endo -61.55 139.95 84.37 Favored 'Trans proline' 0 C--N 1.343 0.244 0 C-N-CA 123.071 2.514 . . . . 20.0 111.272 178.865 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 86.0 m-20 -100.11 -68.79 0.79 Allowed 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 112.552 0.575 . . . . 20.0 112.552 -179.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.427 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 60.9 ttm-85 -122.99 142.72 50.53 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.436 -0.347 . . . . 20.0 111.376 -179.017 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.886 ' CD2' HG13 ' A' ' 137' ' ' VAL . 0.7 OUTLIER -118.61 158.1 26.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.093 0.473 . . . . 20.0 111.296 -179.61 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 55.0 ttm-85 -97.29 141.63 30.16 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 108.807 -0.812 . . . . 20.0 108.807 178.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -77.66 128.15 33.62 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.878 0.37 . . . . 20.0 111.859 -178.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.837 ' HG2' HD23 ' A' ' 136' ' ' LEU . 89.6 mm-40 -126.99 137.15 53.05 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.117 -0.492 . . . . 20.0 111.233 179.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 63.0 ttt180 -133.94 94.23 3.23 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.971 -0.559 . . . . 20.0 110.451 179.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.913 ' HB ' HD21 ' A' ' 64' ' ' LEU . 29.1 t -123.81 147.64 28.15 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 CA-C-N 116.351 -0.386 . . . . 20.0 110.49 179.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.563 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 20.0 pt20 -94.37 133.87 37.47 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.42 -0.512 . . . . 20.0 110.71 -179.594 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.918 HD13 ' HB2' ' A' ' 66' ' ' ASP . 0.1 OUTLIER -77.33 118.65 20.02 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.421 0.629 . . . . 20.0 110.851 -179.717 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -79.16 140.86 37.66 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.002 -0.999 . . . . 20.0 111.124 -179.328 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . 0.504 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.3 OUTLIER -114.38 150.33 43.6 Favored Pre-proline 0 N--CA 1.446 -0.673 0 CA-C-N 115.619 -0.719 . . . . 20.0 109.578 179.128 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.467 ' HD2' ' SG ' ' A' ' 123' ' ' CYS . 59.4 Cg_exo -50.89 112.72 0.84 Allowed 'Trans proline' 0 N--CA 1.465 -0.2 0 C-N-CA 122.252 1.968 . . . . 20.0 112.147 -178.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 92.66 2.03 67.73 Favored Glycine 0 N--CA 1.449 -0.451 0 CA-C-N 115.547 -0.751 . . . . 20.0 111.736 -179.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 45.4 83.5 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 121.078 -0.582 . . . . 20.0 112.788 179.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.458 ' O ' ' HD2' ' A' ' 129' ' ' PRO . . . -116.63 -68.99 0.88 Allowed 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.87 0.335 . . . . 20.0 111.775 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -118.06 60.74 3.79 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-O 120.976 0.417 . . . . 20.0 111.892 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . 0.458 ' HD2' ' O ' ' A' ' 127' ' ' ALA . 3.3 Cg_endo -46.37 155.32 0.72 Allowed 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 123.059 2.506 . . . . 20.0 111.458 178.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.774 ' HB2' HD12 ' A' ' 121' ' ' LEU . 72.4 mtt85 -130.0 154.35 47.48 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.434 -0.348 . . . . 20.0 110.541 -179.991 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.534 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 29.7 m -107.19 140.81 39.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.719 0.295 . . . . 20.0 110.392 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . 0.5 ' HD3' ' CB ' ' A' ' 64' ' ' LEU . 56.6 ttt85 -141.92 142.64 33.04 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.162 0.506 . . . . 20.0 112.203 -179.353 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 7.5 pttt -93.3 143.95 25.78 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.492 -0.776 . . . . 20.0 109.076 178.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.454 ' O ' ' CD2' ' A' ' 136' ' ' LEU . 3.1 t -143.99 121.15 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.629 0 CA-C-O 121.164 0.507 . . . . 20.0 111.805 -178.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.598 ' C ' HD22 ' A' ' 136' ' ' LEU . 87.3 mtm-85 -92.26 112.66 24.69 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.321 -0.854 . . . . 20.0 109.289 178.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.837 HD23 ' HG2' ' A' ' 117' ' ' GLN . 1.6 mm? -113.98 123.78 50.54 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.337 0.589 . . . . 20.0 112.279 -178.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.923 HG11 ' HB3' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -57.5 84.39 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 115.411 -0.813 . . . . 20.0 111.672 179.895 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . 0.49 ' HA ' ' CD1' ' A' ' 78' ' ' LEU . . . -69.83 -16.12 63.22 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.408 -0.517 . . . . 20.0 109.818 178.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 23.0 t -153.83 117.67 4.73 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.748 -0.66 . . . . 20.0 110.511 178.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' CYS . . . . . . . . . . . . . 