data_1tz4_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 1tz4 _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 ' 20' ' ' TYR . . . . . . . . . . . . . 40.6 t80 . . . . . 0 N--CA 1.469 0.523 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.63 -37.52 70.84 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.373 1.069 . . . . 0.0 110.412 176.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.64 -46.04 60.23 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 124.799 1.24 . . . . 0.0 111.956 177.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.73 -46.89 71.0 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 119.676 1.126 . . . . 0.0 109.358 173.269 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.6 mt -65.57 -47.18 76.7 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 118.855 -0.593 . . . . 0.0 111.182 176.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.97 -31.91 67.35 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 117.968 -1.015 . . . . 0.0 113.593 174.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 36.9 t60 -76.44 -51.21 12.25 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 126.4 1.88 . . . . 0.0 110.497 177.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.95 -47.03 84.1 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 123.822 0.849 . . . . 0.0 110.832 177.265 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.221 -0.432 0 CA-C-O 117.185 -1.388 . . . . 0.0 110.318 175.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 3.9 t80 . . . . . 0 C--O 1.221 -0.405 0 CA-C-O 119.435 -0.317 . . . . 0.0 110.698 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.87 -34.01 18.78 Favored 'General case' 0 C--N 1.343 0.314 0 CA-C-O 118.071 -0.966 . . . . 0.0 112.165 177.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.23 -50.43 40.0 Favored 'General case' 0 C--N 1.343 0.283 0 C-N-CA 125.789 1.635 . . . . 0.0 112.21 172.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -49.73 -49.19 49.0 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.931 1.241 . . . . 0.0 111.397 172.225 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.9 mp -63.93 -49.59 71.99 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-O 118.754 -0.641 . . . . 0.0 110.988 177.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.82 -37.96 64.11 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.93 1.292 . . . . 0.0 113.286 175.053 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 20.2 t60 -73.13 -51.91 16.18 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 124.785 1.234 . . . . 0.0 110.881 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -49.82 -60.88 2.49 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 124.54 1.136 . . . . 0.0 110.227 172.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.47 0.529 0 C-N-CA 124.173 0.989 . . . . 0.0 111.806 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 78.7 t80 . . . . . 0 C--O 1.226 -0.137 0 CA-C-O 121.505 0.669 . . . . 0.0 111.841 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.61 -35.33 68.15 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.673 1.189 . . . . 0.0 111.368 176.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.18 -49.69 33.6 Favored 'General case' 0 C--O 1.22 -0.464 0 C-N-CA 125.967 1.707 . . . . 0.0 111.456 177.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -54.72 -44.01 73.1 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 119.57 1.077 . . . . 0.0 110.17 173.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 mt -67.45 -40.26 85.39 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 118.89 -0.576 . . . . 0.0 111.461 177.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.98 -38.17 87.56 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.762 1.225 . . . . 0.0 113.178 172.665 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 51.7 t60 -71.16 -51.65 23.7 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 125.163 1.385 . . . . 0.0 108.961 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -50.34 -53.25 30.28 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 124.538 1.135 . . . . 0.0 111.569 174.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.467 0.393 0 CA-C-N 118.837 0.744 . . . . 0.0 110.525 178.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 89.5 t80 . . . . . 0 N--CA 1.468 0.441 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.62 -32.67 67.45 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 118.488 -0.768 . . . . 0.0 111.49 176.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.82 -50.18 45.43 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 125.431 1.492 . . . . 0.0 111.592 174.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.14 -45.57 75.63 Favored 'General case' 0 N--CA 1.462 0.156 0 C-N-CA 123.753 0.821 . . . . 0.0 110.135 176.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.1 mt -66.39 -40.36 89.62 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 119.14 -0.457 . . . . 0.0 111.702 177.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -39.94 91.68 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.497 1.119 . . . . 0.0 113.03 172.433 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 42.8 t60 -69.53 -50.38 45.56 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 125.136 1.374 . . . . 0.0 110.499 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -50.6 -59.04 4.45 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 124.342 1.057 . . . . 0.0 110.0 173.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.473 0.705 0 CA-C-N 118.444 0.565 . . . . 0.0 111.374 -178.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 44.4 t80 . . . . . 0 N--CA 1.471 0.578 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.42 -35.49 70.12 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.055 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.67 -51.18 52.83 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 125.16 1.384 . . . . 0.0 111.82 174.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -50.75 -46.51 59.35 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 119.454 1.025 . . . . 0.0 110.211 174.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.5 mt -67.73 -47.31 69.67 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 118.99 -0.529 . . . . 0.0 111.279 178.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -35.08 68.63 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.029 1.331 . . . . 0.0 113.514 174.568 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -74.54 -52.95 10.43 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 126.033 1.733 . . . . 0.0 110.35 178.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -48.52 -62.51 1.46 Allowed 'General case' 0 C--N 1.344 0.332 0 CA-C-O 117.857 -1.068 . . . . 0.0 109.907 171.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.475 0.789 0 C-N-CA 124.511 1.124 . . . . 0.0 111.946 -177.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 87.9 t80 . . . . . 0 N--CA 1.471 0.619 0 CA-C-O 121.097 0.475 . . . . 0.0 111.828 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.2 -32.1 66.13 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.475 1.11 . . . . 0.0 111.168 175.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.42 -48.13 43.67 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 125.125 1.37 . . . . 0.0 111.533 175.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -54.83 -47.68 73.8 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 124.029 0.932 . . . . 0.0 109.716 175.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mt -65.93 -39.6 90.64 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 177.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.35 -43.91 96.06 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.457 1.103 . . . . 0.0 112.304 172.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 54.9 t60 -65.43 -50.9 63.69 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.81 1.244 . . . . 0.0 110.513 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -50.91 -57.26 8.96 Favored 'General case' 0 C--N 1.344 0.347 0 C-N-CA 124.386 1.074 . . . . 0.0 110.731 172.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.222 -0.347 0 CA-C-N 118.867 0.758 . . . . 0.0 110.881 178.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 . . . . . 0 N--CA 1.467 0.397 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.77 -29.01 67.89 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 118.708 -0.663 . . . . 0.0 112.386 176.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.55 -49.61 21.22 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.742 1.617 . . . . 0.0 111.735 177.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -58.67 -46.06 88.05 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.224 0.61 . . . . 0.0 109.976 176.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.1 mt -62.27 -39.72 93.87 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 118.713 -0.66 . . . . 0.0 111.682 174.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.87 -34.57 76.24 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.789 1.235 . . . . 0.0 113.123 173.144 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 45.7 t60 -78.82 -53.12 7.43 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 118.706 -0.664 . . . . 0.0 110.172 178.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -46.69 -43.77 18.09 Favored 'General case' 0 C--O 1.214 -0.796 0 C-N-CA 124.679 1.192 . . . . 0.0 111.228 171.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.369 0 CA-C-N 119.607 1.094 . . . . 0.0 111.001 175.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.3 t80 . . . . . 0 N--CA 1.465 0.28 0 CA-C-O 121.012 0.434 . . . . 0.0 111.301 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.78 -29.07 69.21 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 176.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.02 -49.47 19.7 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.834 1.654 . . . . 0.0 112.037 177.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -54.66 -48.43 72.35 Favored 'General case' 0 CA--C 1.528 0.105 0 C-N-CA 124.717 1.207 . . . . 0.0 109.17 175.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.1 mt -64.01 -38.83 92.5 Favored 'General case' 0 C--N 1.347 0.478 0 CA-C-O 119.021 -0.514 . . . . 0.0 111.673 177.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.54 -37.48 86.27 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.414 1.086 . . . . 0.0 113.138 172.184 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 35.9 t60 -71.7 -52.05 19.8 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.197 1.399 . . . . 0.0 110.291 178.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.49 -52.04 56.42 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 124.605 1.162 . . . . 0.0 111.039 174.523 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.219 -0.525 0 CA-C-N 118.638 0.654 . . . . 0.0 111.43 176.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 69.4 t80 . . . . . 0 N--CA 1.47 0.573 0 CA-C-O 120.871 0.367 . . . . 0.0 110.677 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.78 -31.17 69.43 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.832 177.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.49 -48.16 35.59 Favored 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 126.631 1.972 . . . . 0.0 111.953 178.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.04 -47.0 78.68 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 125.145 1.378 . . . . 0.0 109.998 174.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.3 mt -65.3 -39.65 92.8 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.397 0.279 . . . . 0.0 111.556 176.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.02 -41.6 96.86 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.125 1.37 . . . . 0.0 113.379 172.226 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 44.5 t60 -69.8 -48.51 58.84 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 124.776 1.23 . . . . 0.0 110.493 178.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.47 -55.33 19.43 Favored 'General case' 0 C--O 1.223 -0.322 0 C-N-CA 124.016 0.926 . . . . 0.0 110.717 171.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.492 0 CA-C-N 119.272 0.942 . . . . 0.0 111.34 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.539 0.557 0 N-CA-C 111.641 0.237 . . . . 0.0 111.641 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.88 -33.6 74.51 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.295 1.038 . . . . 0.0 111.035 176.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.39 -49.52 33.28 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 126.643 1.977 . . . . 0.0 111.359 176.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.7 -49.93 69.5 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 119.674 1.125 . . . . 0.0 109.503 174.434 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.2 mt -63.18 -39.48 94.77 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 118.487 -0.768 . . . . 0.0 112.44 177.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -50.07 75.14 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 119.169 0.895 . . . . 0.0 112.066 171.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 26.2 t60 -58.55 -46.89 85.91 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.161 0.984 . . . . 0.0 110.015 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -70.88 19.79 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.716 1.606 . . . . 0.0 115.019 176.133 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.508 0 C-N-CA 125.707 1.603 . . . . 0.0 110.387 -179.155 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 91.5 t80 . . . . . 0 N--CA 1.465 0.324 0 CA-C-O 121.441 0.638 . . . . 0.0 111.934 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.72 -36.02 66.76 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.077 1.351 . . . . 0.0 111.012 177.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.08 -49.19 38.36 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 124.471 1.108 . . . . 0.0 111.912 176.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -51.28 -47.2 62.6 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 125.207 1.403 . . . . 0.0 109.192 173.194 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.1 mt -67.33 -43.58 81.21 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.185 177.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.43 -34.2 72.2 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 172.767 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 41.5 t60 -75.24 -52.72 10.21 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 125.792 1.637 . . . . 0.0 110.139 178.418 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -51.18 -52.81 40.74 Favored 'General case' 0 C--O 1.221 -0.431 0 C-N-CA 124.189 0.996 . . . . 0.0 111.702 172.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.222 -0.353 0 CA-C-O 118.64 -0.695 . . . . 0.0 110.727 178.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 12.7 m-30 . . . . . 0 N--CA 1.467 0.404 0 N-CA-C 110.27 -0.271 . . . . 0.0 110.27 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.67 -34.22 64.8 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 118.382 -0.818 . . . . 0.0 111.707 173.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.58 -48.46 32.61 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.138 1.375 . . . . 0.0 112.081 177.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.53 -49.08 65.55 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.947 0.899 . . . . 0.0 110.534 172.544 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.4 mt -61.89 -49.03 77.83 Favored 'General case' 0 C--N 1.346 0.434 0 CA-C-O 118.916 -0.564 . . . . 0.0 110.923 175.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.1 -30.32 61.89 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 174.344 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 40.3 t60 -79.41 -53.48 6.87 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 124.836 1.255 . . . . 0.0 110.756 177.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -51.72 -50.08 61.24 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 124.434 1.094 . . . . 0.0 110.448 175.661 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.467 0.413 0 CA-C-N 118.766 0.712 . . . . 0.0 111.564 177.061 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.5 t80 . . . . . 0 N--CA 1.467 0.421 0 CA-C-O 121.212 0.53 . . . . 0.0 111.444 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.64 -36.15 66.72 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 125.163 1.385 . . . . 0.0 110.96 176.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.4 -47.1 51.9 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-O 117.785 -1.102 . . . . 0.0 112.13 176.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -54.54 -46.92 73.69 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 119.758 1.163 . . . . 0.0 109.312 173.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.3 mt -65.48 -42.49 92.16 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 118.855 -0.593 . . . . 0.0 111.041 177.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.06 -44.12 91.79 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.109 0.963 . . . . 0.0 112.406 173.292 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 41.2 t60 -66.7 -52.57 43.08 Favored 'General case' 0 C--O 1.231 0.103 0 C-N-CA 125.576 1.551 . . . . 0.0 109.952 -179.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -50.16 -56.71 9.86 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-O 118.156 -0.926 . . . . 0.0 110.946 171.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.465 0.298 0 CA-C-N 119.167 0.894 . . . . 0.0 110.293 -179.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 . . . . . 0 N--CA 1.464 0.245 0 N-CA-C 110.467 -0.197 . . . . 0.0 110.467 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.56 -29.62 70.71 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 175.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -76.49 -47.44 22.83 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.445 1.498 . . . . 0.0 112.519 178.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.6 -50.31 70.46 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 124.319 1.048 . . . . 0.0 109.946 172.759 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.6 mt -62.84 -37.46 86.92 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 118.746 -0.645 . . . . 0.0 111.431 177.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -45.32 94.79 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.539 1.136 . . . . 0.0 113.078 171.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 38.6 t60 -64.62 -51.13 64.27 Favored 'General case' 0 C--N 1.334 -0.107 0 C-N-CA 124.097 0.959 . . . . 0.0 109.923 179.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -50.97 -56.5 12.11 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 123.956 0.902 . . . . 0.0 110.982 173.329 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.343 0.32 0 CA-C-N 118.746 0.703 . . . . 0.0 112.472 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 87.4 t80 . . . . . 0 N--CA 1.47 0.542 0 CA-C-O 121.003 0.43 . . . . 0.0 111.835 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.42 -31.98 64.43 Favored 'General case' 0 C--O 1.219 -0.513 0 C-N-CA 124.986 1.315 . . . . 0.0 111.203 175.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.93 -51.03 24.13 Favored 'General case' 0 C--O 1.219 -0.534 0 C-N-CA 124.996 1.318 . . . . 0.0 111.699 174.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -52.2 -47.76 65.43 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.851 0.86 . . . . 0.0 109.888 174.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.1 mt -65.83 -40.57 91.9 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.681 -0.676 . . . . 0.0 111.466 177.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.3 -37.07 79.41 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.621 1.168 . . . . 0.0 113.042 172.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -73.12 -51.67 17.1 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.151 1.381 . . . . 0.0 110.197 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -52.01 -54.69 26.87 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.767 0.827 . . . . 0.0 110.764 173.346 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.467 0.415 0 CA-C-N 119.244 0.929 . . . . 0.0 111.748 178.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 91.7 t80 . . . . . 0 N--CA 1.469 0.483 0 CA-C-O 121.213 0.53 . . . . 0.0 110.942 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.66 -33.0 69.61 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.884 177.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.34 -47.59 41.18 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 126.517 1.927 . . . . 0.0 112.228 178.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.87 -47.9 76.51 Favored 'General case' 0 N--CA 1.46 0.058 0 C-N-CA 124.582 1.153 . . . . 0.0 109.521 174.151 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.8 mt -64.34 -38.15 90.03 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 119.162 -0.447 . . . . 0.0 111.968 176.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.76 -34.14 77.63 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.042 1.337 . . . . 0.0 113.81 171.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 46.2 t60 -75.12 -49.86 18.23 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 125.053 1.341 . . . . 0.0 110.174 178.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -50.39 -55.11 17.14 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 124.491 1.116 . . . . 0.0 110.038 172.411 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.47 0.544 0 CA-C-N 118.867 0.758 . . . . 0.0 112.543 179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 74.7 t80 . . . . . 0 N--CA 1.468 0.429 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.73 -34.11 62.04 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 119.351 -0.357 . . . . 0.0 111.212 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.15 -45.31 57.4 Favored 'General case' 0 C--O 1.212 -0.882 0 C-N-CA 126.261 1.824 . . . . 0.0 112.261 176.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.65 -49.36 70.77 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 120.69 1.586 . . . . 0.0 109.15 174.524 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 mp -61.46 -55.72 28.14 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-O 118.847 -0.597 . . . . 0.0 111.022 175.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.85 -45.66 64.13 Favored 'General case' 0 C--O 1.208 -1.127 0 CA-C-O 118.134 -0.936 . . . . 0.0 112.027 177.131 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 18.7 t60 -60.0 -52.62 64.59 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 124.629 1.172 . . . . 0.0 109.697 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -70.52 19.7 0.05 OUTLIER 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.908 1.683 . . . . 0.0 114.962 176.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.221 -0.415 0 C-N-CA 125.656 1.582 . . . . 0.0 110.289 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 10.7 m-30 . . . . . 0 N--CA 1.467 0.423 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.12 -31.84 70.44 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 118.657 -0.687 . . . . 0.0 112.378 173.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.49 -48.05 24.36 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 125.34 1.456 . . . . 0.0 112.346 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -55.35 -49.13 73.04 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.543 1.537 . . . . 0.0 109.3 174.069 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.0 mt -63.03 -41.79 99.62 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 118.64 -0.695 . . . . 0.0 111.705 176.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -37.68 77.73 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.96 0.904 . . . . 0.0 113.155 172.101 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 39.3 t60 -70.39 -54.05 14.02 Favored 'General case' 0 C--N 1.334 -0.094 0 C-N-CA 124.941 1.296 . . . . 0.0 110.804 177.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -52.16 -51.09 60.11 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 124.3 1.04 . . . . 0.0 110.72 176.557 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.468 0.474 0 CA-C-O 118.653 -0.689 . . . . 0.0 111.888 177.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 . . . . . 0 CA--C 1.534 0.36 0 CA-C-O 119.535 -0.269 . . . . 0.0 110.288 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.9 -30.45 69.03 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 118.358 -0.83 . . . . 0.0 113.028 176.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.54 -48.75 30.64 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.403 1.481 . . . . 0.0 112.358 176.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.4 -48.1 79.97 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 118.411 0.55 . . . . 0.0 109.733 176.532 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.94 -42.54 94.24 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.429 0.692 . . . . 0.0 111.394 174.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.07 -36.18 76.79 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.724 1.209 . . . . 0.0 113.18 174.16 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 32.9 t60 -75.85 -50.77 14.15 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 123.724 0.809 . . . . 0.0 110.34 177.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.87 -46.89 64.65 Favored 'General case' 0 C--O 1.222 -0.393 0 C-N-CA 124.888 1.275 . . . . 0.0 112.51 175.148 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.538 0.512 0 CA-C-N 119.19 0.905 . . . . 0.0 110.374 176.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 68.9 t80 . . . . . 0 CA--C 1.532 0.263 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.9 -34.32 69.69 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.45 1.1 . . . . 0.0 110.598 177.174 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.25 -49.16 46.02 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 124.789 1.235 . . . . 0.0 111.796 175.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -51.4 -47.38 62.93 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.302 1.041 . . . . 0.0 109.957 172.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.3 mt -66.45 -41.03 89.7 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 178.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.92 -29.03 70.24 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.581 1.152 . . . . 0.0 113.788 172.132 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 57.9 t60 -78.75 -51.52 9.66 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.544 1.538 . . . . 0.0 110.061 177.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -49.92 -48.81 51.53 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 124.29 1.036 . . . . 0.0 110.387 175.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.511 0 CA-C-N 118.405 0.548 . . . . 0.0 111.857 178.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 . . . . . 0 N--CA 1.477 0.897 0 CA-C-O 119.307 -0.378 . . . . 0.0 110.989 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -74.01 -178.87 4.14 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 121.672 1.581 . . . . 0.0 111.593 172.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 12.0 p -129.39 -49.59 1.18 Allowed 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 126.513 1.925 . . . . 0.0 111.748 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -166.84 81.85 0.94 Allowed Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 126.958 2.103 . . . . 0.0 110.137 -179.434 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -71.63 147.69 51.75 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 121.667 1.578 . . . . 0.0 110.326 175.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -169.1 123.61 0.84 Allowed 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 126.005 1.722 . . . . 0.0 108.112 177.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -163.43 141.76 6.2 Favored Pre-proline 0 CA--C 1.542 0.638 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 171.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -81.85 169.73 14.63 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 123.08 2.52 . . . . 0.0 111.772 166.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 73.2 86.5 0.21 Allowed Glycine 0 CA--C 1.528 0.881 0 C-N-CA 125.965 1.745 . . . . 0.0 112.722 176.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -166.52 113.11 0.84 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.616 1.166 . . . . 0.0 109.066 -176.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.82 73.9 0.59 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.252 1.421 . . . . 0.0 108.794 174.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.88 153.96 87.12 Favored Pre-proline 0 CA--C 1.546 0.805 0 O-C-N 121.253 -0.905 . . . . 0.0 110.116 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -72.86 175.13 10.79 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 121.166 1.244 . . . . 0.0 110.854 172.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 90.23 20.08 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 127.52 2.328 . . . . 0.0 113.672 179.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -106.21 -3.01 21.82 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.205 1.402 . . . . 0.0 114.688 -176.011 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -176.57 -43.58 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 127.569 2.348 . . . . 0.0 109.957 179.172 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 26.1 tp -58.61 -37.84 76.72 Favored 'General case' 0 C--N 1.348 0.51 0 C-N-CA 124.109 0.964 . . . . 0.0 111.647 176.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.61 -41.32 63.59 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 119.892 1.223 . . . . 0.0 111.507 173.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -65.59 -46.77 78.09 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 118.267 0.485 . . . . 0.0 111.208 175.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -62.32 -54.01 46.78 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.151 0.98 . . . . 0.0 112.222 179.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.63 -37.52 70.84 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.373 1.069 . . . . 0.0 110.412 176.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.64 -46.04 60.23 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 124.799 1.24 . . . . 0.0 111.956 177.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.73 -46.89 71.0 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 119.676 1.126 . . . . 0.0 109.358 173.269 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.6 mt -65.57 -47.18 76.7 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 118.855 -0.593 . . . . 0.0 111.182 176.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.97 -31.91 67.35 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 117.968 -1.015 . . . . 0.0 113.593 174.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 36.9 t60 -76.44 -51.21 12.25 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 126.4 1.88 . . . . 0.0 110.497 177.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.95 -47.03 84.1 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 123.822 0.849 . . . . 0.0 110.832 177.265 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -60.06 -49.68 83.12 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.432 0 CA-C-O 117.185 -1.388 . . . . 0.0 110.318 175.414 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -57.48 -26.69 61.64 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 119.65 1.114 . . . . 0.0 113.295 177.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.4 mt -72.19 -64.19 0.99 Allowed 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.052 0.941 . . . . 0.0 110.139 170.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 7.6 mt -55.56 -38.48 49.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.488 0.715 . . . . 0.0 112.33 -178.059 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 27.0 p -51.3 -43.68 61.72 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.761 1.225 . . . . 0.0 111.605 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.3 ttt85 -88.94 19.4 4.14 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 92.7 mm-40 -140.12 -27.71 0.75 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.722 1.609 . . . . 0.0 114.427 -175.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.1 ttt85 -70.81 -137.12 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 126.362 1.865 . . . . 0.0 111.52 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 29.5 p90 -46.69 -32.53 3.62 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 125.37 1.468 . . . . 0.0 112.896 168.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.427 0 O-C-N 119.082 -2.261 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 30.0 p90 . . . . . 0 N--CA 1.484 1.259 0 CA-C-O 118.567 -0.73 . . . . 