9.3 p -135.49 159.37 41.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.324 0.583 . . . . 20.0 112.281 -179.195 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -142.0 144.05 33.47 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.259 -0.882 . . . . 20.0 109.622 178.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . 0.564 ' SG ' ' CD2' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -69.96 95.41 0.93 Allowed 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.879 -0.328 . . . . 20.0 110.802 -179.886 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.511 ' O ' ' HB2' ' A' ' 144' ' ' ARG . 19.1 tptp -139.3 136.55 34.99 Favored 'General case' 0 N--CA 1.457 -0.122 0 CA-C-N 116.303 -0.408 . . . . 20.0 111.102 179.698 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.511 ' HB2' ' O ' ' A' ' 143' ' ' LYS . 51.1 mtp85 . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.229 -0.891 . . . . 20.0 110.794 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 19.3 mttt . . . . . 0 N--CA 1.486 1.374 0 CA-C-O 120.779 0.323 . . . . 20.0 110.895 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -84.58 14.93 4.1 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.16 -0.473 . . . . 20.0 111.495 -179.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.631 ' O ' HG12 ' A' ' 50' ' ' VAL . 52.9 t -74.85 -3.84 5.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.451 -0.341 . . . . 20.0 111.166 179.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 78.5 p -64.8 -22.66 67.03 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.132 0.491 . . . . 20.0 110.083 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.538 ' O ' ' HB ' ' A' ' 79' ' ' VAL . 95.4 mt-10 -90.54 10.65 24.63 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.555 -0.748 . . . . 20.0 110.263 178.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.758 ' CB ' ' HB2' ' A' ' 81' ' ' SER . 1.7 t80 -121.36 -36.17 3.13 Favored 'General case' 0 C--O 1.208 -1.108 0 N-CA-C 112.468 0.544 . . . . 20.0 112.468 -178.077 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.826 ' O ' HD11 ' A' ' 58' ' ' LEU . 11.4 m -33.14 114.74 0.18 Allowed 'General case' 0 N--CA 1.482 1.145 0 O-C-N 121.23 -0.919 . . . . 20.0 112.459 -179.039 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.55 ' N ' ' H ' ' A' ' 81' ' ' SER . 0.6 OUTLIER -76.69 97.87 4.58 Favored 'General case' 0 C--N 1.351 0.654 0 CA-C-O 121.155 0.502 . . . . 20.0 110.245 -179.824 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.814 ' HB2' HD13 ' A' ' 58' ' ' LEU . 0.0 OUTLIER -138.28 -151.55 0.39 Allowed 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 115.44 -0.8 . . . . 20.0 110.786 -179.24 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -86.5 15.86 5.12 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.248 -0.433 . . . . 20.0 111.007 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.826 HD11 ' O ' ' A' ' 54' ' ' SER . 0.0 OUTLIER -81.07 157.16 25.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 121.476 0.655 . . . . 20.0 112.542 -179.163 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.469 ' CD2' ' HG ' ' A' ' 78' ' ' LEU . 5.0 m170 -146.69 143.99 29.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.345 -0.843 . . . . 20.0 110.078 179.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.668 ' CZ ' HG11 ' A' ' 79' ' ' VAL . 17.8 m-30 -119.89 145.84 46.32 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.938 0.399 . . . . 20.0 111.355 -179.649 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 26.9 p -109.56 88.97 2.87 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.939 -0.573 . . . . 20.0 111.743 -179.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 1.063 ' O ' HG21 ' A' ' 75' ' ' VAL . 64.3 ttt-85 -119.94 122.37 41.07 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 108.445 -0.946 . . . . 20.0 108.445 177.847 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.695 ' O ' HD23 ' A' ' 64' ' ' LEU . 0.2 OUTLIER -105.22 -81.2 0.54 Allowed 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 112.779 0.659 . . . . 20.0 112.779 -177.538 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.695 HD23 ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -170.21 139.9 1.83 Allowed 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 120.566 -0.454 . . . . 20.0 111.828 -178.617 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.96 HG22 ' HG3' ' A' ' 70' ' ' ARG . 29.6 p -134.19 132.22 39.5 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.9 -0.591 . . . . 20.0 110.579 179.062 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.857 ' HB2' HD13 ' A' ' 121' ' ' LEU . 94.0 m-20 -141.98 -163.76 1.65 Allowed 'General case' 0 C--O 1.236 0.367 0 N-CA-C 109.946 -0.39 . . . . 20.0 109.946 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.812 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -28.47 144.41 0.01 OUTLIER Glycine 0 C--N 1.346 1.113 0 CA-C-O 118.736 -1.036 . . . . 20.0 110.633 179.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.551 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 50.1 Cg_exo -15.78 57.13 0.0 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.78 1 C-N-CA 125.373 4.049 . . . . 20.0 115.271 -178.53 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.812 ' N ' ' O ' ' A' ' 67' ' ' GLY . 81.5 m -164.98 164.16 20.67 Favored 'General case' 0 C--O 1.238 0.449 0 N-CA-C 108.625 -0.88 . . . . 20.0 108.625 178.4 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.96 ' HG3' HG22 ' A' ' 65' ' ' THR . 54.6 ttt180 -152.29 143.34 23.11 Favored 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 112.377 0.51 . . . . 20.0 112.377 -179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.984 ' HA ' HD12 ' A' ' 122' ' ' LEU . 0.0 OUTLIER -86.06 161.48 18.91 Favored 'General case' 0 CA--C 1.518 -0.277 0 CA-C-N 115.718 -0.674 . . . . 20.0 110.844 179.156 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . 0.548 ' HA ' ' CD2' ' A' ' 63' ' ' PHE . . . -140.64 29.29 1.94 Allowed 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 113.0 0.741 . . . . 20.0 113.0 -179.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.823 ' CB ' HG21 ' A' ' 119' ' ' VAL . 4.9 tmtm? -73.4 133.29 80.73 Favored Pre-proline 0 C--N 1.329 -0.316 0 C-N-CA 120.958 -0.297 . . . . 20.0 110.335 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . 0.474 ' HD2' ' HG2' ' A' ' 73' ' ' LYS . 50.7 Cg_exo -54.58 122.39 11.48 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.655 2.237 . . . . 20.0 112.356 -179.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 1.063 HG21 ' O ' ' A' ' 62' ' ' ARG . 5.1 m -135.54 159.57 40.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 115.852 -0.613 . . . . 20.0 111.167 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 38.8 m -118.57 128.78 54.88 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.083 0.468 . . . . 20.0 110.858 178.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.546 ' HB3' ' HB2' ' A' ' 60' ' ' TYR . 84.8 tt0 -131.54 139.2 49.19 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.642 -0.708 . . . . 20.0 110.031 179.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.833 ' N ' HD12 ' A' ' 78' ' ' LEU . 1.0 OUTLIER -111.37 144.32 40.75 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.307 0.575 . . . . 20.0 112.127 -179.05 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.706 HG22 ' CG ' ' A' ' 58' ' ' LEU . 0.7 OUTLIER -100.25 93.89 3.2 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 N-CA-C 108.252 -1.018 . . . . 20.0 108.252 178.612 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.647 ' C ' ' O ' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -95.59 118.59 32.58 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 113.814 1.042 . . . . 20.0 113.814 -176.312 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.893 ' N ' ' HB2' ' A' ' 109' ' ' CYS . 8.3 t -161.45 95.69 1.03 Allowed 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.384 -0.825 . . . . 20.0 111.314 177.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.508 ' N ' ' SG ' ' A' ' 55' ' ' CYS . . . -159.09 -154.83 7.39 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.786 -0.721 . . . . 20.0 112.108 -179.805 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -120.97 160.14 24.13 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.748 0.309 . . . . 20.0 110.659 179.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -136.29 -41.73 0.64 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.33 -0.395 . . . . 20.0 111.055 -179.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . -109.16 170.44 14.53 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.811 -0.709 . . . . 20.0 112.766 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_exo -50.8 151.5 10.98 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.839 2.359 . . . . 20.0 112.425 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.678 ' HB1' ' HG3' ' A' ' 105' ' ' PRO . . . -83.01 14.03 3.61 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.001 -0.545 . . . . 20.0 111.553 -179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -67.62 133.45 49.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.846 0.355 . . . . 20.0 110.646 -179.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.584 ' N ' HD22 ' A' ' 89' ' ' LEU . 1.3 mm? -97.27 129.93 44.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.259 -0.428 . . . . 20.0 110.933 -179.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 1.5 mt -115.8 92.0 32.59 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-N 116.18 -0.464 . . . . 20.0 110.982 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.616 ' HA ' ' CZ2' ' A' ' 100' ' ' TRP . 76.1 Cg_exo -47.98 90.6 0.02 OUTLIER 'Trans proline' 0 N--CA 1.464 -0.208 0 C-N-CA 122.562 2.175 . . . . 20.0 112.562 -179.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.591 ' ND2' HD11 ' A' ' 94' ' ' ILE . 63.3 t30 -140.35 68.88 1.35 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.19 -0.459 . . . . 20.0 110.991 179.57 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.628 ' HB2' ' HH2' ' A' ' 100' ' ' TRP . . . -66.6 -9.62 37.35 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.97 -0.559 . . . . 20.0 111.496 -179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.787 HG22 ' O ' ' A' ' 94' ' ' ILE . 9.7 mt 33.25 31.7 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.228 0 CA-C-O 121.037 0.446 . . . . 20.0 111.236 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.529 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 95.96 -41.39 2.44 Favored Glycine 0 N--CA 1.449 -0.441 0 CA-C-N 115.839 -0.619 . . . . 20.0 112.535 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.517 ' HD2' ' HE3' ' A' ' 98' ' ' LYS . 61.3 ttm-85 -123.82 135.99 54.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.66 0.267 . . . . 20.0 111.109 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.566 HG11 ' HD3' ' A' ' 101' ' ' ARG . 17.6 t -110.85 128.46 67.23 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.729 0 CA-C-O 121.702 0.763 . . . . 20.0 110.368 179.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.517 ' HE3' ' HD2' ' A' ' 96' ' ' ARG . 1.0 OUTLIER -160.16 20.22 0.15 Allowed 'General case' 0 C--N 1.308 -1.234 0 CA-C-N 114.428 -1.26 . . . . 20.0 111.086 -179.137 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 0.624 ' N ' ' CD1' ' A' ' 99' ' ' TRP . 0.0 OUTLIER -150.07 -100.02 0.07 Allowed 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.774 0.287 . . . . 20.0 111.774 -178.121 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' TRP . . . . . 0.628 ' HH2' ' HB2' ' A' ' 93' ' ' ALA . 0.0 OUTLIER -60.04 175.22 0.42 Allowed 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 116.573 -0.285 . . . . 