0.0 110.071 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -72.23 139.78 32.83 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 122.525 2.15 . . . . 0.0 111.146 174.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 36.7 t -61.06 -49.67 76.42 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.102 0.961 . . . . 0.0 111.926 177.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 53.67 79.17 0.36 Allowed Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 126.022 1.729 . . . . 0.0 111.219 -175.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -73.6 59.44 4.07 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 124.386 3.391 . . . . 0.0 111.608 177.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -131.47 97.18 4.17 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 127.162 2.185 . . . . 0.0 108.62 -179.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -153.81 151.23 24.51 Favored Pre-proline 0 CA--C 1.541 0.6 0 C-N-CA 123.347 0.659 . . . . 0.0 109.383 174.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -72.76 169.55 21.72 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.144 2.563 . . . . 0.0 111.594 171.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -55.3 -72.31 0.58 Allowed Glycine 0 CA--C 1.537 1.451 0 C-N-CA 125.063 1.316 . . . . 0.0 113.204 -176.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -118.19 -21.12 8.33 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 172.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 168.69 109.23 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 127.135 2.174 . . . . 0.0 108.897 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 62.55 166.25 0.11 Allowed Pre-proline 0 CA--C 1.558 1.254 0 C-N-CA 124.711 1.204 . . . . 0.0 113.373 -176.323 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -74.01 162.96 37.94 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 121.69 1.594 . . . . 0.0 110.42 170.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 81.32 17.05 0.49 Allowed 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.899 2.08 . . . . 0.0 114.103 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -111.15 -2.34 15.84 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 126.055 1.742 . . . . 0.0 113.786 -177.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -163.56 -43.44 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.008 1.723 . . . . 0.0 110.523 176.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -52.27 -40.22 61.44 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.67 0.788 . . . . 0.0 111.895 178.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.41 -27.14 14.63 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.601 0.76 . . . . 0.0 112.833 176.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.09 -45.19 35.22 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.642 1.577 . . . . 0.0 111.773 172.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 3.9 t80 -63.33 -60.11 3.82 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 124.265 1.026 . . . . 0.0 110.698 176.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.87 -34.01 18.78 Favored 'General case' 0 C--N 1.343 0.314 0 CA-C-O 118.071 -0.966 . . . . 0.0 112.165 177.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.23 -50.43 40.0 Favored 'General case' 0 C--N 1.343 0.283 0 C-N-CA 125.789 1.635 . . . . 0.0 112.21 172.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -49.73 -49.19 49.0 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.931 1.241 . . . . 0.0 111.397 172.225 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.9 mp -63.93 -49.59 71.99 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-O 118.754 -0.641 . . . . 0.0 110.988 177.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.82 -37.96 64.11 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.93 1.292 . . . . 0.0 113.286 175.053 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 20.2 t60 -73.13 -51.91 16.18 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 124.785 1.234 . . . . 0.0 110.881 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -49.82 -60.88 2.49 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 124.54 1.136 . . . . 0.0 110.227 172.084 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -52.17 -39.37 26.92 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 124.173 0.989 . . . . 0.0 111.806 -179.155 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -56.13 -61.37 2.43 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.01 0.823 . . . . 0.0 111.08 175.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.4 mt -80.59 30.95 0.29 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.624 1.57 . . . . 0.0 112.09 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 8.1 mt -139.87 -52.51 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 127.304 2.242 . . . . 0.0 109.65 178.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.1 t -63.39 -35.5 80.6 Favored 'General case' 0 N--CA 1.467 0.425 0 O-C-N 120.696 -1.253 . . . . 0.0 111.459 -176.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.5 mtt85 -80.95 11.05 4.27 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 126.351 1.86 . . . . 0.0 113.905 176.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -143.07 15.78 1.9 Allowed 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.62 1.568 . . . . 0.0 113.001 177.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.6 ttt180 -114.88 -140.48 0.38 Allowed 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.537 1.135 . . . . 0.0 111.21 -177.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 7.9 p90 -41.4 -33.32 0.4 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 127.4 2.28 . . . . 0.0 113.394 170.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.392 0 O-C-N 119.318 -2.114 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.142 0 CA-C-O 116.806 -1.569 . . . . 0.0 112.232 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -74.43 -42.17 0.71 Allowed 'Trans proline' 0 C--O 1.213 -0.771 0 C-N-CA 122.566 2.177 . . . . 0.0 112.884 -176.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 56.2 m 53.2 88.07 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 126.244 1.817 . . . . 0.0 113.357 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.9 mttt -124.26 83.8 56.44 Favored Pre-proline 0 CA--C 1.536 0.416 0 C-N-CA 124.939 1.295 . . . . 0.0 109.494 -177.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -71.88 101.16 1.16 Allowed 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 123.592 2.861 . . . . 0.0 109.899 178.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -55.12 -61.11 2.54 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.245 1.018 . . . . 0.0 111.366 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.9 p-10 -106.04 153.36 40.25 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 124.951 1.3 . . . . 0.0 110.759 176.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -75.49 122.89 7.24 Favored 'Trans proline' 0 N--CA 1.456 -0.689 0 C-N-CA 122.835 2.357 . . . . 0.0 110.685 174.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 149.15 123.22 1.24 Allowed Glycine 0 CA--C 1.525 0.702 0 C-N-CA 125.292 1.425 . . . . 0.0 110.399 -179.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.56 -24.11 65.15 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 177.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -176.7 97.2 0.05 Allowed 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 127.247 2.219 . . . . 0.0 107.096 175.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 59.88 166.6 0.09 OUTLIER Pre-proline 0 CA--C 1.564 1.495 0 C-N-CA 124.221 1.008 . . . . 0.0 113.637 -177.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -78.81 161.32 27.37 Favored 'Trans proline' 0 N--CA 1.457 -0.674 0 C-N-CA 122.111 1.874 . . . . 0.0 111.124 168.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 82.69 23.88 0.17 Allowed 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.916 2.086 . . . . 0.0 113.659 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.59 -2.09 9.99 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.835 1.254 . . . . 0.0 114.254 -176.025 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -173.97 -45.86 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 127.258 2.223 . . . . 0.0 109.123 178.68 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 57.0 tp -57.25 -36.37 70.87 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-O 118.315 -0.85 . . . . 0.0 112.014 178.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -49.4 -43.09 44.13 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 118.679 0.672 . . . . 0.0 110.861 173.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -65.65 -45.68 82.05 Favored 'General case' 0 C--O 1.224 -0.28 0 C-N-CA 124.31 1.044 . . . . 0.0 111.925 177.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -60.89 -58.03 10.17 Favored 'General case' 0 C--O 1.226 -0.137 0 C-N-CA 124.354 1.062 . . . . 0.0 111.841 176.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.61 -35.33 68.15 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.673 1.189 . . . . 0.0 111.368 176.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.18 -49.69 33.6 Favored 'General case' 0 C--O 1.22 -0.464 0 C-N-CA 125.967 1.707 . . . . 0.0 111.456 177.538 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -54.72 -44.01 73.1 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 119.57 1.077 . . . . 0.0 110.17 173.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 mt -67.45 -40.26 85.39 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 118.89 -0.576 . . . . 0.0 111.461 177.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.98 -38.17 87.56 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.762 1.225 . . . . 0.0 113.178 172.665 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 51.7 t60 -71.16 -51.65 23.7 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 125.163 1.385 . . . . 0.0 108.961 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -50.34 -53.25 30.28 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 124.538 1.135 . . . . 0.0 111.569 174.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -53.63 -51.65 41.03 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 118.837 0.744 . . . . 0.0 110.525 178.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.81 -42.14 88.44 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.928 0.891 . . . . 0.0 111.481 177.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.2 mt -64.96 -54.72 26.1 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.726 1.611 . . . . 0.0 111.572 -179.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 43.8 mt -52.37 -51.22 34.29 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.345 0 C-N-CA 124.821 1.248 . . . . 0.0 108.228 175.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 42.4 p -55.83 -38.45 70.03 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.181 0.901 . . . . 0.0 112.365 175.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -72.6 3.74 4.66 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 115.123 1.527 . . . . 0.0 115.123 173.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -151.59 34.73 0.56 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.971 1.708 . . . . 0.0 113.406 -178.331 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -129.73 172.35 11.72 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.055 1.342 . . . . 0.0 109.791 178.237 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 15.1 p90 48.0 26.4 0.97 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.23 1.412 . . . . 0.0 114.475 174.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.487 0 O-C-N 119.229 -2.169 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 . . . . . 0 N--CA 1.469 0.505 0 CA-C-O 117.84 -1.076 . . . . 0.0 110.564 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -72.92 48.99 1.49 Allowed 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 125.05 3.833 . . . . 0.0 112.73 175.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 97.5 p -163.83 88.32 0.54 Allowed 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.891 1.277 . . . . 0.0 110.027 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -140.67 161.92 51.81 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 124.614 1.166 . . . . 0.0 111.175 178.38 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -68.95 -174.68 0.79 Allowed 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 123.032 2.488 . . . . 0.0 111.787 178.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -44.39 126.06 5.04 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.861 0.839 . . . . 0.0 111.442 172.047 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 -106.55 128.4 26.29 Favored Pre-proline 0 CA--C 1.537 0.461 0 CA-C-O 118.102 -0.951 . . . . 0.0 108.826 178.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -73.72 61.57 4.55 Favored 'Trans proline' 0 CA--C 1.544 1.022 0 C-N-CA 124.189 3.259 . . . . 0.0 110.833 174.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -109.06 -109.75 3.31 Favored Glycine 0 C--N 1.343 0.948 0 C-N-CA 126.234 1.874 . . . . 0.0 110.0 174.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 58.1 99.05 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 126.165 1.786 . . . . 0.0 113.486 -175.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -135.89 108.97 7.69 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 -176.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.48 154.13 45.83 Favored Pre-proline 0 CA--C 1.554 1.098 0 O-C-N 121.073 -1.017 . . . . 0.0 111.514 176.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -74.36 63.79 5.41 Favored 'Trans proline' 0 CA--C 1.548 1.178 0 C-N-CA 123.863 3.042 . . . . 0.0 111.994 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -166.61 23.37 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 126.755 2.022 . . . . 0.0 113.017 -176.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -122.23 -132.97 0.29 Allowed 'General case' 0 CA--C 1.544 0.724 0 O-C-N 121.02 -1.05 . . . . 0.0 111.325 -177.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -57.12 -32.14 66.03 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.692 1.197 . . . . 0.0 111.112 175.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -62.02 -46.75 87.79 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 124.707 1.203 . . . . 0.0 112.06 170.658 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.23 -36.12 60.69 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.752 1.16 . . . . 0.0 111.29 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -67.71 -46.04 73.35 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.333 1.053 . . . . 0.0 112.355 172.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -57.5 -53.94 52.48 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.806 1.242 . . . . 0.0 112.177 176.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.62 -32.67 67.45 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 118.488 -0.768 . . . . 0.0 111.49 176.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.82 -50.18 45.43 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 125.431 1.492 . . . . 0.0 111.592 174.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.14 -45.57 75.63 Favored 'General case' 0 N--CA 1.462 0.156 0 C-N-CA 123.753 0.821 . . . . 0.0 110.135 176.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.1 mt -66.39 -40.36 89.62 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 119.14 -0.457 . . . . 0.0 111.702 177.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -39.94 91.68 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.497 1.119 . . . . 0.0 113.03 172.433 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 42.8 t60 -69.53 -50.38 45.56 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 125.136 1.374 . . . . 0.0 110.499 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -50.6 -59.04 4.45 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 124.342 1.057 . . . . 0.0 110.0 173.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -52.6 -46.51 49.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-N 118.444 0.565 . . . . 0.0 111.374 -178.549 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -54.65 -55.25 31.57 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 123.816 0.846 . . . . 0.0 110.361 176.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.8 mt -59.08 -46.13 89.06 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.841 1.656 . . . . 0.0 112.8 179.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 13.2 mm -52.8 -60.07 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 C-N-CA 125.161 1.384 . . . . 0.0 108.661 172.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 26.0 p -57.73 -28.2 63.67 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 119.356 0.98 . . . . 0.0 113.119 175.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -76.37 -1.0 24.69 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 114.992 1.479 . . . . 0.0 114.992 173.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -149.58 20.69 0.92 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.778 1.631 . . . . 0.0 113.737 -176.042 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.48 -3.79 15.86 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.768 1.627 . . . . 0.0 114.489 179.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 14.3 p90 -125.62 13.34 8.08 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.076 1.75 . . . . 0.0 111.193 -177.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.56 0 O-C-N 119.115 -2.241 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.478 0.955 0 CA-C-O 117.417 -1.278 . . . . 0.0 112.632 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -72.53 -54.89 0.12 Allowed 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 122.211 1.941 . . . . 0.0 111.779 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 87.9 p -168.81 167.38 11.11 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 126.899 2.079 . . . . 0.0 109.436 175.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.1 68.99 22.99 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 124.925 1.29 . . . . 0.0 109.506 171.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -71.73 143.64 42.22 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 122.198 1.932 . . . . 0.0 110.503 176.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -118.71 -54.72 2.24 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.441 1.496 . . . . 0.0 111.095 -179.85 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -113.47 152.78 45.61 Favored Pre-proline 0 CA--C 1.546 0.79 0 C-N-CA 125.296 1.438 . . . . 0.0 110.227 177.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -75.03 157.59 42.54 Favored 'Trans proline' 0 N--CA 1.453 -0.875 0 C-N-CA 122.323 2.015 . . . . 0.0 111.378 173.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 146.35 -67.96 0.4 Allowed Glycine 0 C--N 1.34 0.756 0 CA-C-O 118.553 -1.137 . . . . 0.0 110.322 175.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 59.93 104.67 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 127.514 2.326 . . . . 0.0 112.524 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 26.3 t0 56.53 91.28 0.03 OUTLIER 'General case' 0 C--O 1.216 -0.66 0 C-N-CA 125.074 1.349 . . . . 0.0 111.734 -173.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 62.08 159.6 0.12 Allowed Pre-proline 0 CA--C 1.556 1.183 0 C-N-CA 125.187 1.395 . . . . 0.0 114.246 -171.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -78.16 112.54 3.25 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.45 2.1 . . . . 0.0 110.891 178.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 75.49 47.43 0.1 Allowed 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 126.349 1.86 . . . . 0.0 113.236 177.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.1 -9.34 10.54 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 114.733 1.383 . . . . 0.0 114.733 -177.614 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -140.47 -63.53 0.48 Allowed 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 127.625 2.37 . . . . 0.0 108.925 178.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.92 -18.13 30.62 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.704 0.802 . . . . 0.0 112.458 176.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -48.6 -32.12 7.67 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.193 0.997 . . . . 0.0 112.167 175.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -77.11 -40.73 44.77 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.242 1.017 . . . . 0.0 113.215 174.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -61.52 -56.32 21.34 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.826 1.65 . . . . 0.0 111.848 174.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.42 -35.49 70.12 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.055 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.67 -51.18 52.83 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 125.16 1.384 . . . . 0.0 111.82 174.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -50.75 -46.51 59.35 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 119.454 1.025 . . . . 0.0 110.211 174.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.5 mt -67.73 -47.31 69.67 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 118.99 -0.529 . . . . 0.0 111.279 178.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -35.08 68.63 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.029 1.331 . . . . 0.0 113.514 174.568 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -74.54 -52.95 10.43 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 126.033 1.733 . . . . 0.0 110.35 178.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -48.52 -62.51 1.46 Allowed 'General case' 0 C--N 1.344 0.332 0 CA-C-O 117.857 -1.068 . . . . 0.0 109.907 171.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -49.76 -43.81 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 124.511 1.124 . . . . 0.0 111.946 -177.121 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -58.43 -59.65 5.01 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.837 1.255 . . . . 0.0 111.661 175.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.0 mt -76.19 23.99 0.14 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.218 1.807 . . . . 0.0 113.179 176.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 2.2 mm -125.95 -50.71 1.81 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.325 0 C-N-CA 126.805 2.042 . . . . 0.0 108.23 177.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 18.2 p -56.82 -30.31 63.62 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 120.068 1.304 . . . . 0.0 113.228 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.8 mtp85 -81.64 3.89 23.63 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.122 1.369 . . . . 0.0 114.521 174.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -154.58 29.66 0.43 Allowed 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 125.83 1.652 . . . . 0.0 113.425 -177.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -101.05 -2.29 31.97 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 120.434 -1.416 . . . . 0.0 113.769 -178.248 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -123.65 21.73 9.21 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 128.084 2.553 . . . . 0.0 111.086 -174.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.513 0 O-C-N 118.686 -2.509 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 117.33 -1.319 . . . . 0.0 110.241 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -69.92 148.23 63.58 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 121.158 1.239 . . . . 0.0 109.616 -174.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 16.4 m -145.13 -55.52 0.32 Allowed 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 124.377 1.071 . . . . 0.0 109.465 177.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt 51.36 72.1 1.32 Allowed Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 126.422 1.889 . . . . 0.0 111.24 -172.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -67.68 163.65 34.35 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 121.786 1.657 . . . . 0.0 110.913 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -118.6 164.48 15.25 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.071 1.348 . . . . 0.0 109.637 174.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -177.54 133.91 0.36 Allowed Pre-proline 0 CA--C 1.538 0.493 0 C-N-CA 126.659 1.984 . . . . 0.0 108.0 175.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -71.73 -176.02 1.86 Allowed 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.939 2.426 . . . . 0.0 111.352 169.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -65.99 -96.33 0.03 OUTLIER Glycine 0 CA--C 1.529 0.922 0 CA-C-O 118.814 -0.992 . . . . 0.0 112.424 176.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 159.3 -37.47 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 128.431 2.692 . . . . 0.0 111.829 178.025 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -173.2 -57.16 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 126.027 1.731 . . . . 0.0 108.189 -179.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 65.08 66.72 0.86 Allowed Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 128.07 2.548 . . . . 0.0 112.7 -170.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -75.66 98.78 1.21 Allowed 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 122.702 2.268 . . . . 0.0 111.143 -173.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.66 40.93 0.09 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.016 1.726 . . . . 0.0 112.561 179.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -125.26 -5.96 7.17 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.054 1.742 . . . . 0.0 113.062 -177.822 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -156.23 -46.01 0.07 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.438 2.295 . . . . 0.0 110.564 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.16 -27.93 23.71 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.547 0.739 . . . . 0.0 111.781 175.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -50.77 -39.3 52.1 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.038 0.835 . . . . 0.0 110.846 178.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.5 tm0? -67.28 -49.1 65.62 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.306 1.042 . . . . 0.0 111.63 174.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -56.52 -53.21 60.21 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.972 1.309 . . . . 0.0 111.828 178.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.2 -32.1 66.13 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.475 1.11 . . . . 0.0 111.168 175.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.42 -48.13 43.67 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 125.125 1.37 . . . . 0.0 111.533 175.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -54.83 -47.68 73.8 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 124.029 0.932 . . . . 0.0 109.716 175.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mt -65.93 -39.6 90.64 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 177.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.35 -43.91 96.06 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.457 1.103 . . . . 0.0 112.304 172.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 54.9 t60 -65.43 -50.9 63.69 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.81 1.244 . . . . 0.0 110.513 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -50.91 -57.26 8.96 Favored 'General case' 0 C--N 1.344 0.347 0 C-N-CA 124.386 1.074 . . . . 0.0 110.731 172.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -52.8 -50.16 43.86 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 CA-C-N 118.867 0.758 . . . . 0.0 110.881 178.358 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.06 -36.93 71.11 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.147 0.885 . . . . 0.0 112.715 177.111 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.1 mt -72.7 -29.43 63.37 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.584 1.154 . . . . 0.0 113.754 174.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 29.2 mm -82.16 -42.27 18.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 C-N-CA 125.341 1.456 . . . . 0.0 110.882 177.421 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 59.7 p -49.33 -51.44 34.37 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.915 1.286 . . . . 0.0 111.154 179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -84.87 25.97 0.88 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.103 1.361 . . . . 0.0 113.215 175.09 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -157.94 32.08 0.26 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.027 1.331 . . . . 0.0 111.64 -178.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.6 ttt180 -142.52 163.36 33.05 Favored 'General case' 0 C--O 1.235 0.331 0 O-C-N 120.667 -1.271 . . . . 0.0 109.017 178.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 39.4 p90 48.27 20.6 0.29 Allowed 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 126.148 1.779 . . . . 0.0 114.114 177.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.468 0 O-C-N 118.025 -2.922 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.481 1.097 0 CA-C-O 117.137 -1.411 . . . . 0.0 111.911 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -72.34 171.8 16.23 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.0 1.8 . . . . 0.0 110.467 177.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -159.93 -178.49 7.07 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 124.578 1.151 . . . . 0.0 109.415 175.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.8 74.25 0.51 Allowed Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 125.373 1.469 . . . . 0.0 110.798 -178.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -71.05 174.88 9.95 Favored 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 121.988 1.792 . . . . 0.0 111.213 175.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -133.38 -60.79 0.83 Allowed 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 126.519 1.927 . . . . 0.0 109.21 -175.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 5.9 m120 51.58 82.99 0.23 Allowed Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 126.431 1.892 . . . . 0.0 111.255 -177.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -66.93 171.75 10.7 Favored 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 122.129 1.886 . . . . 0.0 111.015 -178.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -93.66 -130.06 5.53 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.371 -1.091 . . . . 0.0 110.371 175.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -167.52 106.37 0.55 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.882 1.673 . . . . 0.0 108.386 -179.05 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 167.04 91.53 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 127.517 2.327 . . . . 0.0 108.518 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.44 157.79 87.42 Favored Pre-proline 0 CA--C 1.548 0.882 0 O-C-N 121.456 -0.778 . . . . 0.0 111.25 173.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -75.32 169.05 23.3 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.564 2.176 . . . . 0.0 112.578 175.055 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -155.07 29.88 0.4 Allowed 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.85 1.26 . . . . 0.0 112.284 -178.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -123.18 -150.55 0.45 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.777 1.231 . . . . 0.0 109.225 -178.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -73.79 -45.0 54.3 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.224 1.009 . . . . 0.0 110.489 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -50.41 -25.05 3.48 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.152 1.381 . . . . 0.0 112.9 179.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -66.29 -52.74 44.38 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 126.23 1.812 . . . . 0.0 109.96 176.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.34 -28.25 63.94 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.467 0.707 . . . . 0.0 112.693 176.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -53.14 -51.93 60.38 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.401 1.08 . . . . 0.0 110.133 170.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.77 -29.01 67.89 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 118.708 -0.663 . . . . 0.0 112.386 176.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.55 -49.61 21.22 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.742 1.617 . . . . 0.0 111.735 177.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -58.67 -46.06 88.05 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.224 0.61 . . . . 0.0 109.976 176.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.1 mt -62.27 -39.72 93.87 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 118.713 -0.66 . . . . 0.0 111.682 174.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.87 -34.57 76.24 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.789 1.235 . . . . 