20.0 110.282 179.81 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.566 ' HD3' HG11 ' A' ' 97' ' ' VAL . 0.0 OUTLIER 155.55 150.07 0.0 OUTLIER Pre-proline 0 C--N 1.334 -0.097 0 CA-C-N 116.076 -0.511 . . . . 20.0 111.618 178.494 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.559 ' HD2' ' NE ' ' A' ' 101' ' ' ARG . 10.0 Cg_endo -52.45 -13.12 2.02 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 123.774 2.982 . . . . 20.0 113.481 -179.642 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -81.87 8.65 9.78 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.874 0.368 . . . . 20.0 110.946 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 127.12 149.73 7.29 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 121.081 -0.58 . . . . 20.0 112.423 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . 0.678 ' HG3' ' HB1' ' A' ' 87' ' ' ALA . 98.2 Cg_endo -83.45 133.72 6.36 Favored 'Trans proline' 0 N--CA 1.461 -0.414 0 C-N-CA 122.96 2.44 . . . . 20.0 112.512 -179.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.478 ' O ' ' CD2' ' A' ' 107' ' ' PHE . 84.1 m-20 -84.9 130.44 34.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.12 0.486 . . . . 20.0 111.417 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.483 ' O ' ' O ' ' A' ' 82' ' ' GLY . 74.7 m-85 -162.15 26.54 0.11 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.62 -0.718 . . . . 20.0 110.065 179.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.532 ' O ' ' N ' ' A' ' 143' ' ' LYS . 97.2 mtt180 -45.69 162.96 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.403 -0.817 . . . . 20.0 111.938 -179.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.893 ' HB2' ' N ' ' A' ' 81' ' ' SER . 15.2 m -95.34 106.3 18.34 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.976 -1.011 . . . . 20.0 109.526 178.565 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.723 HG23 ' O ' ' A' ' 143' ' ' LYS . 0.6 OUTLIER -108.08 149.04 38.63 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-O 121.314 0.578 . . . . 20.0 111.996 -179.677 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.976 ' CB ' HG11 ' A' ' 137' ' ' VAL . 19.9 Cg_endo -60.73 130.2 32.24 Favored 'Trans proline' 0 N--CA 1.466 -0.144 0 C-N-CA 122.974 2.45 . . . . 20.0 111.725 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -97.16 -68.58 0.79 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.803 0.335 . . . . 20.0 111.752 -179.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.447 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 35.1 ttm180 -122.97 147.47 46.58 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.284 -0.416 . . . . 20.0 110.909 -179.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.854 ' CE2' HG13 ' A' ' 137' ' ' VAL . 0.5 OUTLIER -120.73 155.93 32.89 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.404 0.621 . . . . 20.0 111.558 -179.456 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.429 ' HD2' ' NE2' ' A' ' 117' ' ' GLN . 48.3 ttm-85 -95.11 142.66 27.3 Favored 'General case' 0 N--CA 1.443 -0.785 0 N-CA-C 108.327 -0.99 . . . . 20.0 108.327 177.982 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . 0.52 ' O ' ' NE2' ' A' ' 117' ' ' GLN . . . -80.51 130.98 35.48 Favored 'General case' 0 C--N 1.315 -0.913 0 C-N-CA 120.662 -0.415 . . . . 20.0 111.365 -178.729 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.664 ' HB2' HG23 ' A' ' 134' ' ' VAL . 87.8 mm-40 -131.58 127.64 37.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.054 -0.521 . . . . 20.0 111.122 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 80.1 mtm180 -129.38 96.06 4.19 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.068 -0.514 . . . . 20.0 110.358 179.079 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 0.823 HG21 ' CB ' ' A' ' 73' ' ' LYS . 59.5 t -122.1 144.54 31.04 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.544 -0.753 . . . . 20.0 110.934 -179.472 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.507 ' HA ' ' O ' ' A' ' 130' ' ' ARG . 24.2 mp0 -82.13 121.48 26.65 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.812 -0.44 . . . . 20.0 109.812 179.621 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.857 HD13 ' HB2' ' A' ' 66' ' ' ASP . 0.2 OUTLIER -66.35 126.33 28.43 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.197 0.523 . . . . 20.0 110.649 -179.093 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.984 HD12 ' HA ' ' A' ' 71' ' ' SER . 0.9 OUTLIER -91.52 144.08 25.92 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.397 -0.82 . . . . 20.0 111.312 -178.742 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . 0.551 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -108.19 123.27 38.05 Favored Pre-proline 0 C--N 1.322 -0.596 0 CA-C-N 115.688 -0.687 . . . . 20.0 111.382 -179.663 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -67.34 103.18 0.76 Allowed 'Trans proline' 0 N--CA 1.462 -0.362 0 C-N-CA 122.108 1.872 . . . . 20.0 110.763 178.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . . . . . . . . . . . 78.46 29.75 51.79 Favored Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 120.457 -0.878 . . . . 20.0 111.35 -178.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . 0.537 ' O ' ' HB3' ' A' ' 123' ' ' CYS . . . -157.27 124.0 1.36 Allowed Glycine 0 N--CA 1.447 -0.584 0 N-CA-C 111.632 -0.587 . . . . 20.0 111.632 -179.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.469 ' C ' ' HD3' ' A' ' 129' ' ' PRO . . . -88.29 43.33 1.12 Allowed 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 111.767 0.284 . . . . 20.0 111.767 -179.363 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -113.12 56.76 0.59 Allowed Pre-proline 0 C--N 1.328 -0.367 0 CA-C-O 120.968 0.413 . . . . 20.0 110.605 179.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . 0.469 ' HD3' ' C ' ' A' ' 127' ' ' ALA . 