0.0 113.123 173.144 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 45.7 t60 -78.82 -53.12 7.43 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 118.706 -0.664 . . . . 0.0 110.172 178.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -46.69 -43.77 18.09 Favored 'General case' 0 C--O 1.214 -0.796 0 C-N-CA 124.679 1.192 . . . . 0.0 111.228 171.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -57.57 -56.84 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 CA-C-N 119.607 1.094 . . . . 0.0 111.001 175.637 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -66.11 -26.38 67.43 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.857 1.263 . . . . 0.0 113.15 -177.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.5 mt -78.49 -55.66 5.04 Favored 'General case' 0 CA--C 1.527 0.074 0 C-N-CA 124.641 1.176 . . . . 0.0 111.208 174.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 5.8 mm -56.26 -44.96 80.93 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.552 0 C-N-CA 125.442 1.497 . . . . 0.0 109.818 177.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 15.3 p -47.85 -48.0 31.19 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 119.482 1.037 . . . . 0.0 111.249 176.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.56 24.66 1.9 Allowed 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 177.603 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -162.73 37.36 0.11 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.23 1.412 . . . . 0.0 113.469 -175.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -141.6 -173.11 3.69 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.437 1.495 . . . . 0.0 109.59 178.666 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 28.0 p90 50.78 17.7 0.43 Allowed 'General case' 0 CA--C 1.56 1.359 0 C-N-CA 126.87 2.068 . . . . 0.0 115.243 173.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.563 0 O-C-N 119.328 -2.108 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 . . . . . 0 N--CA 1.486 1.34 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -76.53 -61.22 0.04 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 123.826 3.017 . . . . 0.0 111.052 175.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 8.5 t -162.39 -55.56 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.367 0.667 . . . . 0.0 111.723 178.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.5 mtpm? -64.13 156.16 75.94 Favored Pre-proline 0 CA--C 1.542 0.66 0 C-N-CA 123.856 0.863 . . . . 0.0 111.273 176.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -75.67 81.27 2.38 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.993 2.462 . . . . 0.0 110.722 176.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -112.16 136.95 50.91 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.93 1.292 . . . . 0.0 110.559 173.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -143.15 156.3 61.49 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 124.133 0.973 . . . . 0.0 109.219 176.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -72.83 145.11 40.1 Favored 'Trans proline' 0 N--CA 1.442 -1.529 0 C-N-CA 122.752 2.301 . . . . 0.0 111.262 171.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -169.82 -73.64 0.04 OUTLIER Glycine 0 CA--C 1.525 0.715 0 N-CA-C 109.849 -1.3 . . . . 0.0 109.849 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 58.71 96.58 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.512 1.525 . . . . 0.0 112.783 -175.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -125.5 -63.85 1.11 Allowed 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 124.258 1.023 . . . . 0.0 108.627 178.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 67.38 155.28 0.14 Allowed Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 126.849 2.059 . . . . 0.0 112.404 -171.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -73.29 142.88 34.35 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 C-N-CA 121.51 1.473 . . . . 0.0 109.808 175.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 82.49 15.86 0.4 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.403 1.881 . . . . 0.0 113.952 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -114.43 -2.91 13.1 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.715 1.206 . . . . 0.0 113.978 -173.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -167.22 -40.93 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 127.444 2.298 . . . . 0.0 111.141 -179.402 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.463 ' C ' ' H ' ' A' ' 19' ' ' GLN . 3.4 tm? -54.72 -35.85 64.11 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.283 -0.885 . . . . 0.0 112.033 178.028 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.4 32.84 0.02 OUTLIER 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 127.82 2.448 . . . . 0.0 113.573 174.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.463 ' H ' ' C ' ' A' ' 17' ' ' LEU . 3.1 tt0 -154.99 -36.95 0.09 Allowed 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 127.525 2.33 . . . . 0.0 111.547 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -56.37 -54.77 41.61 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 123.892 0.877 . . . . 0.0 111.301 178.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.78 -29.07 69.21 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 176.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.02 -49.47 19.7 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.834 1.654 . . . . 0.0 112.037 177.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -54.66 -48.43 72.35 Favored 'General case' 0 CA--C 1.528 0.105 0 C-N-CA 124.717 1.207 . . . . 0.0 109.17 175.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.1 mt -64.01 -38.83 92.5 Favored 'General case' 0 C--N 1.347 0.478 0 CA-C-O 119.021 -0.514 . . . . 0.0 111.673 177.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.54 -37.48 86.27 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.414 1.086 . . . . 0.0 113.138 172.184 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 35.9 t60 -71.7 -52.05 19.8 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.197 1.399 . . . . 0.0 110.291 178.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.49 -52.04 56.42 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 124.605 1.162 . . . . 0.0 111.039 174.523 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -55.99 -44.79 79.43 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.525 0 CA-C-N 118.638 0.654 . . . . 0.0 111.43 176.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -63.43 -29.62 70.88 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 118.64 0.654 . . . . 0.0 112.386 177.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.3 mt -75.36 -50.95 14.35 Favored 'General case' 0 CA--C 1.527 0.096 0 C-N-CA 124.379 1.072 . . . . 0.0 111.656 174.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.2 mp -64.19 -48.85 83.84 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.607 0 C-N-CA 124.893 1.277 . . . . 0.0 109.355 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -54.41 -36.15 63.66 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 120.007 1.276 . . . . 0.0 111.649 176.048 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 4.0 ttp180 -79.51 5.67 12.32 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 114.438 1.274 . . . . 0.0 114.438 176.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 46.0 tp60 -161.69 54.08 0.25 Allowed 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 127.141 2.176 . . . . 0.0 112.28 -178.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -147.63 176.24 10.24 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.108 0.963 . . . . 0.0 108.821 174.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 22.3 p90 48.19 25.01 0.75 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.39 1.476 . . . . 0.0 113.919 176.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.802 0 O-C-N 118.84 -2.412 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 20.4 p90 . . . . . 0 N--CA 1.482 1.174 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -74.82 163.99 34.48 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 121.65 1.567 . . . . 0.0 111.349 176.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 7.5 t -166.93 95.64 0.5 Allowed 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 124.548 1.139 . . . . 0.0 110.015 178.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.0 mmtt 175.52 -60.28 0.0 OUTLIER Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 126.933 2.093 . . . . 0.0 111.487 -177.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -73.07 151.54 49.98 Favored 'Trans proline' 0 N--CA 1.452 -0.924 0 C-N-CA 122.606 2.204 . . . . 0.0 110.614 175.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -160.15 162.52 33.94 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.349 1.859 . . . . 0.0 108.81 176.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -58.25 154.96 28.7 Favored Pre-proline 0 CA--C 1.546 0.81 0 C-N-CA 123.497 0.719 . . . . 0.0 112.184 173.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -72.75 103.46 1.57 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 122.28 1.987 . . . . 0.0 110.561 176.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 157.47 -79.07 0.18 Allowed Glycine 0 CA--C 1.525 0.709 0 C-N-CA 124.743 1.163 . . . . 0.0 111.91 177.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -169.54 -39.82 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.364 1.065 . . . . 0.0 113.059 176.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 28.3 t0 -174.54 98.3 0.09 Allowed 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 127.182 2.193 . . . . 0.0 107.595 174.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 46.2 64.53 8.0 Favored Pre-proline 0 CA--C 1.565 1.52 0 N-CA-C 114.541 1.311 . . . . 0.0 114.541 175.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -66.26 110.53 1.8 Allowed 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.067 2.511 . . . . 0.0 110.569 -171.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 68.69 33.05 3.94 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.344 1.457 . . . . 0.0 112.899 -176.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -121.98 -139.9 0.32 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.286 1.434 . . . . 0.0 110.568 -179.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -59.92 -16.52 30.29 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.874 1.27 . . . . 0.0 112.309 -178.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.479 ' C ' ' H ' ' A' ' 19' ' ' GLN . 61.1 tp -55.65 -25.44 39.26 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 126.149 1.779 . . . . 0.0 112.807 169.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.43 30.4 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 126.716 2.006 . . . . 0.0 113.798 171.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.479 ' H ' ' C ' ' A' ' 17' ' ' LEU . 19.0 tp60 -149.41 -39.58 0.15 Allowed 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 126.952 2.101 . . . . 0.0 111.106 175.323 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 69.4 t80 -56.18 -55.41 33.41 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.603 1.161 . . . . 0.0 110.677 -179.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.78 -31.17 69.43 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.832 177.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.49 -48.16 35.59 Favored 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 126.631 1.972 . . . . 0.0 111.953 178.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.04 -47.0 78.68 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 125.145 1.378 . . . . 0.0 109.998 174.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.3 mt -65.3 -39.65 92.8 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.397 0.279 . . . . 0.0 111.556 176.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.02 -41.6 96.86 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.125 1.37 . . . . 0.0 113.379 172.226 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 44.5 t60 -69.8 -48.51 58.84 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 124.776 1.23 . . . . 0.0 110.493 178.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.47 -55.33 19.43 Favored 'General case' 0 C--O 1.223 -0.322 0 C-N-CA 124.016 0.926 . . . . 0.0 110.717 171.406 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -55.99 -42.81 73.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 CA-C-N 119.272 0.942 . . . . 0.0 111.34 179.254 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -61.71 -31.4 71.55 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 176.111 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.6 mt -75.62 -54.27 7.25 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 125.161 1.384 . . . . 0.0 110.663 173.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 20.0 mt -58.11 -48.39 84.56 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.447 0 C-N-CA 125.303 1.441 . . . . 0.0 110.194 -179.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -54.77 -30.61 57.13 Favored 'General case' 0 N--CA 1.48 1.042 0 O-C-N 120.812 -1.18 . . . . 0.0 112.155 176.219 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.9 -0.03 37.34 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 176.606 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -159.8 45.68 0.24 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.905 2.082 . . . . 0.0 113.245 -176.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -145.87 -179.05 6.44 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 120.747 -1.221 . . . . 0.0 109.513 177.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 25.7 p90 49.08 17.09 0.15 Allowed 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 127.275 2.23 . . . . 0.0 115.478 175.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.546 0 O-C-N 118.705 -2.497 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . 0.447 ' H3 ' ' HD3' ' A' ' 2' ' ' PRO . 23.3 m-85 . . . . . 0 N--CA 1.481 1.115 0 CA-C-O 119.363 -0.351 . . . . 0.0 110.96 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.447 ' HD3' ' H3 ' ' A' ' 1' ' ' TYR . 33.3 Cg_endo -75.2 -60.36 0.04 OUTLIER 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 121.684 1.589 . . . . 0.0 111.551 177.72 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 52.2 p -175.79 58.96 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.063 1.345 . . . . 0.0 110.48 -177.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.7 pttt -149.95 84.24 5.93 Favored Pre-proline 0 CA--C 1.543 0.697 0 C-N-CA 124.885 1.274 . . . . 0.0 109.778 -179.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -66.28 155.76 68.36 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 121.15 1.233 . . . . 0.0 110.227 176.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -59.2 169.23 1.17 Allowed 'General case' 0 C--O 1.237 0.404 0 CA-C-O 122.12 0.962 . . . . 0.0 111.856 174.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -113.74 98.25 46.75 Favored Pre-proline 0 CA--C 1.537 0.452 0 C-N-CA 123.851 0.86 . . . . 0.0 109.544 177.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -74.08 54.88 3.3 Favored 'Trans proline' 0 CA--C 1.551 1.345 0 C-N-CA 123.66 2.907 . . . . 0.0 111.724 174.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 111.73 -78.12 0.24 Allowed Glycine 0 N--CA 1.47 0.92 0 C-N-CA 125.444 1.497 . . . . 0.0 111.419 -179.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -138.93 6.2 2.4 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -85.37 69.11 10.67 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.569 1.548 . . . . 0.0 109.837 177.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -155.41 159.17 31.92 Favored Pre-proline 0 CA--C 1.538 0.508 0 O-C-N 120.967 -1.083 . . . . 0.0 111.824 173.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -71.85 161.24 45.6 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 121.586 1.524 . . . . 0.0 110.947 171.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 77.0 28.34 0.65 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.098 1.759 . . . . 0.0 113.478 179.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -118.42 -6.25 10.77 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.105 1.362 . . . . 0.0 114.065 -177.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -163.99 -43.46 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.957 2.103 . . . . 0.0 110.57 -178.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -51.68 -43.53 62.77 Favored 'General case' 0 C--O 1.222 -0.38 0 C-N-CA 123.322 0.649 . . . . 0.0 110.825 178.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -48.93 -45.55 41.82 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 118.612 -0.709 . . . . 0.0 112.4 175.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -60.63 -40.34 91.56 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.774 0.829 . . . . 0.0 111.832 175.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -62.88 -52.28 63.72 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.007 1.723 . . . . 0.0 111.641 174.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.88 -33.6 74.51 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.295 1.038 . . . . 0.0 111.035 176.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.39 -49.52 33.28 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 126.643 1.977 . . . . 0.0 111.359 176.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.7 -49.93 69.5 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 119.674 1.125 . . . . 0.0 109.503 174.434 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.2 mt -63.18 -39.48 94.77 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 118.487 -0.768 . . . . 0.0 112.44 177.29 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -50.07 75.14 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 119.169 0.895 . . . . 0.0 112.066 171.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 26.2 t60 -58.55 -46.89 85.91 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.161 0.984 . . . . 0.0 110.015 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -70.88 19.79 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.716 1.606 . . . . 0.0 115.019 176.133 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -144.65 -48.99 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 125.707 1.603 . . . . 0.0 110.387 -179.155 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -68.17 -23.36 64.85 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.501 1.52 . . . . 0.0 111.626 176.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.4 mt -79.12 -47.98 15.12 Favored 'General case' 0 C--N 1.344 0.328 0 CA-C-N 118.797 0.726 . . . . 0.0 111.041 171.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.3 mm -63.71 -42.38 95.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 C-N-CA 122.985 0.514 . . . . 0.0 110.701 -176.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -54.78 -38.05 66.78 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.32 -0.863 . . . . 0.0 111.972 174.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.35 18.78 1.35 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.616 1.966 . . . . 0.0 113.689 176.049 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -142.89 -39.74 0.33 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.991 0.916 . . . . 0.0 113.386 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.76 -144.51 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.474 1.91 . . . . 0.0 111.29 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 25.8 p90 -40.48 -33.83 0.3 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.984 1.314 . . . . 0.0 114.207 171.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.388 0 O-C-N 119.439 -2.038 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.483 1.214 0 CA-C-O 117.072 -1.442 . . . . 0.0 111.451 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -72.98 -40.49 1.76 Allowed 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 122.283 1.988 . . . . 0.0 112.27 -177.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.2 p -132.34 80.19 1.89 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.886 1.675 . . . . 0.0 109.078 177.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.3 pttm -57.73 150.65 46.28 Favored Pre-proline 0 CA--C 1.543 0.682 0 O-C-N 121.599 -0.688 . . . . 0.0 111.01 176.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -71.42 -31.95 13.16 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 122.123 1.882 . . . . 0.0 113.001 -178.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 67.52 -62.8 0.32 Allowed 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 126.751 2.02 . . . . 0.0 111.691 -178.244 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 26.5 m-20 -77.39 132.99 68.36 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 124.748 1.219 . . . . 0.0 110.999 172.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -70.38 -178.87 2.8 Favored 'Trans proline' 0 CA--C 1.547 1.148 0 C-N-CA 123.35 2.7 . . . . 0.0 111.426 170.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -39.86 -64.22 1.11 Allowed Glycine 0 N--CA 1.475 1.282 0 C-N-CA 125.344 1.449 . . . . 0.0 112.857 177.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.4 mp0 -136.08 -59.27 0.75 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.714 1.206 . . . . 0.0 111.955 174.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -159.63 78.87 0.71 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.522 1.129 . . . . 0.0 111.553 178.16 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 59.8 164.62 0.09 OUTLIER Pre-proline 0 CA--C 1.561 1.387 0 C-N-CA 125.769 1.627 . . . . 0.0 113.409 -173.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -78.5 57.08 6.14 Favored 'Trans proline' 0 CA--C 1.55 1.283 0 C-N-CA 123.136 2.557 . . . . 0.0 112.294 177.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -173.91 26.17 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.349 1.46 . . . . 0.0 114.441 -176.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -166.93 156.0 10.5 Favored 'General case' 0 N--CA 1.461 0.088 0 N-CA-C 106.56 -1.644 . . . . 0.0 106.56 -179.199 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.0 t70 65.89 -57.6 0.34 Allowed 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 129.559 3.144 . . . . 0.0 112.135 -176.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.5 tt -58.32 -46.75 85.58 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 125.678 1.591 . . . . 0.0 110.107 172.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.2 -38.08 65.26 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 119.389 0.995 . . . . 0.0 110.252 -177.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.83 -50.34 64.95 Favored 'General case' 0 C--O 1.221 -0.442 0 C-N-CA 124.408 1.083 . . . . 0.0 111.25 172.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 91.5 t80 -57.0 -60.23 3.9 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 124.666 1.187 . . . . 0.0 111.934 178.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.72 -36.02 66.76 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.077 1.351 . . . . 0.0 111.012 177.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.08 -49.19 38.36 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 124.471 1.108 . . . . 0.0 111.912 176.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -51.28 -47.2 62.6 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 125.207 1.403 . . . . 0.0 109.192 173.194 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.1 mt -67.33 -43.58 81.21 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.185 177.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.43 -34.2 72.2 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 172.767 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 41.5 t60 -75.24 -52.72 10.21 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 125.792 1.637 . . . . 0.0 110.139 178.418 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -51.18 -52.81 40.74 Favored 'General case' 0 C--O 1.221 -0.431 0 C-N-CA 124.189 0.996 . . . . 0.0 111.702 172.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -57.51 -44.44 84.85 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.353 0 CA-C-O 118.64 -0.695 . . . . 0.0 110.727 178.498 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.14 -34.3 73.35 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 118.544 0.611 . . . . 0.0 112.018 176.441 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.98 -60.9 2.02 Favored 'General case' 0 C--O 1.215 -0.732 0 C-N-CA 124.249 1.02 . . . . 0.0 110.845 174.568 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 35.0 mm -54.0 -45.02 64.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 C-N-CA 124.625 1.17 . . . . 0.0 110.387 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.8 t -65.16 -40.72 94.71 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 120.417 -1.427 . . . . 0.0 112.574 176.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -85.23 13.23 6.65 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.222 1.409 . . . . 0.0 112.515 176.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.66 39.11 1.04 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.176 1.39 . . . . 0.0 110.514 -179.405 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -156.77 -141.86 0.1 Allowed 'General case' 0 N--CA 1.464 0.231 0 O-C-N 121.217 -0.927 . . . . 0.0 111.018 177.456 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 36.4 p90 -39.36 -38.07 0.51 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 127.527 2.331 . . . . 0.0 113.26 168.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.17 0 O-C-N 119.203 -2.185 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . 0.568 ' H2 ' ' HD3' ' A' ' 2' ' ' PRO . 5.2 p90 . . . . . 0 CA--C 1.548 0.878 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.568 ' HD3' ' H2 ' ' A' ' 1' ' ' TYR . 48.6 Cg_endo -71.02 102.99 1.31 Allowed 'Trans proline' 0 C--N 1.353 0.777 0 C-N-CA 122.789 2.326 . . . . 0.0 110.561 -179.358 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -167.16 -55.49 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.144 0.978 . . . . 0.0 110.723 176.057 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 37.92 64.01 3.36 Favored Pre-proline 0 CA--C 1.551 0.992 0 C-N-CA 126.849 2.06 . . . . 0.0 112.163 -174.217 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -67.82 -54.3 0.35 Allowed 'Trans proline' 0 N--CA 1.441 -1.571 0 C-N-CA 122.459 2.106 . . . . 0.0 110.213 -172.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 45.44 83.93 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.097 1.759 . . . . 0.0 110.702 -178.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -102.78 92.77 3.73 Favored Pre-proline 0 CA--C 1.544 0.736 0 O-C-N 121.74 -0.6 . . . . 0.0 110.406 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -71.28 178.7 5.2 Favored 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 123.092 2.528 . . . . 0.0 111.769 177.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -85.32 36.14 3.1 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 124.203 0.906 . . . . 0.0 113.873 177.333 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -99.5 -6.99 26.59 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.305 1.042 . . . . 0.0 112.929 -178.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -143.65 93.9 2.53 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.75 2.02 . . . . 0.0 107.613 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 55.79 86.32 0.17 Allowed Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 125.348 1.459 . . . . 0.0 113.637 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -72.16 67.77 3.36 Favored 'Trans proline' 0 CA--C 1.546 1.083 0 C-N-CA 124.155 3.237 . . . . 0.0 112.801 -177.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -171.38 39.32 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 126.847 2.059 . . . . 0.0 111.312 -174.402 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -117.64 -137.33 0.35 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.976 0.91 . . . . 0.0 109.366 179.373 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -54.58 -37.99 66.17 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.828 1.251 . . . . 0.0 111.345 -178.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -48.71 -30.98 6.15 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.78 1.632 . . . . 0.0 112.963 172.55 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.05 -42.99 99.83 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.693 0.797 . . . . 0.0 110.803 177.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -78.44 -29.04 46.79 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 123.4 0.68 . . . . 0.0 111.566 173.56 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 12.7 m-30 -62.25 -50.17 72.81 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 119.363 0.983 . . . . 0.0 110.27 178.671 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.67 -34.22 64.8 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 118.382 -0.818 . . . . 0.0 111.707 173.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.58 -48.46 32.61 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.138 1.375 . . . . 0.0 112.081 177.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.53 -49.08 65.55 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.947 0.899 . . . . 0.0 110.534 172.544 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.4 mt -61.89 -49.03 77.83 Favored 'General case' 0 C--N 1.346 0.434 0 CA-C-O 118.916 -0.564 . . . . 0.0 110.923 175.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.1 -30.32 61.89 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 174.344 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 40.3 t60 -79.41 -53.48 6.87 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 124.836 1.255 . . . . 0.0 110.756 177.326 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -51.72 -50.08 61.24 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 124.434 1.094 . . . . 0.0 110.448 175.661 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -55.68 -45.77 79.26 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.413 0 CA-C-N 118.766 0.712 . . . . 0.0 111.564 177.061 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -68.53 -23.98 64.59 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 178.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.7 mt -75.87 -52.35 10.54 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.36 1.464 . . . . 0.0 110.868 171.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.9 mp -64.15 -47.19 91.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 124.408 1.083 . . . . 0.0 111.344 177.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.7 t -54.13 -42.73 69.84 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 119.896 1.226 . . . . 0.0 110.935 -179.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -88.56 27.13 1.33 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.75 1.22 . . . . 0.0 112.948 179.162 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -145.61 -41.54 0.22 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.729 1.611 . . . . 0.0 113.816 -178.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -69.62 -152.83 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.655 1.582 . . . . 0.0 109.64 174.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -11.68 80.7 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 128.826 2.851 . . . . 0.0 116.33 173.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.508 0 O-C-N 118.29 -2.756 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.479 0.997 0 CA-C-O 116.846 -1.55 . . . . 0.0 112.086 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -72.49 -61.92 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 122.227 1.951 . . . . 0.0 111.229 -176.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.2 t -170.52 -82.45 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 125.379 1.471 . . . . 0.0 108.678 178.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.47 160.05 30.99 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 125.931 1.693 . . . . 0.0 110.357 178.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -77.82 107.96 2.45 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 124.5 3.467 . . . . 0.0 111.216 177.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -178.26 160.0 1.3 Allowed 'General case' 0 C--O 1.239 0.501 0 C-N-CA 126.65 1.98 . . . . 0.0 108.597 176.089 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -174.48 90.32 0.32 Allowed Pre-proline 0 N--CA 1.468 0.453 0 C-N-CA 124.823 1.249 . . . . 0.0 109.308 174.2 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -71.27 172.34 14.27 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 121.913 1.742 . . . . 0.0 111.507 175.532 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.45 -119.3 4.37 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 110.662 -0.975 . . . . 0.0 110.662 176.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -178.79 -48.16 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 126.919 2.088 . . . . 0.0 110.46 179.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.95 107.6 0.36 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.075 1.75 . . . . 0.0 109.465 -179.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -161.9 76.27 2.23 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 123.98 0.912 . . . . 0.0 111.278 174.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -74.88 46.9 1.59 Allowed 'Trans proline' 0 CA--C 1.548 1.218 0 C-N-CA 123.432 2.755 . . . . 0.0 113.794 -178.348 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -174.75 122.65 0.25 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.92 1.688 . . . . 0.0 109.025 -176.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 67.09 143.26 0.03 OUTLIER 'General case' 0 C--N 1.346 0.434 0 C-N-CA 126.539 1.936 . . . . 0.0 110.407 -173.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.9 t70 74.35 -47.45 0.64 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.266 1.826 . . . . 0.0 111.233 179.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 59.2 tp -55.64 -41.33 73.41 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 125.14 1.376 . . . . 0.0 111.441 175.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.58 -41.59 63.74 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 119.206 0.912 . . . . 0.0 110.371 174.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.6 -45.71 74.71 Favored 'General case' 0 C--O 1.221 -0.417 0 C-N-CA 123.773 0.829 . . . . 0.0 111.693 176.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -61.29 -59.16 5.72 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.272 1.029 . . . . 0.0 111.444 177.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.64 -36.15 66.72 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 125.163 1.385 . . . . 0.0 110.96 176.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.4 -47.1 51.9 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-O 117.785 -1.102 . . . . 0.0 112.13 176.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -54.54 -46.92 73.69 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 119.758 1.163 . . . . 0.0 109.312 173.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.3 mt -65.48 -42.49 92.16 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 118.855 -0.593 . . . . 0.0 111.041 177.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.06 -44.12 91.79 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.109 0.963 . . . . 0.0 112.406 173.292 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 41.2 t60 -66.7 -52.57 43.08 Favored 'General case' 0 C--O 1.231 0.103 0 C-N-CA 125.576 1.551 . . . . 0.0 109.952 -179.201 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -50.16 -56.71 9.86 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-O 118.156 -0.926 . . . . 0.0 110.946 171.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -53.74 -48.1 61.42 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 CA-C-N 119.167 0.894 . . . . 0.0 110.293 -179.227 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -55.41 -35.2 65.11 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.334 1.054 . . . . 0.0 112.574 178.056 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 70.4 mt -77.05 -54.17 6.88 Favored 'General case' 0 C--O 1.22 -0.461 0 C-N-CA 124.443 1.097 . . . . 0.0 111.01 175.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 21.3 mt -49.85 -41.32 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 125.946 1.698 . . . . 0.0 109.411 176.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 36.5 p -63.45 -35.83 81.73 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 120.805 -1.185 . . . . 0.0 112.699 175.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 13.8 ttt180 -79.85 9.86 4.8 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.952 1.701 . . . . 0.0 114.3 174.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -142.82 26.98 1.68 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.965 1.306 . . . . 0.0 112.445 177.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 18.6 ttt180 -128.19 -142.12 0.26 Allowed 'General case' 0 C--N 1.349 0.546 0 C-N-CA 124.159 0.984 . . . . 0.0 111.054 -179.338 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 37.4 p90 -43.37 -32.32 0.81 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 127.753 2.421 . . . . 0.0 114.191 171.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.458 0 O-C-N 120.152 -1.592 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 118.42 -0.8 . . . . 0.0 109.325 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -77.22 -58.37 0.04 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 122.731 2.288 . . . . 0.0 111.597 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -159.33 -51.98 0.06 Allowed 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.966 0.906 . . . . 0.0 110.96 174.363 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 30.73 83.24 0.2 Allowed Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 128.233 2.613 . . . . 0.0 111.802 -176.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -75.68 60.95 6.08 Favored 'Trans proline' 0 CA--C 1.542 0.92 0 C-N-CA 122.916 2.411 . . . . 0.0 111.318 -177.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -123.14 171.2 9.49 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 128.376 2.67 . . . . 0.0 109.071 179.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -50.38 128.84 24.68 Favored Pre-proline 0 CA--C 1.551 0.992 0 C-N-CA 123.611 0.764 . . . . 0.0 111.66 -179.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -68.53 130.86 21.74 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 121.768 1.646 . . . . 0.0 110.068 179.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -126.45 -138.55 4.85 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 125.411 1.482 . . . . 0.0 109.563 176.152 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -160.94 -48.78 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.762 1.225 . . . . 0.0 111.237 177.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -121.36 -64.51 1.22 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.999 1.719 . . . . 0.0 108.799 177.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -137.96 173.04 5.78 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 125.397 1.479 . . . . 0.0 111.879 -176.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -74.82 144.82 31.4 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 122.416 2.077 . . . . 0.0 110.528 170.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 78.12 46.79 0.05 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.938 1.695 . . . . 0.0 113.383 177.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -122.92 -5.34 8.52 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 114.982 1.475 . . . . 0.0 114.982 -176.045 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -138.05 -75.02 0.4 Allowed 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 126.835 2.054 . . . . 0.0 108.972 177.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -51.75 -26.05 8.74 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.256 1.422 . . . . 0.0 113.184 -177.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.23 -58.43 8.32 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 126.288 1.835 . . . . 0.0 110.51 172.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.54 -29.97 70.18 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 123.498 0.719 . . . . 0.0 112.247 177.161 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -53.7 -49.43 68.08 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.715 0.806 . . . . 0.0 110.467 171.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.56 -29.62 70.71 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 175.532 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -76.49 -47.44 22.83 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.445 1.498 . . . . 0.0 112.519 178.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.6 -50.31 70.46 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 124.319 1.048 . . . . 0.0 109.946 172.759 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.6 mt -62.84 -37.46 86.92 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 118.746 -0.645 . . . . 0.0 111.431 177.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -45.32 94.79 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.539 1.136 . . . . 0.0 113.078 171.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 38.6 t60 -64.62 -51.13 64.27 Favored 'General case' 0 C--N 1.334 -0.107 0 C-N-CA 124.097 0.959 . . . . 0.0 109.923 179.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -50.97 -56.5 12.11 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 123.956 0.902 . . . . 0.0 110.982 173.329 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -55.33 -42.93 69.18 Favored 'Isoleucine or valine' 0 C--N 1.343 0.32 0 CA-C-N 118.746 0.703 . . . . 0.0 112.472 179.243 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -63.82 -37.59 87.94 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 122.995 0.518 . . . . 0.0 112.049 175.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.7 mt -66.8 -51.58 53.98 Favored 'General case' 0 C--O 1.226 -0.164 0 C-N-CA 124.414 1.086 . . . . 0.0 110.281 176.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 13.6 mm -64.77 -55.53 20.58 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.506 0 C-N-CA 124.118 0.967 . . . . 0.0 110.432 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.7 t -51.34 -41.06 60.32 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 120.658 1.572 . . . . 0.0 111.885 -179.016 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 17.3 ttt180 -84.71 14.73 4.4 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.567 1.147 . . . . 0.0 113.682 177.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -156.71 30.5 0.32 Allowed 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 126.469 1.908 . . . . 0.0 112.942 -176.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.6 ttt180 -123.95 -137.53 0.29 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.218 1.007 . . . . 0.0 110.257 -179.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 46.6 p90 -22.09 85.47 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 130.091 3.356 . . . . 0.0 114.347 172.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.316 -0.869 0 O-C-N 117.762 -3.087 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 . . . . . 0 N--CA 1.473 0.686 0 CA-C-O 119.276 -0.393 . . . . 0.0 110.424 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -73.23 -62.15 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.6 2.2 . . . . 0.0 111.808 -179.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 26.6 t -168.03 -53.48 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.261 1.424 . . . . 0.0 110.891 176.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 18.1 mttp -127.09 70.81 75.35 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 126.822 2.049 . . . . 0.0 110.166 -179.006 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -73.86 75.77 3.07 Favored 'Trans proline' 0 C--N 1.355 0.89 0 C-N-CA 124.075 3.184 . . . . 0.0 111.199 179.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -163.84 91.84 0.66 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.612 1.165 . . . . 0.0 109.463 178.478 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -158.86 131.08 4.25 Favored Pre-proline 0 C--O 1.241 0.636 0 O-C-N 121.103 -0.998 . . . . 0.0 109.753 176.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -68.8 138.75 41.84 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 121.852 1.701 . . . . 0.0 110.093 172.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.56 -128.92 3.34 Favored Glycine 0 C--N 1.334 0.419 0 N-CA-C 108.744 -1.742 . . . . 0.0 108.744 173.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 63.65 114.86 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 126.32 1.848 . . . . 0.0 111.158 -175.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 48.08 79.63 0.07 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.342 1.057 . . . . 0.0 113.584 179.192 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.24 142.3 38.48 Favored Pre-proline 0 CA--C 1.544 0.745 0 O-C-N 121.576 -0.702 . . . . 0.0 112.356 -176.081 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -69.12 116.4 4.47 Favored 'Trans proline' 0 C--N 1.355 0.91 0 C-N-CA 122.986 2.458 . . . . 0.0 111.208 -174.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -165.59 44.3 0.08 Allowed 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.113 0.965 . . . . 0.0 112.504 -178.901 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -119.33 -134.07 0.32 Allowed 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.33 -0.856 . . . . 0.0 111.693 -175.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -48.55 -43.81 35.96 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.607 1.563 . . . . 0.0 111.397 174.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.0 tt -52.76 -46.59 67.59 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-O 117.96 -1.019 . . . . 0.0 111.382 172.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.65 -40.96 72.93 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.746 1.157 . . . . 0.0 110.138 -178.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -45.77 78.2 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.196 0.999 . . . . 0.0 112.326 174.252 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -60.07 -53.3 59.39 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.523 1.129 . . . . 0.0 111.835 177.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.42 -31.98 64.43 Favored 'General case' 0 C--O 1.219 -0.513 0 C-N-CA 124.986 1.315 . . . . 0.0 111.203 175.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.93 -51.03 24.13 Favored 'General case' 0 C--O 1.219 -0.534 0 C-N-CA 124.996 1.318 . . . . 0.0 111.699 174.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -52.2 -47.76 65.43 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.851 0.86 . . . . 0.0 109.888 174.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.1 mt -65.83 -40.57 91.9 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.681 -0.676 . . . . 0.0 111.466 177.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.3 -37.07 79.41 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.621 1.168 . . . . 0.0 113.042 172.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -73.12 -51.67 17.1 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.151 1.381 . . . . 0.0 110.197 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -52.01 -54.69 26.87 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.767 0.827 . . . . 0.0 110.764 173.346 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -54.71 -42.85 63.62 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 119.244 0.929 . . . . 0.0 111.748 178.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -60.79 -40.96 94.6 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.035 0.534 . . . . 0.0 111.598 174.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.9 -28.56 65.72 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.627 1.171 . . . . 0.0 113.867 175.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 46.7 mm -83.24 -33.25 9.97 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 C-N-CA 124.492 1.117 . . . . 0.0 110.924 175.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.2 -39.44 54.7 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 120.771 -1.206 . . . . 0.0 111.999 176.587 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.81 -13.02 61.79 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 176.181 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 -76.31 -35.33 58.88 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.774 1.23 . . . . 0.0 111.456 177.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -84.62 -134.26 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.592 0.757 . . . . 0.0 110.597 -178.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 44.5 p90 -43.81 -34.8 1.68 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 126.845 2.058 . . . . 0.0 113.339 170.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.4 0 O-C-N 119.47 -2.019 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 . . . . . 0 N--CA 1.482 1.14 0 CA-C-O 118.715 -0.66 . . . . 0.0 110.668 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -73.25 -49.88 0.21 Allowed 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 122.442 2.094 . . . . 0.0 112.566 -179.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 170.39 -33.54 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 128.243 2.617 . . . . 0.0 112.164 176.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.0 mttm -126.04 79.03 69.8 Favored Pre-proline 0 CA--C 1.537 0.474 0 C-N-CA 126.221 1.808 . . . . 0.0 109.057 175.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -73.49 130.52 15.04 Favored 'Trans proline' 0 N--CA 1.453 -0.872 0 C-N-CA 122.758 2.305 . . . . 0.0 110.93 174.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -69.98 139.67 52.84 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.277 0.631 . . . . 0.0 109.504 177.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 23.7 p-10 -147.58 150.54 37.17 Favored Pre-proline 0 CA--C 1.539 0.542 0 C-N-CA 123.057 0.543 . . . . 0.0 111.2 177.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -71.29 149.26 56.95 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 121.78 1.654 . . . . 0.0 110.209 172.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -74.94 -72.86 1.0 Allowed Glycine 0 CA--C 1.527 0.797 0 CA-C-O 119.067 -0.852 . . . . 0.0 111.664 177.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 172.2 -37.26 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 128.324 2.65 . . . . 0.0 111.448 173.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -152.75 105.08 2.93 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.842 2.057 . . . . 0.0 108.689 -178.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -165.06 83.23 1.15 Allowed Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 124.678 1.191 . . . . 0.0 110.003 175.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -71.19 163.01 40.64 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.316 2.011 . . . . 0.0 110.951 175.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 89.63 17.25 0.05 OUTLIER 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 127.717 2.407 . . . . 0.0 112.589 179.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -166.42 151.17 7.85 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 127.375 2.27 . . . . 0.0 105.682 -177.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.1 t70 68.79 -45.0 0.53 Allowed 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 129.043 2.937 . . . . 0.0 113.569 179.443 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.467 ' C ' ' H ' ' A' ' 19' ' ' GLN . 53.5 tp -54.45 -25.41 24.94 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.45 1.9 . . . . 0.0 112.861 173.661 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.6 32.85 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 127.948 2.499 . . . . 0.0 113.752 169.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.467 ' H ' ' C ' ' A' ' 17' ' ' LEU . 21.9 tt0 -153.93 -38.12 0.1 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 127.015 2.126 . . . . 0.0 111.314 176.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 91.7 t80 -55.41 -55.3 33.25 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.924 1.238 . . . . 0.0 110.942 179.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.66 -33.0 69.61 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.884 177.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.34 -47.59 41.18 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 126.517 1.927 . . . . 0.0 112.228 178.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.87 -47.9 76.51 Favored 'General case' 0 N--CA 1.46 0.058 0 C-N-CA 124.582 1.153 . . . . 0.0 109.521 174.151 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.8 mt -64.34 -38.15 90.03 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 119.162 -0.447 . . . . 0.0 111.968 176.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.76 -34.14 77.63 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.042 1.337 . . . . 0.0 113.81 171.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 46.2 t60 -75.12 -49.86 18.23 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 125.053 1.341 . . . . 0.0 110.174 178.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -50.39 -55.11 17.14 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 124.491 1.116 . . . . 0.0 110.038 172.411 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -58.18 -41.12 80.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 118.867 0.758 . . . . 0.0 112.543 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -58.32 -49.47 77.06 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 123.373 0.669 . . . . 0.0 110.559 175.07 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.3 mt -62.79 -44.2 96.81 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 118.822 -0.609 . . . . 0.0 111.985 176.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 5.3 mm -61.24 -56.13 19.96 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.294 0 C-N-CA 125.593 1.557 . . . . 0.0 110.158 178.193 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.2 t -57.32 -39.59 76.14 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 119.589 1.086 . . . . 0.0 111.48 179.081 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 16.7 mtp85 -78.8 11.48 2.61 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.36 1.464 . . . . 0.0 114.796 172.618 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.0 tm0? -142.64 20.05 2.01 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 126.688 1.995 . . . . 0.0 112.351 179.364 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -129.28 -141.81 0.25 Allowed 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.443 -1.411 . . . . 0.0 111.355 -177.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 30.1 p90 -42.9 -32.48 0.63 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 127.669 2.387 . . . . 0.0 113.564 170.265 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.356 0 O-C-N 119.672 -1.892 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . 0.41 ' H3 ' ' HD3' ' A' ' 2' ' ' PRO . 68.2 m-85 . . . . . 0 N--CA 1.478 0.972 0 CA-C-O 119.249 -0.405 . . . . 0.0 111.369 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.41 ' HD3' ' H3 ' ' A' ' 1' ' ' TYR . 30.8 Cg_endo -72.89 -63.89 0.04 OUTLIER 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 121.936 1.757 . . . . 0.0 111.168 178.723 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.1 t -165.44 -170.67 1.91 Allowed 'General case' 0 C--O 1.237 0.442 0 C-N-CA 125.476 1.51 . . . . 0.0 109.83 176.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.0 mttt -53.67 152.18 9.96 Favored Pre-proline 0 N--CA 1.473 0.681 0 C-N-CA 124.825 1.25 . . . . 0.0 111.593 174.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -71.34 145.0 47.2 Favored 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 122.002 1.801 . . . . 0.0 110.553 179.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -128.79 162.88 26.42 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.142 2.177 . . . . 0.0 107.89 178.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 70.02 154.79 0.15 Allowed Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 127.559 2.344 . . . . 0.0 111.988 -176.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -73.24 179.04 5.83 Favored 'Trans proline' 0 CA--C 1.549 1.232 0 C-N-CA 122.409 2.073 . . . . 0.0 111.003 172.338 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -165.41 91.08 0.1 Allowed Glycine 0 C--N 1.339 0.74 0 N-CA-C 112.036 -0.426 . . . . 0.0 112.036 -178.424 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -149.06 116.03 6.01 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 126.031 1.733 . . . . 0.0 108.229 -179.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.2 t70 71.62 -58.1 0.59 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 127.376 2.27 . . . . 0.0 111.474 -179.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 43.0 72.52 1.14 Allowed Pre-proline 0 CA--C 1.54 0.581 0 C-N-CA 127.855 2.462 . . . . 0.0 112.478 -178.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -69.45 80.54 0.79 Allowed 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 124.079 3.186 . . . . 0.0 110.994 -173.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 70.95 33.16 2.19 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.623 2.369 . . . . 0.0 113.797 -173.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -119.26 -6.83 10.34 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 -175.736 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -175.81 -36.83 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 127.646 2.378 . . . . 0.0 111.09 -179.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.469 ' C ' ' H ' ' A' ' 19' ' ' GLN . 38.7 tp -58.7 -21.55 55.06 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.664 1.186 . . . . 0.0 112.685 176.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.63 30.67 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 128.111 2.564 . . . . 0.0 113.839 174.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . 0.469 ' H ' ' C ' ' A' ' 17' ' ' LEU . 7.3 tm0? -154.24 -37.77 0.09 Allowed 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 127.45 2.3 . . . . 0.0 111.186 178.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 74.7 t80 -59.88 -59.12 5.94 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.453 1.101 . . . . 0.0 110.481 177.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.73 -34.11 62.04 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 119.351 -0.357 . . . . 0.0 111.212 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.15 -45.31 57.4 Favored 'General case' 0 C--O 1.212 -0.882 0 C-N-CA 126.261 1.824 . . . . 0.0 112.261 176.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.65 -49.36 70.77 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 120.69 1.586 . . . . 0.0 109.15 174.524 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 mp -61.46 -55.72 28.14 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-O 118.847 -0.597 . . . . 0.0 111.022 175.353 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.85 -45.66 64.13 Favored 'General case' 0 C--O 1.208 -1.127 0 CA-C-O 118.134 -0.936 . . . . 0.0 112.027 177.131 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 18.7 t60 -60.0 -52.62 64.59 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 124.629 1.172 . . . . 0.0 109.697 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -70.52 19.7 0.05 OUTLIER 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.908 1.683 . . . . 0.0 114.962 176.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -141.69 -48.24 0.22 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.415 0 C-N-CA 125.656 1.582 . . . . 0.0 110.289 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -65.99 -31.92 73.11 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 125.684 1.594 . . . . 0.0 110.376 176.297 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 17.1 mt -76.01 -36.68 59.06 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 119.09 0.859 . . . . 0.0 112.155 175.514 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 10.9 mm -75.42 -47.92 32.89 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 123.236 0.615 . . . . 0.0 109.81 -179.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.8 t -53.74 -43.31 68.99 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.312 1.045 . . . . 0.0 111.601 179.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.37 2.63 18.04 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.545 1.138 . . . . 0.0 113.809 178.636 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -132.93 15.97 4.24 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.875 2.47 . . . . 0.0 113.07 -173.414 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.95 -144.01 0.25 Allowed 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.166 0.986 . . . . 0.0 110.333 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 7.5 p90 -41.32 -34.81 0.55 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.237 1.815 . . . . 0.0 113.588 172.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.333 0 O-C-N 119.639 -1.913 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 27.5 p90 . . . . . 0 N--CA 1.481 1.093 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -76.64 -71.68 0.01 OUTLIER 'Trans proline' 0 CA--C 1.536 0.575 0 C-N-CA 122.064 1.843 . . . . 0.0 111.583 178.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 9.0 p -112.37 -66.05 1.12 Allowed 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 126.259 1.824 . . . . 0.0 110.625 -177.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 58.83 80.61 0.27 Allowed Pre-proline 0 N--CA 1.473 0.725 0 C-N-CA 126.951 2.1 . . . . 0.0 111.811 -178.81 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -70.26 -53.17 0.25 Allowed 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 123.107 2.538 . . . . 0.0 112.752 -175.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -160.4 -86.41 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.628 1.571 . . . . 0.0 107.724 174.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -161.3 102.17 1.23 Allowed Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 126.847 2.059 . . . . 0.0 108.936 179.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -78.86 102.26 1.52 Allowed 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 123.37 2.713 . . . . 0.0 112.215 175.735 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 174.79 78.44 0.05 OUTLIER Glycine 0 CA--C 1.526 0.738 0 CA-C-O 118.525 -1.153 . . . . 0.0 113.285 178.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 172.24 -28.18 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 127.271 2.228 . . . . 0.0 112.456 -179.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -138.34 84.96 2.06 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.87 1.668 . . . . 0.0 109.065 177.694 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -154.84 171.5 7.09 Favored Pre-proline 0 CA--C 1.544 0.748 0 O-C-N 121.265 -0.897 . . . . 0.0 111.207 177.646 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -70.68 -179.85 3.64 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 122.373 2.049 . . . . 0.0 111.06 169.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 82.12 46.81 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.709 2.004 . . . . 0.0 112.973 179.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -117.67 -1.58 11.59 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 -176.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -163.2 -63.21 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.983 1.713 . . . . 0.0 108.226 -178.047 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -51.74 -27.35 11.72 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.615 1.566 . . . . 0.0 113.463 -179.562 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.18 -52.09 66.28 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 126.124 1.77 . . . . 0.0 111.248 174.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -28.54 62.53 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-O 118.877 -0.583 . . . . 0.0 111.041 174.265 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 10.7 m-30 -60.82 -48.27 82.54 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 119.464 1.029 . . . . 0.0 110.152 178.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.12 -31.84 70.44 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 118.657 -0.687 . . . . 0.0 112.378 173.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.49 -48.05 24.36 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 125.34 1.456 . . . . 0.0 112.346 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -55.35 -49.13 73.04 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.543 1.537 . . . . 0.0 109.3 174.069 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.0 mt -63.03 -41.79 99.62 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 118.64 -0.695 . . . . 0.0 111.705 176.247 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -37.68 77.73 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.96 0.904 . . . . 0.0 113.155 172.101 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 39.3 t60 -70.39 -54.05 14.02 Favored 'General case' 0 C--N 1.334 -0.094 0 C-N-CA 124.941 1.296 . . . . 0.0 110.804 177.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -52.16 -51.09 60.11 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 124.3 1.04 . . . . 0.0 110.72 176.557 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -57.12 -45.21 84.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 CA-C-O 118.653 -0.689 . . . . 0.0 111.888 177.523 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -64.95 -27.99 69.22 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 176.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.6 mt -73.71 -52.95 11.55 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 124.962 1.305 . . . . 0.0 111.325 172.