46.8 Cg_endo -68.2 151.18 77.07 Favored 'Trans proline' 0 C--N 1.342 0.217 0 C-N-CA 122.934 2.423 . . . . 20.0 112.752 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.552 ' HB2' HD12 ' A' ' 121' ' ' LEU . 99.7 mtt180 -138.71 151.04 46.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.122 -0.49 . . . . 20.0 110.987 179.764 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . . . . . . . . . 10.6 t -91.11 139.21 30.97 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.623 0.249 . . . . 20.0 110.954 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . 0.524 ' HD3' ' CB ' ' A' ' 64' ' ' LEU . 54.6 ttt85 -146.23 143.77 29.44 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.082 0.467 . . . . 20.0 112.086 -179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.475 ' HA ' ' O ' ' A' ' 117' ' ' GLN . 25.4 pttm -104.42 142.08 35.22 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.589 -0.732 . . . . 20.0 110.006 178.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.664 HG23 ' HB2' ' A' ' 117' ' ' GLN . 1.8 m -147.58 128.65 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.49 0 CA-C-O 121.276 0.56 . . . . 20.0 110.97 -179.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.541 ' HB3' ' HB2' ' A' ' 114' ' ' TYR . 91.2 mtt-85 -89.62 110.99 21.81 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.282 -0.872 . . . . 20.0 110.315 179.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.587 ' CD2' ' N ' ' A' ' 136' ' ' LEU . 0.2 OUTLIER -107.86 127.24 53.55 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.873 0.368 . . . . 20.0 111.067 -179.811 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.976 HG11 ' CB ' ' A' ' 111' ' ' PRO . 0.0 OUTLIER -63.05 88.73 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-O 120.816 0.341 . . . . 20.0 111.666 -179.941 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -61.68 -23.88 66.39 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.25 0.548 . . . . 20.0 109.602 179.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 37.0 t -155.21 126.39 7.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.342 -0.844 . . . . 20.0 111.325 179.483 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' CYS . . . . . . . . . . . . . 26.5 p -131.23 164.14 26.22 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.386 -0.37 . . . . 20.0 110.619 179.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . 0.436 ' HG2' ' N ' ' A' ' 142' ' ' CYS . 75.3 tttt -141.54 162.14 36.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.273 -0.421 . . . . 20.0 111.495 -179.576 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . 0.863 ' HA ' ' HA ' ' A' ' 109' ' ' CYS . 0.5 OUTLIER -60.44 106.17 0.51 Allowed 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.986 -0.552 . . . . 20.0 109.856 179.61 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.723 ' O ' HG23 ' A' ' 110' ' ' ILE . 69.6 mmtt -132.93 141.14 48.2 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 113.261 0.837 . . . . 20.0 113.261 -179.055 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.438 ' CD ' ' HB3' ' A' ' 143' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.248 1.0 0 CA-C-O 118.268 -0.872 . . . . 20.0 111.068 179.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 93.4 mttt . . . . . 0 N--CA 1.487 1.411 0 CA-C-O 120.699 0.285 . . . . 20.0 110.65 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 46.8 m-20 -89.26 17.75 5.77 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.495 -0.321 . . . . 20.0 111.668 -179.093 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.583 HG13 ' CB ' ' A' ' 81' ' ' SER . 92.7 t -71.8 -11.22 14.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 C-N-CA 120.779 -0.368 . . . . 20.0 111.14 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . . . . . . . . . 72.6 m -59.76 -33.93 72.32 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.152 0.501 . . . . 20.0 109.748 179.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.564 ' O ' ' CG2' ' A' ' 79' ' ' VAL . 96.9 mt-10 -86.29 13.28 8.31 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.381 -0.827 . . . . 20.0 110.647 179.327 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.864 ' O ' ' N ' ' A' ' 81' ' ' SER . 0.3 OUTLIER -128.48 30.32 5.17 Favored 'General case' 0 C--O 1.194 -1.829 0 CA-C-N 116.062 -0.517 . . . . 20.0 111.798 -178.75 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.473 ' C ' ' HA ' ' A' ' 80' ' ' CYS . 2.1 m -70.52 131.44 44.01 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 119.973 1.26 . . . . 20.0 112.68 -178.029 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.551 ' HA ' ' CB ' ' A' ' 80' ' ' CYS . 3.9 m -71.03 -29.04 64.85 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 109.673 -0.491 . . . . 20.0 109.673 178.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.47 ' CG ' ' HB3' ' A' ' 54' ' ' SER . 0.0 OUTLIER -26.77 -85.21 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.982 -0.554 . . . . 20.0 111.816 -179.435 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 36.8 tp10 -171.56 62.66 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.675 -0.693 . . . . 20.0 109.975 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.96 HD22 HG22 ' A' ' 79' ' ' VAL . 6.8 tt -100.23 140.2 34.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.987 -0.551 . . . . 20.0 111.871 -179.393 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.753 ' N ' HD23 ' A' ' 58' ' ' LEU . 38.4 m80 -132.27 139.04 48.1 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.797 -0.638 . . . . 20.0 111.085 179.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.927 ' CE1' HD21 ' A' ' 58' ' ' LEU . 10.2 m-30 -115.51 152.53 32.82 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.974 0.416 . . . . 20.0 111.765 -179.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 58.6 p -102.53 79.68 1.84 Allowed 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.9 -0.591 . . . . 20.0 111.198 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.911 ' O ' HG21 ' A' ' 75' ' ' VAL . 16.1 tpt180 -118.32 120.27 37.13 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 108.712 -0.847 . . . . 20.0 108.712 178.197 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.636 ' C ' HD23 ' A' ' 64' ' ' LEU . 0.0 OUTLIER -109.08 -79.44 0.58 Allowed 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 112.663 0.616 . . . . 20.0 112.663 -177.786 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 1.002 HD11 HG23 ' A' ' 119' ' ' VAL . 0.0 OUTLIER -168.29 137.75 2.44 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.699 -0.4 . . . . 20.0 111.869 -178.063 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.693 HG22 ' HG3' ' A' ' 70' ' ' ARG . 19.3 p -129.45 149.12 51.36 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.852 0.358 . . . . 20.0 110.263 178.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.506 ' O ' ' C ' ' A' ' 67' ' ' GLY . 24.7 t0 -154.45 -165.51 2.09 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.396 -0.594 . . . . 20.0 109.396 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.847 ' O ' ' N ' ' A' ' 69' ' ' CYS . . . -32.29 147.55 0.01 OUTLIER Glycine 0 C--N 1.345 1.082 0 N-CA-C 109.879 -1.289 . . . . 20.0 109.879 178.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.502 ' O ' ' SG ' ' A' ' 123' ' ' CYS . 25.3 Cg_exo -15.95 55.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.667 0 C-N-CA 125.138 3.892 . . . . 20.0 115.29 -178.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.847 ' N ' ' O ' ' A' ' 67' ' ' GLY . 33.3 m -162.23 162.41 28.21 Favored 'General case' 0 C--O 1.233 0.232 0 C-N-CA 123.492 0.717 . . . . 20.0 109.121 178.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.693 ' HG3' HG22 ' A' ' 65' ' ' THR . 75.7 ttt180 -158.41 144.58 17.11 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.079 0.466 . . . . 20.0 111.988 179.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . 0.644 ' HB3' HD12 ' A' ' 64' ' ' LEU . 1.0 OUTLIER -83.05 172.37 12.8 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 115.59 -0.732 . . . . 20.0 110.819 179.287 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -152.87 36.51 0.49 Allowed 'General case' 0 C--N 1.321 -0.632 0 C-N-CA 120.26 -0.576 . . . . 20.0 112.422 178.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.652 ' CB ' HG11 ' A' ' 119' ' ' VAL . 30.3 mmtt -79.89 163.68 56.88 Favored Pre-proline 0 C--N 1.327 -0.399 0 CA-C-N 116.405 -0.361 . . . . 20.0 110.637 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -63.51 116.07 3.42 Favored 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.601 2.201 . . . . 20.0 112.505 -179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' VAL . . . . . 0.911 HG21 ' O ' ' A' ' 62' ' ' ARG . 4.4 m -140.07 136.52 37.99 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 CA-C-N 116.573 -0.285 . . . . 20.0 111.101 179.332 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.446 HG23 ' HB3' ' A' ' 59' ' ' HIS . 54.6 m -126.49 123.29 37.48 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 120.918 0.389 . . . . 20.0 112.031 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.57 ' CG ' ' HB2' ' A' ' 60' ' ' TYR . 20.0 pt-20 -131.17 148.64 52.74 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.034 -0.53 . . . . 20.0 109.677 178.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.568 ' N ' HD12 ' A' ' 78' ' ' LEU . 6.5 mp -101.07 158.36 16.07 Favored 'General case' 0 CA--C 1.513 -0.475 0 N-CA-C 113.575 0.954 . . . . 20.0 113.575 -178.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' VAL . . . . . 0.96 HG22 HD22 ' A' ' 58' ' ' LEU . 1.4 m -135.06 84.01 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.647 0 CA-C-N 113.903 -1.499 . . . . 20.0 109.162 178.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.628 ' C ' ' HB2' ' A' ' 109' ' ' CYS . 3.2 p -98.65 137.3 37.48 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.511 0.93 . . . . 20.0 113.511 -177.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.864 ' N ' ' O ' ' A' ' 53' ' ' TYR . 40.3 t -151.05 108.18 3.58 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.808 0.843 . . . . 20.0 110.041 178.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . 0.473 ' O ' ' HA ' ' A' ' 108' ' ' ARG . . . -163.13 -151.61 6.48 Favored Glycine 0 N--CA 1.447 -0.627 0 C-N-CA 120.663 -0.78 . . . . 20.0 112.374 -179.089 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.415 ' C ' ' SG ' ' A' ' 142' ' ' CYS . 58.3 tt0 -108.15 141.49 39.79 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.627 -0.509 . . . . 20.0 109.627 179.207 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' CYS . . . . . 0.445 ' SG ' ' O ' ' A' ' 142' ' ' CYS . 4.5 m -100.7 153.61 19.3 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.575 -0.284 . . . . 20.0 110.605 -179.399 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLY . . . . . 0.425 ' N ' ' CD ' ' A' ' 86' ' ' PRO . . . -54.23 -49.53 59.44 Favored Glycine 0 CA--C 1.519 0.285 0 C-N-CA 120.989 -0.624 . . . . 20.0 113.254 -179.147 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' PRO . . . . . 0.425 ' CD ' ' N ' ' A' ' 85' ' ' GLY . 51.8 Cg_exo -56.55 127.41 25.82 Favored 'Trans proline' 0 N--CA 1.473 0.284 0 C-N-CA 122.818 2.345 . . . . 20.0 112.755 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -113.08 25.16 11.63 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.127 -0.488 . . . . 20.0 111.989 -179.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -67.08 124.44 23.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.073 0.463 . . . . 20.0 110.699 -179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.515 HD13 ' O ' ' A' ' 103' ' ' ASN . 10.7 mt -111.88 107.37 16.38 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.86 -0.609 . . . . 