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 2.1 mp -59.57 -50.24 80.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-O 118.029 -0.986 . . . . 0.0 109.431 177.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.537 ' HA ' ' CG ' ' A' ' 35' ' ' ARG . 0.5 OUTLIER -54.01 -27.22 30.54 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 119.772 1.169 . . . . 0.0 113.181 179.826 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -77.82 4.74 11.06 Favored 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 174.427 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -142.37 -42.37 0.33 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 127.515 2.326 . . . . 0.0 113.746 -174.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.537 ' CG ' ' HA ' ' A' ' 32' ' ' THR . 0.2 OUTLIER -54.13 160.52 1.53 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 119.353 0.979 . . . . 0.0 110.33 168.795 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 26.1 p90 48.09 14.35 0.05 Allowed 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 126.641 1.976 . . . . 0.0 115.62 -179.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.482 0 O-C-N 118.173 -2.83 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 . . . . . 0 N--CA 1.476 0.851 0 CA-C-O 119.636 -0.221 . . . . 0.0 110.42 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -76.02 86.84 1.47 Allowed 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.398 2.732 . . . . 0.0 111.059 178.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.19 -45.93 0.08 Allowed 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.072 1.349 . . . . 0.0 111.316 178.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -119.14 83.35 24.31 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 124.82 1.248 . . . . 0.0 109.904 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -69.1 171.9 12.94 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 123.077 2.518 . . . . 0.0 111.748 178.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -85.74 171.61 11.47 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.108 0.563 . . . . 0.0 111.704 173.051 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -136.54 133.89 19.39 Favored Pre-proline 0 CA--C 1.541 0.609 0 C-N-CA 123.744 0.818 . . . . 0.0 109.902 175.829 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -73.21 103.05 1.54 Allowed 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 123.003 2.469 . . . . 0.0 110.828 176.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 97.58 116.41 3.49 Favored Glycine 0 CA--C 1.526 0.779 0 C-N-CA 124.841 1.21 . . . . 0.0 111.612 -177.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.59 -29.99 67.64 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 175.752 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -169.44 102.5 0.34 Allowed 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 127.089 2.156 . . . . 0.0 106.583 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 52.72 80.99 0.27 Allowed Pre-proline 0 CA--C 1.555 1.147 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 173.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -71.97 73.79 2.46 Favored 'Trans proline' 0 C--N 1.355 0.869 0 C-N-CA 124.029 3.153 . . . . 0.0 111.392 -176.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 72.21 38.85 0.82 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 128.011 2.524 . . . . 0.0 112.956 179.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.4 tp10 -172.85 143.56 1.23 Allowed 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 125.357 1.463 . . . . 0.0 108.479 -178.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.6 t0 84.17 -42.72 0.08 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 128.781 2.833 . . . . 0.0 110.758 -177.627 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -48.53 -26.47 2.2 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.935 1.694 . . . . 0.0 114.049 177.224 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.39 -56.48 19.86 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.629 1.971 . . . . 0.0 110.36 172.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -69.73 -28.79 66.1 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.708 0.803 . . . . 0.0 112.358 177.682 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -53.65 -52.82 58.72 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.762 0.825 . . . . 0.0 110.288 169.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.9 -30.45 69.03 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 118.358 -0.83 . . . . 0.0 113.028 176.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.54 -48.75 30.64 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.403 1.481 . . . . 0.0 112.358 176.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.4 -48.1 79.97 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 118.411 0.55 . . . . 0.0 109.733 176.532 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.94 -42.54 94.24 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.429 0.692 . . . . 0.0 111.394 174.911 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.07 -36.18 76.79 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.724 1.209 . . . . 0.0 113.18 174.16 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 32.9 t60 -75.85 -50.77 14.15 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 123.724 0.809 . . . . 0.0 110.34 177.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.87 -46.89 64.65 Favored 'General case' 0 C--O 1.222 -0.393 0 C-N-CA 124.888 1.275 . . . . 0.0 112.51 175.148 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -57.55 -49.18 81.28 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 CA-C-N 119.19 0.905 . . . . 0.0 110.374 176.176 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -64.12 -22.61 67.0 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.334 1.053 . . . . 0.0 112.821 177.629 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.7 mt -80.55 -62.17 1.75 Allowed 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 124.237 1.015 . . . . 0.0 111.103 171.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 21.8 mm -48.8 -44.84 15.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 C-N-CA 125.44 1.496 . . . . 0.0 111.011 179.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 18.6 p -51.91 -42.96 63.18 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.183 -0.948 . . . . 0.0 113.163 173.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -79.69 17.33 0.92 Allowed 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 174.721 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -159.18 33.58 0.2 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.703 1.601 . . . . 0.0 113.273 -177.023 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.6 ttt-85 -138.53 -138.49 0.14 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.668 0.787 . . . . 0.0 111.265 -178.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 51.6 p90 -37.67 -39.02 0.31 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 127.821 2.449 . . . . 0.0 113.51 172.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.468 0 O-C-N 119.512 -1.993 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 . . . . . 0 N--CA 1.477 0.881 0 CA-C-O 117.534 -1.222 . . . . 0.0 109.824 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -72.54 162.31 41.72 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 123.648 2.899 . . . . 0.0 111.198 173.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 8.1 t 50.28 93.24 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.883 1.673 . . . . 0.0 112.118 -173.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 33.1 mttt -112.97 83.19 5.8 Favored Pre-proline 0 CA--C 1.534 0.361 0 C-N-CA 123.947 0.899 . . . . 0.0 109.006 179.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -73.8 65.35 4.91 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.609 2.873 . . . . 0.0 109.784 175.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -57.9 130.23 45.53 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.078 0.951 . . . . 0.0 109.755 175.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 27.1 p30 -151.02 158.75 34.59 Favored Pre-proline 0 CA--C 1.538 0.493 0 C-N-CA 123.448 0.699 . . . . 0.0 110.538 178.097 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -74.91 169.0 23.58 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 121.914 1.742 . . . . 0.0 111.219 168.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -170.64 -72.64 0.04 OUTLIER Glycine 0 C--N 1.332 0.33 0 N-CA-C 110.078 -1.209 . . . . 0.0 110.078 178.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 65.42 -52.09 0.36 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 126.555 1.942 . . . . 0.0 112.426 -176.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.9 t0 70.69 -62.98 0.43 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.996 2.518 . . . . 0.0 109.323 -177.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -159.26 166.64 15.88 Favored Pre-proline 0 CA--C 1.544 0.747 0 C-N-CA 126.615 1.966 . . . . 0.0 111.778 -179.668 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -74.01 78.93 2.44 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 123.773 2.982 . . . . 0.0 112.176 177.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.442 ' C ' ' H ' ' A' ' 16' ' ' ASP . . . -154.52 164.26 38.95 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.235 1.414 . . . . 0.0 109.415 175.911 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 62.45 -6.74 0.14 Allowed 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 126.459 1.904 . . . . 0.0 115.949 -178.016 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.442 ' H ' ' C ' ' A' ' 14' ' ' ALA . 0.6 OUTLIER -138.43 -71.45 0.42 Allowed 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 127.899 2.48 . . . . 0.0 108.08 -176.168 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.9 tt -61.2 -49.5 76.9 Favored 'General case' 0 C--N 1.344 0.338 0 C-N-CA 123.627 0.771 . . . . 0.0 111.126 177.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.28 -42.87 66.99 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.891 0.769 . . . . 0.0 110.9 -176.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.4 tm0? -67.4 -44.91 77.68 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.838 1.655 . . . . 0.0 111.785 175.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 68.9 t80 -58.45 -54.29 48.7 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.117 1.367 . . . . 0.0 112.342 175.595 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.9 -34.32 69.69 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.45 1.1 . . . . 0.0 110.598 177.174 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.25 -49.16 46.02 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 124.789 1.235 . . . . 0.0 111.796 175.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -51.4 -47.38 62.93 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.302 1.041 . . . . 0.0 109.957 172.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.3 mt -66.45 -41.03 89.7 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 178.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.92 -29.03 70.24 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.581 1.152 . . . . 0.0 113.788 172.132 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 57.9 t60 -78.75 -51.52 9.66 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.544 1.538 . . . . 0.0 110.061 177.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -49.92 -48.81 51.53 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 124.29 1.036 . . . . 0.0 110.387 175.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -59.47 -46.39 92.86 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-N 118.405 0.548 . . . . 0.0 111.857 178.457 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -57.97 -46.74 84.66 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.799 1.24 . . . . 0.0 110.288 177.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.0 mt -65.62 -38.37 89.23 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.866 1.266 . . . . 0.0 112.924 175.339 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.8 mm -60.76 -46.58 95.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 C-N-CA 123.803 0.841 . . . . 0.0 109.823 173.008 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.2 p -60.17 -17.75 43.06 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 175.095 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.9 ttt-85 -71.72 -3.94 24.7 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 171.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -146.18 11.44 1.18 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 127.279 2.232 . . . . 0.0 112.92 179.021 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.46 160.11 17.58 Favored 'General case' 0 C--O 1.217 -0.643 0 O-C-N 121.007 -1.058 . . . . 0.0 111.316 -178.586 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -177.12 -38.13 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.207 1.403 . . . . 0.0 109.238 -174.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.414 0 O-C-N 119.079 -2.263 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.6 t80 . . . . . 0 N--CA 1.469 0.523 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.63 -37.52 70.84 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.373 1.069 . . . . 0.0 110.412 176.652 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.64 -46.04 60.23 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 124.799 1.24 . . . . 0.0 111.956 177.043 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.73 -46.89 71.0 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 119.676 1.126 . . . . 0.0 109.358 173.269 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.6 mt -65.57 -47.18 76.7 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 118.855 -0.593 . . . . 0.0 111.182 176.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.97 -31.91 67.35 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 117.968 -1.015 . . . . 0.0 113.593 174.174 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 36.9 t60 -76.44 -51.21 12.25 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 126.4 1.88 . . . . 0.0 110.497 177.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.95 -47.03 84.1 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 123.822 0.849 . . . . 0.0 110.832 177.265 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.221 -0.432 0 CA-C-O 117.185 -1.388 . . . . 0.0 110.318 175.414 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.691 ' O ' HD12 ' A' ' 24' ' ' LEU . 3.9 t80 . . . . . 0 C--O 1.221 -0.405 0 CA-C-O 119.435 -0.317 . . . . 0.0 110.698 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.87 -34.01 18.78 Favored 'General case' 0 C--N 1.343 0.314 0 CA-C-O 118.071 -0.966 . . . . 0.0 112.165 177.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.23 -50.43 40.0 Favored 'General case' 0 C--N 1.343 0.283 0 C-N-CA 125.789 1.635 . . . . 0.0 112.21 172.658 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -49.73 -49.19 49.0 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.931 1.241 . . . . 0.0 111.397 172.225 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.691 HD12 ' O ' ' A' ' 20' ' ' TYR . 2.9 mp -63.93 -49.59 71.99 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-O 118.754 -0.641 . . . . 0.0 110.988 177.055 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.82 -37.96 64.11 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.93 1.292 . . . . 0.0 113.286 175.053 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 20.2 t60 -73.13 -51.91 16.18 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 124.785 1.234 . . . . 0.0 110.881 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -49.82 -60.88 2.49 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 124.54 1.136 . . . . 0.0 110.227 172.084 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.47 0.529 0 C-N-CA 124.173 0.989 . . . . 0.0 111.806 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 78.7 t80 . . . . . 0 C--O 1.226 -0.137 0 CA-C-O 121.505 0.669 . . . . 0.0 111.841 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.61 -35.33 68.15 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.673 1.189 . . . . 0.0 111.368 176.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.18 -49.69 33.6 Favored 'General case' 0 C--O 1.22 -0.464 0 C-N-CA 125.967 1.707 . . . . 0.0 111.456 177.538 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -54.72 -44.01 73.1 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 119.57 1.077 . . . . 0.0 110.17 173.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 mt -67.45 -40.26 85.39 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 118.89 -0.576 . . . . 0.0 111.461 177.405 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.98 -38.17 87.56 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.762 1.225 . . . . 0.0 113.178 172.665 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 51.7 t60 -71.16 -51.65 23.7 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 125.163 1.385 . . . . 0.0 108.961 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -50.34 -53.25 30.28 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 124.538 1.135 . . . . 0.0 111.569 174.029 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.467 0.393 0 CA-C-N 118.837 0.744 . . . . 0.0 110.525 178.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 89.5 t80 . . . . . 0 N--CA 1.468 0.441 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.62 -32.67 67.45 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 118.488 -0.768 . . . . 0.0 111.49 176.582 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.82 -50.18 45.43 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 125.431 1.492 . . . . 0.0 111.592 174.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.14 -45.57 75.63 Favored 'General case' 0 N--CA 1.462 0.156 0 C-N-CA 123.753 0.821 . . . . 0.0 110.135 176.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.1 mt -66.39 -40.36 89.62 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 119.14 -0.457 . . . . 0.0 111.702 177.184 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -39.94 91.68 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.497 1.119 . . . . 0.0 113.03 172.433 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 42.8 t60 -69.53 -50.38 45.56 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 125.136 1.374 . . . . 0.0 110.499 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -50.6 -59.04 4.45 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 124.342 1.057 . . . . 0.0 110.0 173.345 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.473 0.705 0 CA-C-N 118.444 0.565 . . . . 0.0 111.374 -178.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 44.4 t80 . . . . . 0 N--CA 1.471 0.578 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.42 -35.49 70.12 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.055 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.67 -51.18 52.83 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 125.16 1.384 . . . . 0.0 111.82 174.459 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -50.75 -46.51 59.35 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 119.454 1.025 . . . . 0.0 110.211 174.598 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.5 mt -67.73 -47.31 69.67 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 118.99 -0.529 . . . . 0.0 111.279 178.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -35.08 68.63 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.029 1.331 . . . . 0.0 113.514 174.568 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -74.54 -52.95 10.43 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 126.033 1.733 . . . . 0.0 110.35 178.672 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -48.52 -62.51 1.46 Allowed 'General case' 0 C--N 1.344 0.332 0 CA-C-O 117.857 -1.068 . . . . 0.0 109.907 171.794 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.475 0.789 0 C-N-CA 124.511 1.124 . . . . 0.0 111.946 -177.121 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 87.9 t80 . . . . . 0 N--CA 1.471 0.619 0 CA-C-O 121.097 0.475 . . . . 0.0 111.828 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.2 -32.1 66.13 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.475 1.11 . . . . 0.0 111.168 175.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.42 -48.13 43.67 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 125.125 1.37 . . . . 0.0 111.533 175.403 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -54.83 -47.68 73.8 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 124.029 0.932 . . . . 0.0 109.716 175.547 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mt -65.93 -39.6 90.64 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 177.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.35 -43.91 96.06 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.457 1.103 . . . . 0.0 112.304 172.01 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 54.9 t60 -65.43 -50.9 63.69 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.81 1.244 . . . . 0.0 110.513 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -50.91 -57.26 8.96 Favored 'General case' 0 C--N 1.344 0.347 0 C-N-CA 124.386 1.074 . . . . 0.0 110.731 172.844 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.222 -0.347 0 CA-C-N 118.867 0.758 . . . . 0.0 110.881 178.358 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.528 ' O ' HD12 ' A' ' 24' ' ' LEU . 4.2 m-85 . . . . . 0 N--CA 1.467 0.397 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.77 -29.01 67.89 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 118.708 -0.663 . . . . 0.0 112.386 176.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.55 -49.61 21.22 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.742 1.617 . . . . 0.0 111.735 177.296 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -58.67 -46.06 88.05 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.224 0.61 . . . . 0.0 109.976 176.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.528 HD12 ' O ' ' A' ' 20' ' ' TYR . 1.1 mt -62.27 -39.72 93.87 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 118.713 -0.66 . . . . 0.0 111.682 174.276 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.87 -34.57 76.24 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.789 1.235 . . . . 0.0 113.123 173.144 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 45.7 t60 -78.82 -53.12 7.43 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 118.706 -0.664 . . . . 0.0 110.172 178.159 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -46.69 -43.77 18.09 Favored 'General case' 0 C--O 1.214 -0.796 0 C-N-CA 124.679 1.192 . . . . 0.0 111.228 171.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.369 0 CA-C-N 119.607 1.094 . . . . 0.0 111.001 175.637 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.3 t80 . . . . . 0 N--CA 1.465 0.28 0 CA-C-O 121.012 0.434 . . . . 0.0 111.301 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.78 -29.07 69.21 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 176.183 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.02 -49.47 19.7 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.834 1.654 . . . . 0.0 112.037 177.377 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -54.66 -48.43 72.35 Favored 'General case' 0 CA--C 1.528 0.105 0 C-N-CA 124.717 1.207 . . . . 0.0 109.17 175.013 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.1 mt -64.01 -38.83 92.5 Favored 'General case' 0 C--N 1.347 0.478 0 CA-C-O 119.021 -0.514 . . . . 0.0 111.673 177.209 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.54 -37.48 86.27 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.414 1.086 . . . . 0.0 113.138 172.184 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 35.9 t60 -71.7 -52.05 19.8 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.197 1.399 . . . . 0.0 110.291 178.376 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.49 -52.04 56.42 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 124.605 1.162 . . . . 0.0 111.039 174.523 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.219 -0.525 0 CA-C-N 118.638 0.654 . . . . 0.0 111.43 176.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 69.4 t80 . . . . . 0 N--CA 1.47 0.573 0 CA-C-O 120.871 0.367 . . . . 0.0 110.677 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.78 -31.17 69.43 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.832 177.597 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.49 -48.16 35.59 Favored 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 126.631 1.972 . . . . 0.0 111.953 178.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.04 -47.0 78.68 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 125.145 1.378 . . . . 0.0 109.998 174.726 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.3 mt -65.3 -39.65 92.8 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.397 0.279 . . . . 0.0 111.556 176.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.02 -41.6 96.86 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.125 1.37 . . . . 0.0 113.379 172.226 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 44.5 t60 -69.8 -48.51 58.84 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 124.776 1.23 . . . . 0.0 110.493 178.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.47 -55.33 19.43 Favored 'General case' 0 C--O 1.223 -0.322 0 C-N-CA 124.016 0.926 . . . . 0.0 110.717 171.406 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.492 0 CA-C-N 119.272 0.942 . . . . 0.0 111.34 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.539 0.557 0 N-CA-C 111.641 0.237 . . . . 0.0 111.641 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.88 -33.6 74.51 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.295 1.038 . . . . 0.0 111.035 176.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.39 -49.52 33.28 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 126.643 1.977 . . . . 0.0 111.359 176.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.7 -49.93 69.5 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 119.674 1.125 . . . . 0.0 109.503 174.434 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.2 mt -63.18 -39.48 94.77 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 118.487 -0.768 . . . . 0.0 112.44 177.29 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -50.07 75.14 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 119.169 0.895 . . . . 0.0 112.066 171.491 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 26.2 t60 -58.55 -46.89 85.91 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.161 0.984 . . . . 0.0 110.015 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -70.88 19.79 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.716 1.606 . . . . 0.0 115.019 176.133 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.508 0 C-N-CA 125.707 1.603 . . . . 0.0 110.387 -179.155 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 91.5 t80 . . . . . 0 N--CA 1.465 0.324 0 CA-C-O 121.441 0.638 . . . . 0.0 111.934 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.72 -36.02 66.76 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.077 1.351 . . . . 0.0 111.012 177.613 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.08 -49.19 38.36 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 124.471 1.108 . . . . 0.0 111.912 176.351 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -51.28 -47.2 62.6 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 125.207 1.403 . . . . 0.0 109.192 173.194 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.1 mt -67.33 -43.58 81.21 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.185 177.949 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.43 -34.2 72.2 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 172.767 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 41.5 t60 -75.24 -52.72 10.21 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 125.792 1.637 . . . . 0.0 110.139 178.418 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -51.18 -52.81 40.74 Favored 'General case' 0 C--O 1.221 -0.431 0 C-N-CA 124.189 0.996 . . . . 0.0 111.702 172.626 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.222 -0.353 0 CA-C-O 118.64 -0.695 . . . . 0.0 110.727 178.498 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 12.7 m-30 . . . . . 0 N--CA 1.467 0.404 0 N-CA-C 110.27 -0.271 . . . . 0.0 110.27 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.67 -34.22 64.8 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 118.382 -0.818 . . . . 0.0 111.707 173.565 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.58 -48.46 32.61 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.138 1.375 . . . . 0.0 112.081 177.459 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.53 -49.08 65.55 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.947 0.899 . . . . 0.0 110.534 172.544 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.4 mt -61.89 -49.03 77.83 Favored 'General case' 0 C--N 1.346 0.434 0 CA-C-O 118.916 -0.564 . . . . 0.0 110.923 175.714 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.1 -30.32 61.89 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 174.344 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 40.3 t60 -79.41 -53.48 6.87 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 124.836 1.255 . . . . 0.0 110.756 177.326 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -51.72 -50.08 61.24 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 124.434 1.094 . . . . 0.0 110.448 175.661 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.467 0.413 0 CA-C-N 118.766 0.712 . . . . 0.0 111.564 177.061 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.5 t80 . . . . . 0 N--CA 1.467 0.421 0 CA-C-O 121.212 0.53 . . . . 0.0 111.444 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.64 -36.15 66.72 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 125.163 1.385 . . . . 0.0 110.96 176.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.4 -47.1 51.9 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-O 117.785 -1.102 . . . . 0.0 112.13 176.284 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -54.54 -46.92 73.69 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 119.758 1.163 . . . . 0.0 109.312 173.826 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.3 mt -65.48 -42.49 92.16 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 118.855 -0.593 . . . . 0.0 111.041 177.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.06 -44.12 91.79 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.109 0.963 . . . . 0.0 112.406 173.292 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 41.2 t60 -66.7 -52.57 43.08 Favored 'General case' 0 C--O 1.231 0.103 0 C-N-CA 125.576 1.551 . . . . 0.0 109.952 -179.201 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -50.16 -56.71 9.86 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-O 118.156 -0.926 . . . . 0.0 110.946 171.887 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.465 0.298 0 CA-C-N 119.167 0.894 . . . . 0.0 110.293 -179.227 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 . . . . . 0 N--CA 1.464 0.245 0 N-CA-C 110.467 -0.197 . . . . 0.0 110.467 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.56 -29.62 70.71 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 175.532 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -76.49 -47.44 22.83 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.445 1.498 . . . . 0.0 112.519 178.482 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.6 -50.31 70.46 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 124.319 1.048 . . . . 0.0 109.946 172.759 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.6 mt -62.84 -37.46 86.92 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 118.746 -0.645 . . . . 0.0 111.431 177.806 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -45.32 94.79 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.539 1.136 . . . . 0.0 113.078 171.961 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 38.6 t60 -64.62 -51.13 64.27 Favored 'General case' 0 C--N 1.334 -0.107 0 C-N-CA 124.097 0.959 . . . . 0.0 109.923 179.245 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -50.97 -56.5 12.11 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 123.956 0.902 . . . . 0.0 110.982 173.329 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.343 0.32 0 CA-C-N 118.746 0.703 . . . . 0.0 112.472 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 87.4 t80 . . . . . 0 N--CA 1.47 0.542 0 CA-C-O 121.003 0.43 . . . . 0.0 111.835 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.42 -31.98 64.43 Favored 'General case' 0 C--O 1.219 -0.513 0 C-N-CA 124.986 1.315 . . . . 0.0 111.203 175.088 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.93 -51.03 24.13 Favored 'General case' 0 C--O 1.219 -0.534 0 C-N-CA 124.996 1.318 . . . . 0.0 111.699 174.715 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -52.2 -47.76 65.43 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.851 0.86 . . . . 0.0 109.888 174.509 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.1 mt -65.83 -40.57 91.9 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.681 -0.676 . . . . 0.0 111.466 177.681 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.3 -37.07 79.41 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.621 1.168 . . . . 0.0 113.042 172.873 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -73.12 -51.67 17.1 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.151 1.381 . . . . 0.0 110.197 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -52.01 -54.69 26.87 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.767 0.827 . . . . 0.0 110.764 173.346 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.467 0.415 0 CA-C-N 119.244 0.929 . . . . 0.0 111.748 178.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 91.7 t80 . . . . . 0 N--CA 1.469 0.483 0 CA-C-O 121.213 0.53 . . . . 0.0 110.942 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.66 -33.0 69.61 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.884 177.347 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.34 -47.59 41.18 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 126.517 1.927 . . . . 0.0 112.228 178.321 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.87 -47.9 76.51 Favored 'General case' 0 N--CA 1.46 0.058 0 C-N-CA 124.582 1.153 . . . . 0.0 109.521 174.151 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.8 mt -64.34 -38.15 90.03 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 119.162 -0.447 . . . . 0.0 111.968 176.844 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.76 -34.14 77.63 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.042 1.337 . . . . 0.0 113.81 171.829 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 46.2 t60 -75.12 -49.86 18.23 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 125.053 1.341 . . . . 0.0 110.174 178.173 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -50.39 -55.11 17.14 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 124.491 1.116 . . . . 0.0 110.038 172.411 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.47 0.544 0 CA-C-N 118.867 0.758 . . . . 0.0 112.543 179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 74.7 t80 . . . . . 0 N--CA 1.468 0.429 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.73 -34.11 62.04 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 119.351 -0.357 . . . . 0.0 111.212 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.15 -45.31 57.4 Favored 'General case' 0 C--O 1.212 -0.882 0 C-N-CA 126.261 1.824 . . . . 0.0 112.261 176.498 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.65 -49.36 70.77 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 120.69 1.586 . . . . 0.0 109.15 174.524 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 mp -61.46 -55.72 28.14 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-O 118.847 -0.597 . . . . 0.0 111.022 175.353 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.85 -45.66 64.13 Favored 'General case' 0 C--O 1.208 -1.127 0 CA-C-O 118.134 -0.936 . . . . 0.0 112.027 177.131 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 18.7 t60 -60.0 -52.62 64.59 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 124.629 1.172 . . . . 0.0 109.697 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -70.52 19.7 0.05 OUTLIER 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.908 1.683 . . . . 0.0 114.962 176.56 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.221 -0.415 0 C-N-CA 125.656 1.582 . . . . 0.0 110.289 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 10.7 m-30 . . . . . 0 N--CA 1.467 0.423 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.12 -31.84 70.44 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 118.657 -0.687 . . . . 0.0 112.378 173.334 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.49 -48.05 24.36 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 125.34 1.456 . . . . 0.0 112.346 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -55.35 -49.13 73.04 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.543 1.537 . . . . 0.0 109.3 174.069 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.0 mt -63.03 -41.79 99.62 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 118.64 -0.695 . . . . 0.0 111.705 176.247 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -37.68 77.73 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.96 0.904 . . . . 0.0 113.155 172.101 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 39.3 t60 -70.39 -54.05 14.02 Favored 'General case' 0 C--N 1.334 -0.094 0 C-N-CA 124.941 1.296 . . . . 0.0 110.804 177.285 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -52.16 -51.09 60.11 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 124.3 1.04 . . . . 0.0 110.72 176.557 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.468 0.474 0 CA-C-O 118.653 -0.689 . . . . 0.0 111.888 177.523 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.511 ' O ' HD12 ' A' ' 24' ' ' LEU . 6.1 m-85 . . . . . 0 CA--C 1.534 0.36 0 CA-C-O 119.535 -0.269 . . . . 0.0 110.288 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.9 -30.45 69.03 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 118.358 -0.83 . . . . 0.0 113.028 176.768 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.54 -48.75 30.64 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.403 1.481 . . . . 0.0 112.358 176.027 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.4 -48.1 79.97 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 118.411 0.55 . . . . 0.0 109.733 176.532 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.511 HD12 ' O ' ' A' ' 20' ' ' TYR . 0.9 OUTLIER -59.94 -42.54 94.24 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.429 0.692 . . . . 0.0 111.394 174.911 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.07 -36.18 76.79 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.724 1.209 . . . . 0.0 113.18 174.16 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 32.9 t60 -75.85 -50.77 14.15 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 123.724 0.809 . . . . 0.0 110.34 177.102 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.87 -46.89 64.65 Favored 'General case' 0 C--O 1.222 -0.393 0 C-N-CA 124.888 1.275 . . . . 0.0 112.51 175.148 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.538 0.512 0 CA-C-N 119.19 0.905 . . . . 0.0 110.374 176.176 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 68.9 t80 . . . . . 0 CA--C 1.532 0.263 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.9 -34.32 69.69 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.45 1.1 . . . . 0.0 110.598 177.174 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.25 -49.16 46.02 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 124.789 1.235 . . . . 0.0 111.796 175.78 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -51.4 -47.38 62.93 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.302 1.041 . . . . 0.0 109.957 172.6 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.3 mt -66.45 -41.03 89.7 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 178.484 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.92 -29.03 70.24 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.581 1.152 . . . . 0.0 113.788 172.132 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 57.9 t60 -78.75 -51.52 9.66 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.544 1.538 . . . . 0.0 110.061 177.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -49.92 -48.81 51.53 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 124.29 1.036 . . . . 0.0 110.387 175.781 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.511 0 CA-C-N 118.405 0.548 . . . . 0.0 111.857 178.457 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 . . . . . 0 N--CA 1.477 0.897 0 CA-C-O 119.307 -0.378 . . . . 0.0 110.989 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -74.01 -178.87 4.14 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 121.672 1.581 . . . . 0.0 111.593 172.078 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 12.0 p -129.39 -49.59 1.18 Allowed 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 126.513 1.925 . . . . 0.0 111.748 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -166.84 81.85 0.94 Allowed Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 126.958 2.103 . . . . 0.0 110.137 -179.434 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -71.63 147.69 51.75 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 121.667 1.578 . . . . 0.0 110.326 175.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -169.1 123.61 0.84 Allowed 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 126.005 1.722 . . . . 0.0 108.112 177.436 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -163.43 141.76 6.2 Favored Pre-proline 0 CA--C 1.542 0.638 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 171.491 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -81.85 169.73 14.63 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 123.08 2.52 . . . . 0.0 111.772 166.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 73.2 86.5 0.21 Allowed Glycine 0 CA--C 1.528 0.881 0 C-N-CA 125.965 1.745 . . . . 0.0 112.722 176.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -166.52 113.11 0.84 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.616 1.166 . . . . 0.0 109.066 -176.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.82 73.9 0.59 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.252 1.421 . . . . 0.0 108.794 174.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.88 153.96 87.12 Favored Pre-proline 0 CA--C 1.546 0.805 0 O-C-N 121.253 -0.905 . . . . 0.0 110.116 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -72.86 175.13 10.79 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 121.166 1.244 . . . . 0.0 110.854 172.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 90.23 20.08 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 127.52 2.328 . . . . 0.0 113.672 179.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -106.21 -3.01 21.82 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.205 1.402 . . . . 0.0 114.688 -176.011 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -176.57 -43.58 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 127.569 2.348 . . . . 0.0 109.957 179.172 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 26.1 tp -58.61 -37.84 76.72 Favored 'General case' 0 C--N 1.348 0.51 0 C-N-CA 124.109 0.964 . . . . 0.0 111.647 176.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.61 -41.32 63.59 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 119.892 1.223 . . . . 0.0 111.507 173.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -65.59 -46.77 78.09 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 118.267 0.485 . . . . 0.0 111.208 175.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -62.32 -54.01 46.78 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.151 0.98 . . . . 0.0 112.222 179.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.63 -37.52 70.84 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.373 1.069 . . . . 0.0 110.412 176.652 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.64 -46.04 60.23 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 124.799 1.24 . . . . 0.0 111.956 177.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.73 -46.89 71.0 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 119.676 1.126 . . . . 0.0 109.358 173.269 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.6 mt -65.57 -47.18 76.7 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 118.855 -0.593 . . . . 0.0 111.182 176.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.97 -31.91 67.35 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 117.968 -1.015 . . . . 0.0 113.593 174.174 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 36.9 t60 -76.44 -51.21 12.25 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 126.4 1.88 . . . . 0.0 110.497 177.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.95 -47.03 84.1 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 123.822 0.849 . . . . 0.0 110.832 177.265 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.451 ' O ' HG23 ' A' ' 32' ' ' THR . 0.1 OUTLIER -60.06 -49.68 83.12 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.432 0 CA-C-O 117.185 -1.388 . . . . 0.0 110.318 175.414 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -57.48 -26.69 61.64 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 119.65 1.114 . . . . 0.0 113.295 177.775 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.4 mt -72.19 -64.19 0.99 Allowed 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.052 0.941 . . . . 0.0 110.139 170.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 7.6 mt -55.56 -38.48 49.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.488 0.715 . . . . 0.0 112.33 -178.059 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.451 HG23 ' O ' ' A' ' 28' ' ' ILE . 27.0 p -51.3 -43.68 61.72 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.761 1.225 . . . . 0.0 111.605 178.045 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.3 ttt85 -88.94 19.4 4.14 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 92.7 mm-40 -140.12 -27.71 0.75 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.722 1.609 . . . . 0.0 114.427 -175.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.1 ttt85 -70.81 -137.12 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 126.362 1.865 . . . . 0.0 111.52 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 29.5 p90 -46.69 -32.53 3.62 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 125.37 1.468 . . . . 0.0 112.896 168.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.427 0 O-C-N 119.082 -2.261 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 30.0 p90 . . . . . 0 N--CA 1.484 1.259 0 CA-C-O 118.567 -0.73 . . . . 0.0 110.071 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -72.23 139.78 32.83 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 122.525 2.15 . . . . 0.0 111.146 174.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 36.7 t -61.06 -49.67 76.42 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.102 0.961 . . . . 0.0 111.926 177.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 53.67 79.17 0.36 Allowed Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 126.022 1.729 . . . . 0.0 111.219 -175.626 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -73.6 59.44 4.07 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 124.386 3.391 . . . . 0.0 111.608 177.391 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -131.47 97.18 4.17 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 127.162 2.185 . . . . 0.0 108.62 -179.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -153.81 151.23 24.51 Favored Pre-proline 0 CA--C 1.541 0.6 0 C-N-CA 123.347 0.659 . . . . 0.0 109.383 174.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -72.76 169.55 21.72 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.144 2.563 . . . . 0.0 111.594 171.107 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -55.3 -72.31 0.58 Allowed Glycine 0 CA--C 1.537 1.451 0 C-N-CA 125.063 1.316 . . . . 0.0 113.204 -176.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -118.19 -21.12 8.33 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 172.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 168.69 109.23 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 127.135 2.174 . . . . 0.0 108.897 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.4 ' HB1' ' HD2' ' A' ' 13' ' ' PRO . . . 62.55 166.25 0.11 Allowed Pre-proline 0 CA--C 1.558 1.254 0 C-N-CA 124.711 1.204 . . . . 0.0 113.373 -176.323 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.4 ' HD2' ' HB1' ' A' ' 12' ' ' ALA . 37.5 Cg_endo -74.01 162.96 37.94 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 121.69 1.594 . . . . 0.0 110.42 170.18 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 81.32 17.05 0.49 Allowed 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.899 2.08 . . . . 0.0 114.103 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -111.15 -2.34 15.84 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 126.055 1.742 . . . . 0.0 113.786 -177.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -163.56 -43.44 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.008 1.723 . . . . 0.0 110.523 176.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.46 HD13 ' C ' ' A' ' 17' ' ' LEU . 3.1 tm? -52.27 -40.22 61.44 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.67 0.788 . . . . 0.0 111.895 178.159 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.41 -27.14 14.63 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.601 0.76 . . . . 0.0 112.833 176.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.09 -45.19 35.22 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.642 1.577 . . . . 0.0 111.773 172.627 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.691 ' O ' HD12 ' A' ' 24' ' ' LEU . 3.9 t80 -63.33 -60.11 3.82 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 124.265 1.026 . . . . 0.0 110.698 176.656 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.87 -34.01 18.78 Favored 'General case' 0 C--N 1.343 0.314 0 CA-C-O 118.071 -0.966 . . . . 0.0 112.165 177.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.23 -50.43 40.0 Favored 'General case' 0 C--N 1.343 0.283 0 C-N-CA 125.789 1.635 . . . . 0.0 112.21 172.658 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -49.73 -49.19 49.0 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.931 1.241 . . . . 0.0 111.397 172.225 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.691 HD12 ' O ' ' A' ' 20' ' ' TYR . 2.9 mp -63.93 -49.59 71.99 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-O 118.754 -0.641 . . . . 0.0 110.988 177.055 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.82 -37.96 64.11 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.93 1.292 . . . . 0.0 113.286 175.053 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 20.2 t60 -73.13 -51.91 16.18 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 124.785 1.234 . . . . 0.0 110.881 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -49.82 -60.88 2.49 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 124.54 1.136 . . . . 0.0 110.227 172.084 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -52.17 -39.37 26.92 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 124.173 0.989 . . . . 0.0 111.806 -179.155 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -56.13 -61.37 2.43 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.01 0.823 . . . . 0.0 111.08 175.453 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.4 mt -80.59 30.95 0.29 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.624 1.57 . . . . 0.0 112.09 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 8.1 mt -139.87 -52.51 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 127.304 2.242 . . . . 0.0 109.65 178.42 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.1 t -63.39 -35.5 80.6 Favored 'General case' 0 N--CA 1.467 0.425 0 O-C-N 120.696 -1.253 . . . . 0.0 111.459 -176.361 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.5 mtt85 -80.95 11.05 4.27 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 126.351 1.86 . . . . 0.0 113.905 176.363 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -143.07 15.78 1.9 Allowed 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.62 1.568 . . . . 0.0 113.001 177.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.6 ttt180 -114.88 -140.48 0.38 Allowed 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.537 1.135 . . . . 0.0 111.21 -177.592 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 7.9 p90 -41.4 -33.32 0.4 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 127.4 2.28 . . . . 0.0 113.394 170.233 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.392 0 O-C-N 119.318 -2.114 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.142 0 CA-C-O 116.806 -1.569 . . . . 0.0 112.232 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -74.43 -42.17 0.71 Allowed 'Trans proline' 0 C--O 1.213 -0.771 0 C-N-CA 122.566 2.177 . . . . 0.0 112.884 -176.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 56.2 m 53.2 88.07 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 126.244 1.817 . . . . 0.0 113.357 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.9 mttt -124.26 83.8 56.44 Favored Pre-proline 0 CA--C 1.536 0.416 0 C-N-CA 124.939 1.295 . . . . 0.0 109.494 -177.026 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -71.88 101.16 1.16 Allowed 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 123.592 2.861 . . . . 0.0 109.899 178.061 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -55.12 -61.11 2.54 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.245 1.018 . . . . 0.0 111.366 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.9 p-10 -106.04 153.36 40.25 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 124.951 1.3 . . . . 0.0 110.759 176.22 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -75.49 122.89 7.24 Favored 'Trans proline' 0 N--CA 1.456 -0.689 0 C-N-CA 122.835 2.357 . . . . 0.0 110.685 174.438 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 149.15 123.22 1.24 Allowed Glycine 0 CA--C 1.525 0.702 0 C-N-CA 125.292 1.425 . . . . 0.0 110.399 -179.041 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.56 -24.11 65.15 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 177.717 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -176.7 97.2 0.05 Allowed 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 127.247 2.219 . . . . 0.0 107.096 175.63 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 59.88 166.6 0.09 OUTLIER Pre-proline 0 CA--C 1.564 1.495 0 C-N-CA 124.221 1.008 . . . . 0.0 113.637 -177.246 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -78.81 161.32 27.37 Favored 'Trans proline' 0 N--CA 1.457 -0.674 0 C-N-CA 122.111 1.874 . . . . 0.0 111.124 168.379 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 82.69 23.88 0.17 Allowed 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.916 2.086 . . . . 0.0 113.659 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.59 -2.09 9.99 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.835 1.254 . . . . 0.0 114.254 -176.025 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -173.97 -45.86 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 127.258 2.223 . . . . 0.0 109.123 178.68 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 57.0 tp -57.25 -36.37 70.87 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-O 118.315 -0.85 . . . . 0.0 112.014 178.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -49.4 -43.09 44.13 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 118.679 0.672 . . . . 0.0 110.861 173.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -65.65 -45.68 82.05 Favored 'General case' 0 C--O 1.224 -0.28 0 C-N-CA 124.31 1.044 . . . . 0.0 111.925 177.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -60.89 -58.03 10.17 Favored 'General case' 0 C--O 1.226 -0.137 0 C-N-CA 124.354 1.062 . . . . 0.0 111.841 176.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.61 -35.33 68.15 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.673 1.189 . . . . 0.0 111.368 176.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.18 -49.69 33.6 Favored 'General case' 0 C--O 1.22 -0.464 0 C-N-CA 125.967 1.707 . . . . 0.0 111.456 177.538 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -54.72 -44.01 73.1 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 119.57 1.077 . . . . 0.0 110.17 173.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 mt -67.45 -40.26 85.39 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 118.89 -0.576 . . . . 0.0 111.461 177.405 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.98 -38.17 87.56 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.762 1.225 . . . . 0.0 113.178 172.665 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 51.7 t60 -71.16 -51.65 23.7 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 125.163 1.385 . . . . 0.0 108.961 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -50.34 -53.25 30.28 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 124.538 1.135 . . . . 0.0 111.569 174.029 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -53.63 -51.65 41.03 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 118.837 0.744 . . . . 0.0 110.525 178.66 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.81 -42.14 88.44 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.928 0.891 . . . . 0.0 111.481 177.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 30' ' ' LEU . 6.2 mt -64.96 -54.72 26.1 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.726 1.611 . . . . 0.0 111.572 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 43.8 mt -52.37 -51.22 34.29 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.345 0 C-N-CA 124.821 1.248 . . . . 0.0 108.228 175.379 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 42.4 p -55.83 -38.45 70.03 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.181 0.901 . . . . 0.0 112.365 175.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -72.6 3.74 4.66 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 115.123 1.527 . . . . 0.0 115.123 173.064 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -151.59 34.73 0.56 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.971 1.708 . . . . 0.0 113.406 -178.331 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -129.73 172.35 11.72 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.055 1.342 . . . . 0.0 109.791 178.237 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 15.1 p90 48.0 26.4 0.97 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.23 1.412 . . . . 0.0 114.475 174.498 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.487 0 O-C-N 119.229 -2.169 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 . . . . . 0 N--CA 1.469 0.505 0 CA-C-O 117.84 -1.076 . . . . 0.0 110.564 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -72.92 48.99 1.49 Allowed 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 125.05 3.833 . . . . 0.0 112.73 175.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 97.5 p -163.83 88.32 0.54 Allowed 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.891 1.277 . . . . 0.0 110.027 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -140.67 161.92 51.81 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 124.614 1.166 . . . . 0.0 111.175 178.38 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -68.95 -174.68 0.79 Allowed 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 123.032 2.488 . . . . 0.0 111.787 178.261 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -44.39 126.06 5.04 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.861 0.839 . . . . 0.0 111.442 172.047 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 -106.55 128.4 26.29 Favored Pre-proline 0 CA--C 1.537 0.461 0 CA-C-O 118.102 -0.951 . . . . 0.0 108.826 178.269 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -73.72 61.57 4.55 Favored 'Trans proline' 0 CA--C 1.544 1.022 0 C-N-CA 124.189 3.259 . . . . 0.0 110.833 174.269 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -109.06 -109.75 3.31 Favored Glycine 0 C--N 1.343 0.948 0 C-N-CA 126.234 1.874 . . . . 0.0 110.0 174.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 58.1 99.05 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 126.165 1.786 . . . . 0.0 113.486 -175.394 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -135.89 108.97 7.69 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 -176.403 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.48 154.13 45.83 Favored Pre-proline 0 CA--C 1.554 1.098 0 O-C-N 121.073 -1.017 . . . . 0.0 111.514 176.017 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -74.36 63.79 5.41 Favored 'Trans proline' 0 CA--C 1.548 1.178 0 C-N-CA 123.863 3.042 . . . . 0.0 111.994 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.456 ' HA ' ' HB2' ' A' ' 18' ' ' ALA . . . -166.61 23.37 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 126.755 2.022 . . . . 0.0 113.017 -176.632 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -122.23 -132.97 0.29 Allowed 'General case' 0 CA--C 1.544 0.724 0 O-C-N 121.02 -1.05 . . . . 0.0 111.325 -177.719 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -57.12 -32.14 66.03 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.692 1.197 . . . . 0.0 111.112 175.579 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.65 HD12 ' O ' ' A' ' 17' ' ' LEU . 1.0 OUTLIER -62.02 -46.75 87.79 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 124.707 1.203 . . . . 0.0 112.06 170.658 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.456 ' HB2' ' HA ' ' A' ' 14' ' ' ALA . . . -53.23 -36.12 60.69 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.752 1.16 . . . . 0.0 111.29 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -67.71 -46.04 73.35 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.333 1.053 . . . . 0.0 112.355 172.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -57.5 -53.94 52.48 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.806 1.242 . . . . 0.0 112.177 176.241 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.62 -32.67 67.45 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 118.488 -0.768 . . . . 0.0 111.49 176.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.82 -50.18 45.43 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 125.431 1.492 . . . . 0.0 111.592 174.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.14 -45.57 75.63 Favored 'General case' 0 N--CA 1.462 0.156 0 C-N-CA 123.753 0.821 . . . . 0.0 110.135 176.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.1 mt -66.39 -40.36 89.62 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 119.14 -0.457 . . . . 0.0 111.702 177.184 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -39.94 91.68 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.497 1.119 . . . . 0.0 113.03 172.433 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 42.8 t60 -69.53 -50.38 45.56 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 125.136 1.374 . . . . 0.0 110.499 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -50.6 -59.04 4.45 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 124.342 1.057 . . . . 0.0 110.0 173.345 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -52.6 -46.51 49.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-N 118.444 0.565 . . . . 0.0 111.374 -178.549 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -54.65 -55.25 31.57 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 123.816 0.846 . . . . 0.0 110.361 176.164 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.8 mt -59.08 -46.13 89.06 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.841 1.656 . . . . 0.0 112.8 179.19 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.479 HG23 ' NE ' ' A' ' 35' ' ' ARG . 13.2 mm -52.8 -60.07 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 C-N-CA 125.161 1.384 . . . . 0.0 108.661 172.014 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 26.0 p -57.73 -28.2 63.67 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 119.356 0.98 . . . . 0.0 113.119 175.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -76.37 -1.0 24.69 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 114.992 1.479 . . . . 0.0 114.992 173.623 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -149.58 20.69 0.92 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.778 1.631 . . . . 0.0 113.737 -176.042 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.479 ' NE ' HG23 ' A' ' 31' ' ' ILE . 0.0 OUTLIER -110.48 -3.79 15.86 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.768 1.627 . . . . 0.0 114.489 179.554 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 14.3 p90 -125.62 13.34 8.08 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.076 1.75 . . . . 0.0 111.193 -177.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.56 0 O-C-N 119.115 -2.241 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.478 0.955 0 CA-C-O 117.417 -1.278 . . . . 0.0 112.632 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -72.53 -54.89 0.12 Allowed 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 122.211 1.941 . . . . 0.0 111.779 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 87.9 p -168.81 167.38 11.11 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 126.899 2.079 . . . . 0.0 109.436 175.159 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.1 68.99 22.99 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 124.925 1.29 . . . . 0.0 109.506 171.523 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -71.73 143.64 42.22 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 122.198 1.932 . . . . 0.0 110.503 176.09 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -118.71 -54.72 2.24 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.441 1.496 . . . . 0.0 111.095 -179.85 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -113.47 152.78 45.61 Favored Pre-proline 0 CA--C 1.546 0.79 0 C-N-CA 125.296 1.438 . . . . 0.0 110.227 177.021 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -75.03 157.59 42.54 Favored 'Trans proline' 0 N--CA 1.453 -0.875 0 C-N-CA 122.323 2.015 . . . . 0.0 111.378 173.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 146.35 -67.96 0.4 Allowed Glycine 0 C--N 1.34 0.756 0 CA-C-O 118.553 -1.137 . . . . 