20.0 110.845 -179.415 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -115.18 119.25 38.94 Favored Pre-proline 0 C--N 1.327 -0.395 0 N-CA-C 112.123 0.416 . . . . 20.0 112.123 -179.526 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' PRO . . . . . 0.616 ' HB2' ' CD2' ' A' ' 100' ' ' TRP . 44.0 Cg_endo -65.99 131.0 25.8 Favored 'Trans proline' 0 C--N 1.343 0.263 0 C-N-CA 122.743 2.295 . . . . 20.0 111.306 178.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ASN . . . . . 0.599 ' O ' ' CH2' ' A' ' 99' ' ' TRP . 48.9 m-20 -101.16 146.81 27.01 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 113.303 0.853 . . . . 20.0 113.303 -178.276 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ALA . . . . . 0.727 ' HA ' ' CZ3' ' A' ' 100' ' ' TRP . . . -74.06 -20.7 60.2 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.298 -0.864 . . . . 20.0 112.68 179.478 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ILE . . . . . 1.024 HD12 ' CH2' ' A' ' 99' ' ' TRP . 58.0 mt 30.55 33.85 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-O 121.116 0.484 . . . . 20.0 111.395 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.565 ' N ' ' O ' ' A' ' 93' ' ' ALA . . . 97.63 -48.69 1.49 Allowed Glycine 0 CA--C 1.519 0.288 0 CA-C-N 115.721 -0.672 . . . . 20.0 112.203 -179.618 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . 0.595 ' O ' ' CZ2' ' A' ' 99' ' ' TRP . 50.8 mtp85 -117.98 142.22 47.61 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.51 0.195 . . . . 20.0 110.518 179.396 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' VAL . . . . . 0.953 HG13 ' CZ3' ' A' ' 100' ' ' TRP . 10.8 t -123.48 133.97 67.65 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.924 0 CA-C-O 121.68 0.752 . . . . 20.0 110.91 178.842 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.452 ' CB ' ' O ' ' A' ' 97' ' ' VAL . 0.2 OUTLIER 161.27 -30.45 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 114.498 -1.228 . . . . 20.0 108.671 -178.988 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' TRP . . . . . 1.024 ' CH2' HD12 ' A' ' 94' ' ' ILE . 31.1 p-90 -96.54 22.05 8.49 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 113.324 -1.762 . . . . 20.0 109.408 179.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' TRP . . . . . 0.953 ' CZ3' HG13 ' A' ' 97' ' ' VAL . 0.0 OUTLIER -28.79 136.93 0.02 OUTLIER 'General case' 0 CA--C 1.497 -1.067 0 CA-C-O 121.908 0.861 . . . . 20.0 113.179 -177.317 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 11.2 mtp180 -124.78 80.71 62.2 Favored Pre-proline 0 N--CA 1.437 -1.095 0 CA-C-N 114.028 -1.442 . . . . 20.0 111.07 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.452 ' O ' ' CB ' ' A' ' 89' ' ' LEU . 26.5 Cg_endo -64.15 -4.11 7.2 Favored 'Trans proline' 0 C--O 1.233 0.26 0 C-N-CA 122.804 2.336 . . . . 20.0 112.153 179.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.515 ' O ' HD13 ' A' ' 89' ' ' LEU . 34.8 m120 -54.76 -32.63 60.19 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.071 0.462 . . . . 20.0 110.069 179.239 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 107.58 151.75 17.17 Favored Glycine 0 N--CA 1.448 -0.527 0 C-N-CA 120.823 -0.703 . . . . 20.0 112.677 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -69.86 167.35 24.82 Favored 'Trans proline' 0 N--CA 1.465 -0.169 0 C-N-CA 122.905 2.403 . . . . 20.0 112.003 179.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.468 ' O ' ' O ' ' A' ' 144' ' ' ARG . 62.4 t0 -74.46 128.35 35.33 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.32 -0.4 . . . . 20.0 110.979 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' PHE . . . . . 0.406 ' HA ' ' HB3' ' A' ' 144' ' ' ARG . 97.4 m-85 -112.41 155.86 23.49 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.943 0.402 . . . . 20.0 111.231 -179.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ARG . . . . . 0.544 ' N ' ' HB3' ' A' ' 144' ' ' ARG . 57.6 ttp180 -173.03 174.13 3.54 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 116.041 -0.527 . . . . 20.0 110.673 -179.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.823 ' HA ' ' HA ' ' A' ' 142' ' ' CYS . 4.5 m -85.35 138.5 32.25 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.822 -0.172 . . . . 20.0 110.857 179.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ILE . . . . . 0.793 HG22 ' OH ' ' A' ' 53' ' ' TYR . 2.7 pp -147.56 154.64 45.01 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.316 0.579 . . . . 20.0 112.149 178.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' PRO . . . . . 0.921 ' CB ' HG11 ' A' ' 137' ' ' VAL . 16.6 Cg_endo -56.45 143.1 88.45 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 123.341 2.694 . . . . 20.0 112.028 179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 67.5 t0 -126.59 -57.43 1.36 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.403 -0.362 . . . . 20.0 111.686 -179.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ARG . . . . . 0.521 ' O ' ' HA ' ' A' ' 137' ' ' VAL . 48.0 ttt180 -121.38 150.16 41.89 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.298 -0.41 . . . . 20.0 111.072 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . 0.816 ' CE2' HG13 ' A' ' 137' ' ' VAL . 0.5 OUTLIER -125.48 160.77 28.67 Favored 'General case' 0 CA--C 1.515 -0.37 0 CA-C-O 121.702 0.763 . . . . 20.0 112.629 -179.289 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.53 ' HD2' ' NE2' ' A' ' 117' ' ' GLN . 42.9 ttm-85 -97.84 140.4 32.26 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 114.539 -1.21 . . . . 20.0 107.907 176.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ALA . . . . . . . . . . . . . . . -80.51 130.66 35.28 Favored 'General case' 0 C--N 1.313 -0.988 0 C-N-CA 120.683 -0.407 . . . . 20.0 111.633 -178.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.53 ' NE2' ' HD2' ' A' ' 115' ' ' ARG . 89.1 mm-40 -133.79 136.62 44.62 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 116.09 -0.504 . . . . 20.0 110.807 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 50.1 ttt180 -134.02 94.71 3.3 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.996 -0.547 . . . . 20.0 110.189 179.661 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' VAL . . . . . 1.002 HG23 HD11 ' A' ' 64' ' ' LEU . 9.1 m -131.61 162.19 39.88 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 115.861 -0.608 . . . . 20.0 110.859 -179.402 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' GLN . . . . . 0.567 ' HA ' ' HA ' ' A' ' 131' ' ' SER . 21.7 pt20 -99.86 143.46 30.05 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.286 -0.415 . . . . 20.0 112.017 -179.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.783 HD12 ' HB2' ' A' ' 130' ' ' ARG . 0.1 OUTLIER -79.51 131.52 36.06 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.85 -0.614 . . . . 20.0 110.049 179.456 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' LEU . . . . . 0.642 ' N ' HD12 ' A' ' 122' ' ' LEU . 3.5 mp -97.22 140.76 31.23 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.774 -0.648 . . . . 20.0 111.942 -178.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' CYS . . . . . 0.502 ' SG ' ' O ' ' A' ' 68' ' ' PRO . 0.1 OUTLIER -118.59 152.34 51.05 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 115.176 -0.92 . . . . 20.0 109.837 179.313 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' PRO . . . . . 0.452 ' HD2' ' SG ' ' A' ' 123' ' ' CYS . 82.0 Cg_exo -47.73 109.78 0.26 Allowed 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 121.603 1.535 . . . . 20.0 111.044 179.851 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' GLY . . . . . 0.424 ' O ' ' C ' ' A' ' 126' ' ' GLY . . . 95.56 3.6 61.07 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.89 -0.672 . . . . 20.0 112.202 -178.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . 0.424 ' C ' ' O ' ' A' ' 125' ' ' GLY . . . 36.47 63.29 0.7 Allowed Glycine 0 C--N 1.335 0.481 0 C-N-CA 120.685 -0.769 . . . . 20.0 111.788 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -97.41 -53.08 3.57 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 111.849 0.314 . . . . 20.0 111.849 -179.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -122.2 59.14 10.88 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 120.939 0.4 . . . . 20.0 111.741 -179.203 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' PRO . . . . . 0.42 ' HB2' ' NE2' ' A' ' 120' ' ' GLN . 12.4 Cg_endo -55.75 149.18 51.4 Favored 'Trans proline' 0 CA--C 1.528 0.203 0 C-N-CA 122.981 2.454 . . . . 20.0 111.945 179.229 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' ARG . . . . . 0.783 ' HB2' HD12 ' A' ' 121' ' ' LEU . 95.9 mtt-85 -130.49 155.57 46.24 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 116.358 -0.383 . . . . 20.0 110.822 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' SER . . . . . 0.567 ' HA ' ' HA ' ' A' ' 120' ' ' GLN . 66.6 m -109.04 133.91 52.36 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.898 0.38 . . . . 20.0 111.936 -179.606 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' ARG . . . . . 0.462 ' HD2' ' HB2' ' A' ' 64' ' ' LEU . 15.8 ttm180 -140.96 142.44 34.33 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.045 -0.525 . . . . 20.0 111.879 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -100.15 146.51 26.74 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.596 -0.729 . . . . 20.0 109.155 178.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' VAL . . . . . 0.528 HG21 ' O ' ' A' ' 63' ' ' PHE . 0.4 OUTLIER -153.03 133.3 4.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-O 121.385 0.612 . . . . 20.0 112.398 -178.576 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . 0.489 ' C ' HD23 ' A' ' 136' ' ' LEU . 62.1 mtp85 -91.37 113.06 25.23 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.823 -1.081 . . . . 20.0 109.89 178.475 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.768 HD12 ' HB ' ' A' ' 75' ' ' VAL . 7.6 mt -112.38 130.02 56.11 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.971 0.415 . . . . 20.0 111.927 -179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' VAL . . . . . 0.921 HG11 ' CB ' ' A' ' 111' ' ' PRO . 0.2 OUTLIER -64.61 94.58 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 112.401 0.519 . . . . 20.0 112.401 -179.407 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' ALA . . . . . . . . . . . . . . . -80.27 -7.07 58.85 Favored 'General case' 0 CA--C 1.53 0.19 0 CA-C-O 121.158 0.504 . . . . 20.0 109.74 178.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 20.1 t -163.29 129.78 3.33 Favored 'General case' 0 N--CA 1.461 0.117 0 CA-C-N 115.405 -0.816 . . . . 20.0 109.919 179.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' CYS . . . . . 0.481 ' HB3' ' HA ' ' A' ' 111' ' ' PRO . 25.5 p -129.4 165.74 20.95 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 121.028 0.442 . . . . 20.0 111.49 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' LYS . . . . . . . . . . . . . 36.1 mttt -123.02 154.4 38.53 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.718 -0.673 . . . . 20.0 110.032 179.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . 0.823 ' HA ' ' HA ' ' A' ' 109' ' ' CYS . 53.4 t -66.21 103.82 1.06 Allowed 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.724 -0.473 . . . . 20.0 109.724 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' LYS . . . . . 0.599 ' HB3' HG13 ' A' ' 110' ' ' ILE . 20.5 tptt -147.16 136.66 22.79 Favored 'General case' 0 N--CA 1.461 0.097 0 C-N-CA 118.762 -1.175 . . . . 20.0 113.376 -178.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' ARG . . . . . 0.544 ' HB3' ' N ' ' A' ' 108' ' ' ARG . 11.7 tpt180 . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.258 -0.877 . . . . 20.0 110.616 179.485 . . . . . . . . 1 1 . 1 stop_ save_