0.0 110.322 175.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 59.93 104.67 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 127.514 2.326 . . . . 0.0 112.524 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 26.3 t0 56.53 91.28 0.03 OUTLIER 'General case' 0 C--O 1.216 -0.66 0 C-N-CA 125.074 1.349 . . . . 0.0 111.734 -173.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 62.08 159.6 0.12 Allowed Pre-proline 0 CA--C 1.556 1.183 0 C-N-CA 125.187 1.395 . . . . 0.0 114.246 -171.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -78.16 112.54 3.25 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.45 2.1 . . . . 0.0 110.891 178.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 75.49 47.43 0.1 Allowed 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 126.349 1.86 . . . . 0.0 113.236 177.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.1 -9.34 10.54 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 114.733 1.383 . . . . 0.0 114.733 -177.614 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -140.47 -63.53 0.48 Allowed 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 127.625 2.37 . . . . 0.0 108.925 178.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.595 HD22 ' O ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -58.92 -18.13 30.62 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.704 0.802 . . . . 0.0 112.458 176.806 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.522 ' N ' HD13 ' A' ' 17' ' ' LEU . . . -48.6 -32.12 7.67 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.193 0.997 . . . . 0.0 112.167 175.194 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -77.11 -40.73 44.77 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.242 1.017 . . . . 0.0 113.215 174.445 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -61.52 -56.32 21.34 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.826 1.65 . . . . 0.0 111.848 174.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.42 -35.49 70.12 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.055 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.67 -51.18 52.83 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 125.16 1.384 . . . . 0.0 111.82 174.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -50.75 -46.51 59.35 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 119.454 1.025 . . . . 0.0 110.211 174.598 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.5 mt -67.73 -47.31 69.67 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 118.99 -0.529 . . . . 0.0 111.279 178.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -35.08 68.63 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.029 1.331 . . . . 0.0 113.514 174.568 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -74.54 -52.95 10.43 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 126.033 1.733 . . . . 0.0 110.35 178.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -48.52 -62.51 1.46 Allowed 'General case' 0 C--N 1.344 0.332 0 CA-C-O 117.857 -1.068 . . . . 0.0 109.907 171.794 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -49.76 -43.81 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 124.511 1.124 . . . . 0.0 111.946 -177.121 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -58.43 -59.65 5.01 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.837 1.255 . . . . 0.0 111.661 175.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.0 mt -76.19 23.99 0.14 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.218 1.807 . . . . 0.0 113.179 176.422 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 2.2 mm -125.95 -50.71 1.81 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.325 0 C-N-CA 126.805 2.042 . . . . 0.0 108.23 177.751 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 18.2 p -56.82 -30.31 63.62 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 120.068 1.304 . . . . 0.0 113.228 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.8 mtp85 -81.64 3.89 23.63 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.122 1.369 . . . . 0.0 114.521 174.379 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -154.58 29.66 0.43 Allowed 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 125.83 1.652 . . . . 0.0 113.425 -177.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -101.05 -2.29 31.97 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 120.434 -1.416 . . . . 0.0 113.769 -178.248 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -123.65 21.73 9.21 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 128.084 2.553 . . . . 0.0 111.086 -174.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.513 0 O-C-N 118.686 -2.509 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 117.33 -1.319 . . . . 0.0 110.241 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -69.92 148.23 63.58 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 121.158 1.239 . . . . 0.0 109.616 -174.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 16.4 m -145.13 -55.52 0.32 Allowed 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 124.377 1.071 . . . . 0.0 109.465 177.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt 51.36 72.1 1.32 Allowed Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 126.422 1.889 . . . . 0.0 111.24 -172.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -67.68 163.65 34.35 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 121.786 1.657 . . . . 0.0 110.913 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -118.6 164.48 15.25 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.071 1.348 . . . . 0.0 109.637 174.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -177.54 133.91 0.36 Allowed Pre-proline 0 CA--C 1.538 0.493 0 C-N-CA 126.659 1.984 . . . . 0.0 108.0 175.462 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -71.73 -176.02 1.86 Allowed 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.939 2.426 . . . . 0.0 111.352 169.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -65.99 -96.33 0.03 OUTLIER Glycine 0 CA--C 1.529 0.922 0 CA-C-O 118.814 -0.992 . . . . 0.0 112.424 176.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 159.3 -37.47 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 128.431 2.692 . . . . 0.0 111.829 178.025 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -173.2 -57.16 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 126.027 1.731 . . . . 0.0 108.189 -179.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 65.08 66.72 0.86 Allowed Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 128.07 2.548 . . . . 0.0 112.7 -170.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -75.66 98.78 1.21 Allowed 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 122.702 2.268 . . . . 0.0 111.143 -173.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.66 40.93 0.09 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.016 1.726 . . . . 0.0 112.561 179.277 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -125.26 -5.96 7.17 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.054 1.742 . . . . 0.0 113.062 -177.822 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -156.23 -46.01 0.07 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.438 2.295 . . . . 0.0 110.564 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.568 HD23 ' C ' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -53.16 -27.93 23.71 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.547 0.739 . . . . 0.0 111.781 175.745 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.448 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -50.77 -39.3 52.1 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.038 0.835 . . . . 0.0 110.846 178.028 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.5 tm0? -67.28 -49.1 65.62 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.306 1.042 . . . . 0.0 111.63 174.037 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -56.52 -53.21 60.21 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.972 1.309 . . . . 0.0 111.828 178.601 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.2 -32.1 66.13 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.475 1.11 . . . . 0.0 111.168 175.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.42 -48.13 43.67 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 125.125 1.37 . . . . 0.0 111.533 175.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -54.83 -47.68 73.8 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 124.029 0.932 . . . . 0.0 109.716 175.547 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mt -65.93 -39.6 90.64 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 177.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.35 -43.91 96.06 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.457 1.103 . . . . 0.0 112.304 172.01 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 54.9 t60 -65.43 -50.9 63.69 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.81 1.244 . . . . 0.0 110.513 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -50.91 -57.26 8.96 Favored 'General case' 0 C--N 1.344 0.347 0 C-N-CA 124.386 1.074 . . . . 0.0 110.731 172.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.675 ' O ' HG23 ' A' ' 32' ' ' THR . 0.1 OUTLIER -52.8 -50.16 43.86 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 CA-C-N 118.867 0.758 . . . . 0.0 110.881 178.358 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.06 -36.93 71.11 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.147 0.885 . . . . 0.0 112.715 177.111 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.439 HD23 ' HA ' ' A' ' 30' ' ' LEU . 10.1 mt -72.7 -29.43 63.37 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.584 1.154 . . . . 0.0 113.754 174.521 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 29.2 mm -82.16 -42.27 18.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 C-N-CA 125.341 1.456 . . . . 0.0 110.882 177.421 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.675 HG23 ' O ' ' A' ' 28' ' ' ILE . 59.7 p -49.33 -51.44 34.37 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.915 1.286 . . . . 0.0 111.154 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -84.87 25.97 0.88 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.103 1.361 . . . . 0.0 113.215 175.09 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -157.94 32.08 0.26 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.027 1.331 . . . . 0.0 111.64 -178.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.6 ttt180 -142.52 163.36 33.05 Favored 'General case' 0 C--O 1.235 0.331 0 O-C-N 120.667 -1.271 . . . . 0.0 109.017 178.137 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 39.4 p90 48.27 20.6 0.29 Allowed 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 126.148 1.779 . . . . 0.0 114.114 177.156 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.468 0 O-C-N 118.025 -2.922 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.481 1.097 0 CA-C-O 117.137 -1.411 . . . . 0.0 111.911 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -72.34 171.8 16.23 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.0 1.8 . . . . 0.0 110.467 177.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -159.93 -178.49 7.07 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 124.578 1.151 . . . . 0.0 109.415 175.459 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.8 74.25 0.51 Allowed Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 125.373 1.469 . . . . 0.0 110.798 -178.692 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -71.05 174.88 9.95 Favored 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 121.988 1.792 . . . . 0.0 111.213 175.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -133.38 -60.79 0.83 Allowed 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 126.519 1.927 . . . . 0.0 109.21 -175.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 5.9 m120 51.58 82.99 0.23 Allowed Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 126.431 1.892 . . . . 0.0 111.255 -177.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -66.93 171.75 10.7 Favored 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 122.129 1.886 . . . . 0.0 111.015 -178.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -93.66 -130.06 5.53 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.371 -1.091 . . . . 0.0 110.371 175.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -167.52 106.37 0.55 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.882 1.673 . . . . 0.0 108.386 -179.05 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 167.04 91.53 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 127.517 2.327 . . . . 0.0 108.518 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.44 157.79 87.42 Favored Pre-proline 0 CA--C 1.548 0.882 0 O-C-N 121.456 -0.778 . . . . 0.0 111.25 173.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -75.32 169.05 23.3 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.564 2.176 . . . . 0.0 112.578 175.055 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -155.07 29.88 0.4 Allowed 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.85 1.26 . . . . 0.0 112.284 -178.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -123.18 -150.55 0.45 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.777 1.231 . . . . 0.0 109.225 -178.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -73.79 -45.0 54.3 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.224 1.009 . . . . 0.0 110.489 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.528 HD13 ' N ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -50.41 -25.05 3.48 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.152 1.381 . . . . 0.0 112.9 179.04 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.528 ' N ' HD13 ' A' ' 17' ' ' LEU . . . -66.29 -52.74 44.38 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 126.23 1.812 . . . . 0.0 109.96 176.026 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.34 -28.25 63.94 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.467 0.707 . . . . 0.0 112.693 176.751 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.528 ' O ' HD12 ' A' ' 24' ' ' LEU . 4.2 m-85 -53.14 -51.93 60.38 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.401 1.08 . . . . 0.0 110.133 170.809 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.77 -29.01 67.89 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 118.708 -0.663 . . . . 0.0 112.386 176.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.55 -49.61 21.22 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.742 1.617 . . . . 0.0 111.735 177.296 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -58.67 -46.06 88.05 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.224 0.61 . . . . 0.0 109.976 176.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.528 HD12 ' O ' ' A' ' 20' ' ' TYR . 1.1 mt -62.27 -39.72 93.87 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 118.713 -0.66 . . . . 0.0 111.682 174.276 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.87 -34.57 76.24 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.789 1.235 . . . . 0.0 113.123 173.144 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 45.7 t60 -78.82 -53.12 7.43 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 118.706 -0.664 . . . . 0.0 110.172 178.159 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -46.69 -43.77 18.09 Favored 'General case' 0 C--O 1.214 -0.796 0 C-N-CA 124.679 1.192 . . . . 0.0 111.228 171.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.413 ' O ' HG23 ' A' ' 32' ' ' THR . 0.0 OUTLIER -57.57 -56.84 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 CA-C-N 119.607 1.094 . . . . 0.0 111.001 175.637 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -66.11 -26.38 67.43 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.857 1.263 . . . . 0.0 113.15 -177.063 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 30' ' ' LEU . 5.5 mt -78.49 -55.66 5.04 Favored 'General case' 0 CA--C 1.527 0.074 0 C-N-CA 124.641 1.176 . . . . 0.0 111.208 174.546 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 5.8 mm -56.26 -44.96 80.93 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.552 0 C-N-CA 125.442 1.497 . . . . 0.0 109.818 177.204 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.413 HG23 ' O ' ' A' ' 28' ' ' ILE . 15.3 p -47.85 -48.0 31.19 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 119.482 1.037 . . . . 0.0 111.249 176.289 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.56 24.66 1.9 Allowed 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 177.603 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -162.73 37.36 0.11 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.23 1.412 . . . . 0.0 113.469 -175.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -141.6 -173.11 3.69 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.437 1.495 . . . . 0.0 109.59 178.666 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 28.0 p90 50.78 17.7 0.43 Allowed 'General case' 0 CA--C 1.56 1.359 0 C-N-CA 126.87 2.068 . . . . 0.0 115.243 173.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.563 0 O-C-N 119.328 -2.108 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 . . . . . 0 N--CA 1.486 1.34 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -76.53 -61.22 0.04 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 123.826 3.017 . . . . 0.0 111.052 175.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 8.5 t -162.39 -55.56 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.367 0.667 . . . . 0.0 111.723 178.357 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.5 mtpm? -64.13 156.16 75.94 Favored Pre-proline 0 CA--C 1.542 0.66 0 C-N-CA 123.856 0.863 . . . . 0.0 111.273 176.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -75.67 81.27 2.38 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.993 2.462 . . . . 0.0 110.722 176.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -112.16 136.95 50.91 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.93 1.292 . . . . 0.0 110.559 173.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -143.15 156.3 61.49 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 124.133 0.973 . . . . 0.0 109.219 176.47 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -72.83 145.11 40.1 Favored 'Trans proline' 0 N--CA 1.442 -1.529 0 C-N-CA 122.752 2.301 . . . . 0.0 111.262 171.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -169.82 -73.64 0.04 OUTLIER Glycine 0 CA--C 1.525 0.715 0 N-CA-C 109.849 -1.3 . . . . 0.0 109.849 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 58.71 96.58 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.512 1.525 . . . . 0.0 112.783 -175.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -125.5 -63.85 1.11 Allowed 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 124.258 1.023 . . . . 0.0 108.627 178.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 67.38 155.28 0.14 Allowed Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 126.849 2.059 . . . . 0.0 112.404 -171.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -73.29 142.88 34.35 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 C-N-CA 121.51 1.473 . . . . 0.0 109.808 175.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 82.49 15.86 0.4 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.403 1.881 . . . . 0.0 113.952 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -114.43 -2.91 13.1 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.715 1.206 . . . . 0.0 113.978 -173.784 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -167.22 -40.93 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 127.444 2.298 . . . . 0.0 111.141 -179.402 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.456 HD13 ' O ' ' A' ' 17' ' ' LEU . 3.4 tm? -54.72 -35.85 64.11 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.283 -0.885 . . . . 0.0 112.033 178.028 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.4 32.84 0.02 OUTLIER 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 127.82 2.448 . . . . 0.0 113.573 174.215 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.41 ' H ' ' C ' ' A' ' 17' ' ' LEU . 3.1 tt0 -154.99 -36.95 0.09 Allowed 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 127.525 2.33 . . . . 0.0 111.547 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -56.37 -54.77 41.61 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 123.892 0.877 . . . . 0.0 111.301 178.056 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.78 -29.07 69.21 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 176.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.02 -49.47 19.7 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.834 1.654 . . . . 0.0 112.037 177.377 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -54.66 -48.43 72.35 Favored 'General case' 0 CA--C 1.528 0.105 0 C-N-CA 124.717 1.207 . . . . 0.0 109.17 175.013 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.1 mt -64.01 -38.83 92.5 Favored 'General case' 0 C--N 1.347 0.478 0 CA-C-O 119.021 -0.514 . . . . 0.0 111.673 177.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.54 -37.48 86.27 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.414 1.086 . . . . 0.0 113.138 172.184 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 35.9 t60 -71.7 -52.05 19.8 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.197 1.399 . . . . 0.0 110.291 178.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.49 -52.04 56.42 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 124.605 1.162 . . . . 0.0 111.039 174.523 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -55.99 -44.79 79.43 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.525 0 CA-C-N 118.638 0.654 . . . . 0.0 111.43 176.729 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -63.43 -29.62 70.88 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 118.64 0.654 . . . . 0.0 112.386 177.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.3 mt -75.36 -50.95 14.35 Favored 'General case' 0 CA--C 1.527 0.096 0 C-N-CA 124.379 1.072 . . . . 0.0 111.656 174.567 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.2 mp -64.19 -48.85 83.84 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.607 0 C-N-CA 124.893 1.277 . . . . 0.0 109.355 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -54.41 -36.15 63.66 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 120.007 1.276 . . . . 0.0 111.649 176.048 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 4.0 ttp180 -79.51 5.67 12.32 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 114.438 1.274 . . . . 0.0 114.438 176.095 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 46.0 tp60 -161.69 54.08 0.25 Allowed 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 127.141 2.176 . . . . 0.0 112.28 -178.459 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -147.63 176.24 10.24 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.108 0.963 . . . . 0.0 108.821 174.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 22.3 p90 48.19 25.01 0.75 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.39 1.476 . . . . 0.0 113.919 176.314 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.802 0 O-C-N 118.84 -2.412 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 20.4 p90 . . . . . 0 N--CA 1.482 1.174 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -74.82 163.99 34.48 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 121.65 1.567 . . . . 0.0 111.349 176.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 7.5 t -166.93 95.64 0.5 Allowed 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 124.548 1.139 . . . . 0.0 110.015 178.32 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.0 mmtt 175.52 -60.28 0.0 OUTLIER Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 126.933 2.093 . . . . 0.0 111.487 -177.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -73.07 151.54 49.98 Favored 'Trans proline' 0 N--CA 1.452 -0.924 0 C-N-CA 122.606 2.204 . . . . 0.0 110.614 175.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -160.15 162.52 33.94 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.349 1.859 . . . . 0.0 108.81 176.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -58.25 154.96 28.7 Favored Pre-proline 0 CA--C 1.546 0.81 0 C-N-CA 123.497 0.719 . . . . 0.0 112.184 173.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -72.75 103.46 1.57 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 122.28 1.987 . . . . 0.0 110.561 176.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 157.47 -79.07 0.18 Allowed Glycine 0 CA--C 1.525 0.709 0 C-N-CA 124.743 1.163 . . . . 0.0 111.91 177.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -169.54 -39.82 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.364 1.065 . . . . 0.0 113.059 176.231 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.573 ' O ' HD22 ' A' ' 17' ' ' LEU . 28.3 t0 -174.54 98.3 0.09 Allowed 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 127.182 2.193 . . . . 0.0 107.595 174.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.716 ' HB1' ' HB3' ' A' ' 15' ' ' GLU . . . 46.2 64.53 8.0 Favored Pre-proline 0 CA--C 1.565 1.52 0 N-CA-C 114.541 1.311 . . . . 0.0 114.541 175.683 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -66.26 110.53 1.8 Allowed 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.067 2.511 . . . . 0.0 110.569 -171.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 68.69 33.05 3.94 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.344 1.457 . . . . 0.0 112.899 -176.221 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.716 ' HB3' ' HB1' ' A' ' 12' ' ' ALA . 1.9 tt0 -121.98 -139.9 0.32 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.286 1.434 . . . . 0.0 110.568 -179.076 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -59.92 -16.52 30.29 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.874 1.27 . . . . 0.0 112.309 -178.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.573 HD22 ' O ' ' A' ' 11' ' ' ASP . 61.1 tp -55.65 -25.44 39.26 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 126.149 1.779 . . . . 0.0 112.807 169.77 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.43 30.4 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 126.716 2.006 . . . . 0.0 113.798 171.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.436 ' H ' ' C ' ' A' ' 17' ' ' LEU . 19.0 tp60 -149.41 -39.58 0.15 Allowed 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 126.952 2.101 . . . . 0.0 111.106 175.323 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.414 ' HB3' HD12 ' A' ' 17' ' ' LEU . 69.4 t80 -56.18 -55.41 33.41 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.603 1.161 . . . . 0.0 110.677 -179.528 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.78 -31.17 69.43 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.832 177.597 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.49 -48.16 35.59 Favored 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 126.631 1.972 . . . . 0.0 111.953 178.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.04 -47.0 78.68 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 125.145 1.378 . . . . 0.0 109.998 174.726 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.3 mt -65.3 -39.65 92.8 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.397 0.279 . . . . 0.0 111.556 176.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.02 -41.6 96.86 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.125 1.37 . . . . 0.0 113.379 172.226 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 44.5 t60 -69.8 -48.51 58.84 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 124.776 1.23 . . . . 0.0 110.493 178.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.47 -55.33 19.43 Favored 'General case' 0 C--O 1.223 -0.322 0 C-N-CA 124.016 0.926 . . . . 0.0 110.717 171.406 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -55.99 -42.81 73.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 CA-C-N 119.272 0.942 . . . . 0.0 111.34 179.254 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -61.71 -31.4 71.55 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 176.111 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.6 mt -75.62 -54.27 7.25 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 125.161 1.384 . . . . 0.0 110.663 173.005 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 20.0 mt -58.11 -48.39 84.56 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.447 0 C-N-CA 125.303 1.441 . . . . 0.0 110.194 -179.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -54.77 -30.61 57.13 Favored 'General case' 0 N--CA 1.48 1.042 0 O-C-N 120.812 -1.18 . . . . 0.0 112.155 176.219 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.9 -0.03 37.34 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 176.606 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -159.8 45.68 0.24 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.905 2.082 . . . . 0.0 113.245 -176.569 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -145.87 -179.05 6.44 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 120.747 -1.221 . . . . 0.0 109.513 177.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 25.7 p90 49.08 17.09 0.15 Allowed 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 127.275 2.23 . . . . 0.0 115.478 175.462 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.546 0 O-C-N 118.705 -2.497 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 . . . . . 0 N--CA 1.481 1.115 0 CA-C-O 119.363 -0.351 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -75.2 -60.36 0.04 OUTLIER 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 121.684 1.589 . . . . 0.0 111.551 177.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 52.2 p -175.79 58.96 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.063 1.345 . . . . 0.0 110.48 -177.027 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.7 pttt -149.95 84.24 5.93 Favored Pre-proline 0 CA--C 1.543 0.697 0 C-N-CA 124.885 1.274 . . . . 0.0 109.778 -179.689 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -66.28 155.76 68.36 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 121.15 1.233 . . . . 0.0 110.227 176.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -59.2 169.23 1.17 Allowed 'General case' 0 C--O 1.237 0.404 0 CA-C-O 122.12 0.962 . . . . 0.0 111.856 174.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -113.74 98.25 46.75 Favored Pre-proline 0 CA--C 1.537 0.452 0 C-N-CA 123.851 0.86 . . . . 0.0 109.544 177.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -74.08 54.88 3.3 Favored 'Trans proline' 0 CA--C 1.551 1.345 0 C-N-CA 123.66 2.907 . . . . 0.0 111.724 174.634 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 111.73 -78.12 0.24 Allowed Glycine 0 N--CA 1.47 0.92 0 C-N-CA 125.444 1.497 . . . . 0.0 111.419 -179.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -138.93 6.2 2.4 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -85.37 69.11 10.67 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.569 1.548 . . . . 0.0 109.837 177.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -155.41 159.17 31.92 Favored Pre-proline 0 CA--C 1.538 0.508 0 O-C-N 120.967 -1.083 . . . . 0.0 111.824 173.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -71.85 161.24 45.6 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 121.586 1.524 . . . . 0.0 110.947 171.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 77.0 28.34 0.65 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.098 1.759 . . . . 0.0 113.478 179.309 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -118.42 -6.25 10.77 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.105 1.362 . . . . 0.0 114.065 -177.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -163.99 -43.46 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.957 2.103 . . . . 0.0 110.57 -178.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.494 HD13 ' C ' ' A' ' 17' ' ' LEU . 2.8 tm? -51.68 -43.53 62.77 Favored 'General case' 0 C--O 1.222 -0.38 0 C-N-CA 123.322 0.649 . . . . 0.0 110.825 178.568 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -48.93 -45.55 41.82 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 118.612 -0.709 . . . . 0.0 112.4 175.489 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -60.63 -40.34 91.56 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.774 0.829 . . . . 0.0 111.832 175.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -62.88 -52.28 63.72 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.007 1.723 . . . . 0.0 111.641 174.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.88 -33.6 74.51 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.295 1.038 . . . . 0.0 111.035 176.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.39 -49.52 33.28 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 126.643 1.977 . . . . 0.0 111.359 176.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.7 -49.93 69.5 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 119.674 1.125 . . . . 0.0 109.503 174.434 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.2 mt -63.18 -39.48 94.77 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 118.487 -0.768 . . . . 0.0 112.44 177.29 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -50.07 75.14 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 119.169 0.895 . . . . 0.0 112.066 171.491 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 26.2 t60 -58.55 -46.89 85.91 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.161 0.984 . . . . 0.0 110.015 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -70.88 19.79 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.716 1.606 . . . . 0.0 115.019 176.133 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -144.65 -48.99 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 125.707 1.603 . . . . 0.0 110.387 -179.155 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -68.17 -23.36 64.85 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.501 1.52 . . . . 0.0 111.626 176.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.4 mt -79.12 -47.98 15.12 Favored 'General case' 0 C--N 1.344 0.328 0 CA-C-N 118.797 0.726 . . . . 0.0 111.041 171.015 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.3 mm -63.71 -42.38 95.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 C-N-CA 122.985 0.514 . . . . 0.0 110.701 -176.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -54.78 -38.05 66.78 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.32 -0.863 . . . . 0.0 111.972 174.452 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.35 18.78 1.35 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.616 1.966 . . . . 0.0 113.689 176.049 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -142.89 -39.74 0.33 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.991 0.916 . . . . 0.0 113.386 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.76 -144.51 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.474 1.91 . . . . 0.0 111.29 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 25.8 p90 -40.48 -33.83 0.3 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.984 1.314 . . . . 0.0 114.207 171.281 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.388 0 O-C-N 119.439 -2.038 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.483 1.214 0 CA-C-O 117.072 -1.442 . . . . 0.0 111.451 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -72.98 -40.49 1.76 Allowed 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 122.283 1.988 . . . . 0.0 112.27 -177.09 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.2 p -132.34 80.19 1.89 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.886 1.675 . . . . 0.0 109.078 177.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.3 pttm -57.73 150.65 46.28 Favored Pre-proline 0 CA--C 1.543 0.682 0 O-C-N 121.599 -0.688 . . . . 0.0 111.01 176.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -71.42 -31.95 13.16 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 122.123 1.882 . . . . 0.0 113.001 -178.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 67.52 -62.8 0.32 Allowed 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 126.751 2.02 . . . . 0.0 111.691 -178.244 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 26.5 m-20 -77.39 132.99 68.36 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 124.748 1.219 . . . . 0.0 110.999 172.085 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -70.38 -178.87 2.8 Favored 'Trans proline' 0 CA--C 1.547 1.148 0 C-N-CA 123.35 2.7 . . . . 0.0 111.426 170.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -39.86 -64.22 1.11 Allowed Glycine 0 N--CA 1.475 1.282 0 C-N-CA 125.344 1.449 . . . . 0.0 112.857 177.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.4 mp0 -136.08 -59.27 0.75 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.714 1.206 . . . . 0.0 111.955 174.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -159.63 78.87 0.71 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.522 1.129 . . . . 0.0 111.553 178.16 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 59.8 164.62 0.09 OUTLIER Pre-proline 0 CA--C 1.561 1.387 0 C-N-CA 125.769 1.627 . . . . 0.0 113.409 -173.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -78.5 57.08 6.14 Favored 'Trans proline' 0 CA--C 1.55 1.283 0 C-N-CA 123.136 2.557 . . . . 0.0 112.294 177.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -173.91 26.17 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.349 1.46 . . . . 0.0 114.441 -176.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -166.93 156.0 10.5 Favored 'General case' 0 N--CA 1.461 0.088 0 N-CA-C 106.56 -1.644 . . . . 0.0 106.56 -179.199 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.0 t70 65.89 -57.6 0.34 Allowed 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 129.559 3.144 . . . . 0.0 112.135 -176.371 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.533 HD23 ' C ' ' A' ' 17' ' ' LEU . 2.5 tt -58.32 -46.75 85.58 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 125.678 1.591 . . . . 0.0 110.107 172.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.2 -38.08 65.26 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 119.389 0.995 . . . . 0.0 110.252 -177.538 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.83 -50.34 64.95 Favored 'General case' 0 C--O 1.221 -0.442 0 C-N-CA 124.408 1.083 . . . . 0.0 111.25 172.885 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 91.5 t80 -57.0 -60.23 3.9 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 124.666 1.187 . . . . 0.0 111.934 178.051 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.72 -36.02 66.76 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.077 1.351 . . . . 0.0 111.012 177.613 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.08 -49.19 38.36 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 124.471 1.108 . . . . 0.0 111.912 176.351 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -51.28 -47.2 62.6 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 125.207 1.403 . . . . 0.0 109.192 173.194 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.1 mt -67.33 -43.58 81.21 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.185 177.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.43 -34.2 72.2 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 172.767 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 41.5 t60 -75.24 -52.72 10.21 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 125.792 1.637 . . . . 0.0 110.139 178.418 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -51.18 -52.81 40.74 Favored 'General case' 0 C--O 1.221 -0.431 0 C-N-CA 124.189 0.996 . . . . 0.0 111.702 172.626 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -57.51 -44.44 84.85 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.353 0 CA-C-O 118.64 -0.695 . . . . 0.0 110.727 178.498 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.14 -34.3 73.35 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 118.544 0.611 . . . . 0.0 112.018 176.441 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.98 -60.9 2.02 Favored 'General case' 0 C--O 1.215 -0.732 0 C-N-CA 124.249 1.02 . . . . 0.0 110.845 174.568 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 35.0 mm -54.0 -45.02 64.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 C-N-CA 124.625 1.17 . . . . 0.0 110.387 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.8 t -65.16 -40.72 94.71 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 120.417 -1.427 . . . . 0.0 112.574 176.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -85.23 13.23 6.65 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.222 1.409 . . . . 0.0 112.515 176.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.66 39.11 1.04 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.176 1.39 . . . . 0.0 110.514 -179.405 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -156.77 -141.86 0.1 Allowed 'General case' 0 N--CA 1.464 0.231 0 O-C-N 121.217 -0.927 . . . . 0.0 111.018 177.456 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 36.4 p90 -39.36 -38.07 0.51 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 127.527 2.331 . . . . 0.0 113.26 168.483 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.17 0 O-C-N 119.203 -2.185 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 5.2 p90 . . . . . 0 CA--C 1.548 0.878 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -71.02 102.99 1.31 Allowed 'Trans proline' 0 C--N 1.353 0.777 0 C-N-CA 122.789 2.326 . . . . 0.0 110.561 -179.358 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -167.16 -55.49 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.144 0.978 . . . . 0.0 110.723 176.057 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 37.92 64.01 3.36 Favored Pre-proline 0 CA--C 1.551 0.992 0 C-N-CA 126.849 2.06 . . . . 0.0 112.163 -174.217 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -67.82 -54.3 0.35 Allowed 'Trans proline' 0 N--CA 1.441 -1.571 0 C-N-CA 122.459 2.106 . . . . 0.0 110.213 -172.441 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 45.44 83.93 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.097 1.759 . . . . 0.0 110.702 -178.564 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -102.78 92.77 3.73 Favored Pre-proline 0 CA--C 1.544 0.736 0 O-C-N 121.74 -0.6 . . . . 0.0 110.406 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -71.28 178.7 5.2 Favored 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 123.092 2.528 . . . . 0.0 111.769 177.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -85.32 36.14 3.1 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 124.203 0.906 . . . . 0.0 113.873 177.333 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -99.5 -6.99 26.59 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.305 1.042 . . . . 0.0 112.929 -178.803 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -143.65 93.9 2.53 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.75 2.02 . . . . 0.0 107.613 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 55.79 86.32 0.17 Allowed Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 125.348 1.459 . . . . 0.0 113.637 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -72.16 67.77 3.36 Favored 'Trans proline' 0 CA--C 1.546 1.083 0 C-N-CA 124.155 3.237 . . . . 0.0 112.801 -177.153 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -171.38 39.32 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 126.847 2.059 . . . . 0.0 111.312 -174.402 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -117.64 -137.33 0.35 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.976 0.91 . . . . 0.0 109.366 179.373 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -54.58 -37.99 66.17 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.828 1.251 . . . . 0.0 111.345 -178.364 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.474 HD23 ' N ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -48.71 -30.98 6.15 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.78 1.632 . . . . 0.0 112.963 172.55 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.474 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -63.05 -42.99 99.83 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.693 0.797 . . . . 0.0 110.803 177.244 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -78.44 -29.04 46.79 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 123.4 0.68 . . . . 0.0 111.566 173.56 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.463 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 12.7 m-30 -62.25 -50.17 72.81 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 119.363 0.983 . . . . 0.0 110.27 178.671 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.67 -34.22 64.8 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 118.382 -0.818 . . . . 0.0 111.707 173.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.58 -48.46 32.61 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.138 1.375 . . . . 0.0 112.081 177.459 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.53 -49.08 65.55 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.947 0.899 . . . . 0.0 110.534 172.544 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.4 mt -61.89 -49.03 77.83 Favored 'General case' 0 C--N 1.346 0.434 0 CA-C-O 118.916 -0.564 . . . . 0.0 110.923 175.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.1 -30.32 61.89 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 174.344 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 40.3 t60 -79.41 -53.48 6.87 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 124.836 1.255 . . . . 0.0 110.756 177.326 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -51.72 -50.08 61.24 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 124.434 1.094 . . . . 0.0 110.448 175.661 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -55.68 -45.77 79.26 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.413 0 CA-C-N 118.766 0.712 . . . . 0.0 111.564 177.061 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -68.53 -23.98 64.59 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 178.576 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.7 mt -75.87 -52.35 10.54 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.36 1.464 . . . . 0.0 110.868 171.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.9 mp -64.15 -47.19 91.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 124.408 1.083 . . . . 0.0 111.344 177.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.7 t -54.13 -42.73 69.84 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 119.896 1.226 . . . . 0.0 110.935 -179.13 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -88.56 27.13 1.33 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.75 1.22 . . . . 0.0 112.948 179.162 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -145.61 -41.54 0.22 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.729 1.611 . . . . 0.0 113.816 -178.02 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -69.62 -152.83 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.655 1.582 . . . . 0.0 109.64 174.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -11.68 80.7 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 128.826 2.851 . . . . 0.0 116.33 173.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.508 0 O-C-N 118.29 -2.756 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.479 0.997 0 CA-C-O 116.846 -1.55 . . . . 0.0 112.086 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -72.49 -61.92 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 122.227 1.951 . . . . 0.0 111.229 -176.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.2 t -170.52 -82.45 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 125.379 1.471 . . . . 0.0 108.678 178.229 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.47 160.05 30.99 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 125.931 1.693 . . . . 0.0 110.357 178.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -77.82 107.96 2.45 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 124.5 3.467 . . . . 0.0 111.216 177.295 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -178.26 160.0 1.3 Allowed 'General case' 0 C--O 1.239 0.501 0 C-N-CA 126.65 1.98 . . . . 0.0 108.597 176.089 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -174.48 90.32 0.32 Allowed Pre-proline 0 N--CA 1.468 0.453 0 C-N-CA 124.823 1.249 . . . . 0.0 109.308 174.2 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -71.27 172.34 14.27 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 121.913 1.742 . . . . 0.0 111.507 175.532 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.45 -119.3 4.37 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 110.662 -0.975 . . . . 0.0 110.662 176.003 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -178.79 -48.16 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 126.919 2.088 . . . . 0.0 110.46 179.051 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.95 107.6 0.36 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.075 1.75 . . . . 0.0 109.465 -179.338 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -161.9 76.27 2.23 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 123.98 0.912 . . . . 0.0 111.278 174.182 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -74.88 46.9 1.59 Allowed 'Trans proline' 0 CA--C 1.548 1.218 0 C-N-CA 123.432 2.755 . . . . 0.0 113.794 -178.348 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -174.75 122.65 0.25 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.92 1.688 . . . . 0.0 109.025 -176.115 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 67.09 143.26 0.03 OUTLIER 'General case' 0 C--N 1.346 0.434 0 C-N-CA 126.539 1.936 . . . . 0.0 110.407 -173.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.9 t70 74.35 -47.45 0.64 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.266 1.826 . . . . 0.0 111.233 179.814 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 59.2 tp -55.64 -41.33 73.41 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 125.14 1.376 . . . . 0.0 111.441 175.076 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.58 -41.59 63.74 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 119.206 0.912 . . . . 0.0 110.371 174.417 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.6 -45.71 74.71 Favored 'General case' 0 C--O 1.221 -0.417 0 C-N-CA 123.773 0.829 . . . . 0.0 111.693 176.266 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -61.29 -59.16 5.72 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.272 1.029 . . . . 0.0 111.444 177.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.64 -36.15 66.72 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 125.163 1.385 . . . . 0.0 110.96 176.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.4 -47.1 51.9 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-O 117.785 -1.102 . . . . 0.0 112.13 176.284 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -54.54 -46.92 73.69 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 119.758 1.163 . . . . 0.0 109.312 173.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.3 mt -65.48 -42.49 92.16 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 118.855 -0.593 . . . . 0.0 111.041 177.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.06 -44.12 91.79 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.109 0.963 . . . . 0.0 112.406 173.292 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 41.2 t60 -66.7 -52.57 43.08 Favored 'General case' 0 C--O 1.231 0.103 0 C-N-CA 125.576 1.551 . . . . 0.0 109.952 -179.201 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -50.16 -56.71 9.86 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-O 118.156 -0.926 . . . . 0.0 110.946 171.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -53.74 -48.1 61.42 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 CA-C-N 119.167 0.894 . . . . 0.0 110.293 -179.227 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -55.41 -35.2 65.11 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.334 1.054 . . . . 0.0 112.574 178.056 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 70.4 mt -77.05 -54.17 6.88 Favored 'General case' 0 C--O 1.22 -0.461 0 C-N-CA 124.443 1.097 . . . . 0.0 111.01 175.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 21.3 mt -49.85 -41.32 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 125.946 1.698 . . . . 0.0 109.411 176.185 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 36.5 p -63.45 -35.83 81.73 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 120.805 -1.185 . . . . 0.0 112.699 175.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 13.8 ttt180 -79.85 9.86 4.8 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.952 1.701 . . . . 0.0 114.3 174.093 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -142.82 26.98 1.68 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.965 1.306 . . . . 0.0 112.445 177.4 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 18.6 ttt180 -128.19 -142.12 0.26 Allowed 'General case' 0 C--N 1.349 0.546 0 C-N-CA 124.159 0.984 . . . . 0.0 111.054 -179.338 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 37.4 p90 -43.37 -32.32 0.81 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 127.753 2.421 . . . . 0.0 114.191 171.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.458 0 O-C-N 120.152 -1.592 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 118.42 -0.8 . . . . 0.0 109.325 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -77.22 -58.37 0.04 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 122.731 2.288 . . . . 0.0 111.597 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -159.33 -51.98 0.06 Allowed 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.966 0.906 . . . . 0.0 110.96 174.363 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 30.73 83.24 0.2 Allowed Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 128.233 2.613 . . . . 0.0 111.802 -176.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -75.68 60.95 6.08 Favored 'Trans proline' 0 CA--C 1.542 0.92 0 C-N-CA 122.916 2.411 . . . . 0.0 111.318 -177.546 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -123.14 171.2 9.49 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 128.376 2.67 . . . . 0.0 109.071 179.373 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -50.38 128.84 24.68 Favored Pre-proline 0 CA--C 1.551 0.992 0 C-N-CA 123.611 0.764 . . . . 0.0 111.66 -179.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -68.53 130.86 21.74 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 121.768 1.646 . . . . 0.0 110.068 179.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -126.45 -138.55 4.85 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 125.411 1.482 . . . . 0.0 109.563 176.152 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -160.94 -48.78 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.762 1.225 . . . . 0.0 111.237 177.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -121.36 -64.51 1.22 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.999 1.719 . . . . 0.0 108.799 177.403 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.594 ' HB1' ' HD2' ' A' ' 13' ' ' PRO . . . -137.96 173.04 5.78 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 125.397 1.479 . . . . 0.0 111.879 -176.826 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.594 ' HD2' ' HB1' ' A' ' 12' ' ' ALA . 37.0 Cg_endo -74.82 144.82 31.4 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 122.416 2.077 . . . . 0.0 110.528 170.505 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 78.12 46.79 0.05 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.938 1.695 . . . . 0.0 113.383 177.515 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -122.92 -5.34 8.52 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 114.982 1.475 . . . . 0.0 114.982 -176.045 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -138.05 -75.02 0.4 Allowed 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 126.835 2.054 . . . . 0.0 108.972 177.691 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.484 HD22 ' C ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -51.75 -26.05 8.74 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.256 1.422 . . . . 0.0 113.184 -177.809 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.23 -58.43 8.32 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 126.288 1.835 . . . . 0.0 110.51 172.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.54 -29.97 70.18 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 123.498 0.719 . . . . 0.0 112.247 177.161 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.452 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 4.7 m-85 -53.7 -49.43 68.08 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.715 0.806 . . . . 0.0 110.467 171.224 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.56 -29.62 70.71 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 175.532 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -76.49 -47.44 22.83 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.445 1.498 . . . . 0.0 112.519 178.482 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.6 -50.31 70.46 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 124.319 1.048 . . . . 0.0 109.946 172.759 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.6 mt -62.84 -37.46 86.92 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 118.746 -0.645 . . . . 0.0 111.431 177.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -45.32 94.79 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.539 1.136 . . . . 0.0 113.078 171.961 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 38.6 t60 -64.62 -51.13 64.27 Favored 'General case' 0 C--N 1.334 -0.107 0 C-N-CA 124.097 0.959 . . . . 0.0 109.923 179.245 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -50.97 -56.5 12.11 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 123.956 0.902 . . . . 0.0 110.982 173.329 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -55.33 -42.93 69.18 Favored 'Isoleucine or valine' 0 C--N 1.343 0.32 0 CA-C-N 118.746 0.703 . . . . 0.0 112.472 179.243 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -63.82 -37.59 87.94 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 122.995 0.518 . . . . 0.0 112.049 175.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.7 mt -66.8 -51.58 53.98 Favored 'General case' 0 C--O 1.226 -0.164 0 C-N-CA 124.414 1.086 . . . . 0.0 110.281 176.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 13.6 mm -64.77 -55.53 20.58 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.506 0 C-N-CA 124.118 0.967 . . . . 0.0 110.432 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.7 t -51.34 -41.06 60.32 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 120.658 1.572 . . . . 0.0 111.885 -179.016 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 17.3 ttt180 -84.71 14.73 4.4 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.567 1.147 . . . . 0.0 113.682 177.482 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -156.71 30.5 0.32 Allowed 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 126.469 1.908 . . . . 0.0 112.942 -176.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.6 ttt180 -123.95 -137.53 0.29 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.218 1.007 . . . . 0.0 110.257 -179.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 46.6 p90 -22.09 85.47 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 130.091 3.356 . . . . 0.0 114.347 172.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.316 -0.869 0 O-C-N 117.762 -3.087 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 . . . . . 0 N--CA 1.473 0.686 0 CA-C-O 119.276 -0.393 . . . . 0.0 110.424 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -73.23 -62.15 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.6 2.2 . . . . 0.0 111.808 -179.592 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 26.6 t -168.03 -53.48 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.261 1.424 . . . . 0.0 110.891 176.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 18.1 mttp -127.09 70.81 75.35 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 126.822 2.049 . . . . 0.0 110.166 -179.006 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -73.86 75.77 3.07 Favored 'Trans proline' 0 C--N 1.355 0.89 0 C-N-CA 124.075 3.184 . . . . 0.0 111.199 179.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -163.84 91.84 0.66 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.612 1.165 . . . . 0.0 109.463 178.478 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -158.86 131.08 4.25 Favored Pre-proline 0 C--O 1.241 0.636 0 O-C-N 121.103 -0.998 . . . . 0.0 109.753 176.042 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -68.8 138.75 41.84 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 121.852 1.701 . . . . 0.0 110.093 172.742 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.56 -128.92 3.34 Favored Glycine 0 C--N 1.334 0.419 0 N-CA-C 108.744 -1.742 . . . . 0.0 108.744 173.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 63.65 114.86 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 126.32 1.848 . . . . 0.0 111.158 -175.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 48.08 79.63 0.07 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.342 1.057 . . . . 0.0 113.584 179.192 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.24 142.3 38.48 Favored Pre-proline 0 CA--C 1.544 0.745 0 O-C-N 121.576 -0.702 . . . . 0.0 112.356 -176.081 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -69.12 116.4 4.47 Favored 'Trans proline' 0 C--N 1.355 0.91 0 C-N-CA 122.986 2.458 . . . . 0.0 111.208 -174.004 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -165.59 44.3 0.08 Allowed 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.113 0.965 . . . . 0.0 112.504 -178.901 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -119.33 -134.07 0.32 Allowed 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.33 -0.856 . . . . 0.0 111.693 -175.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -48.55 -43.81 35.96 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.607 1.563 . . . . 0.0 111.397 174.632 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.544 HD23 ' C ' ' A' ' 17' ' ' LEU . 4.0 tt -52.76 -46.59 67.59 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-O 117.96 -1.019 . . . . 0.0 111.382 172.172 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.65 -40.96 72.93 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.746 1.157 . . . . 0.0 110.138 -178.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -45.77 78.2 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.196 0.999 . . . . 0.0 112.326 174.252 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -60.07 -53.3 59.39 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.523 1.129 . . . . 0.0 111.835 177.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.42 -31.98 64.43 Favored 'General case' 0 C--O 1.219 -0.513 0 C-N-CA 124.986 1.315 . . . . 0.0 111.203 175.088 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.93 -51.03 24.13 Favored 'General case' 0 C--O 1.219 -0.534 0 C-N-CA 124.996 1.318 . . . . 0.0 111.699 174.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -52.2 -47.76 65.43 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.851 0.86 . . . . 0.0 109.888 174.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.1 mt -65.83 -40.57 91.9 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.681 -0.676 . . . . 0.0 111.466 177.681 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.3 -37.07 79.41 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.621 1.168 . . . . 0.0 113.042 172.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -73.12 -51.67 17.1 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.151 1.381 . . . . 0.0 110.197 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -52.01 -54.69 26.87 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.767 0.827 . . . . 0.0 110.764 173.346 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -54.71 -42.85 63.62 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 119.244 0.929 . . . . 0.0 111.748 178.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -60.79 -40.96 94.6 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.035 0.534 . . . . 0.0 111.598 174.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.9 -28.56 65.72 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.627 1.171 . . . . 0.0 113.867 175.624 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 46.7 mm -83.24 -33.25 9.97 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 C-N-CA 124.492 1.117 . . . . 0.0 110.924 175.383 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.2 -39.44 54.7 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 120.771 -1.206 . . . . 0.0 111.999 176.587 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.81 -13.02 61.79 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 176.181 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 -76.31 -35.33 58.88 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.774 1.23 . . . . 0.0 111.456 177.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -84.62 -134.26 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.592 0.757 . . . . 0.0 110.597 -178.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 44.5 p90 -43.81 -34.8 1.68 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 126.845 2.058 . . . . 0.0 113.339 170.729 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.4 0 O-C-N 119.47 -2.019 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 . . . . . 0 N--CA 1.482 1.14 0 CA-C-O 118.715 -0.66 . . . . 0.0 110.668 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -73.25 -49.88 0.21 Allowed 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 122.442 2.094 . . . . 0.0 112.566 -179.21 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 170.39 -33.54 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 128.243 2.617 . . . . 0.0 112.164 176.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.0 mttm -126.04 79.03 69.8 Favored Pre-proline 0 CA--C 1.537 0.474 0 C-N-CA 126.221 1.808 . . . . 0.0 109.057 175.601 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -73.49 130.52 15.04 Favored 'Trans proline' 0 N--CA 1.453 -0.872 0 C-N-CA 122.758 2.305 . . . . 0.0 110.93 174.571 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -69.98 139.67 52.84 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.277 0.631 . . . . 0.0 109.504 177.526 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 23.7 p-10 -147.58 150.54 37.17 Favored Pre-proline 0 CA--C 1.539 0.542 0 C-N-CA 123.057 0.543 . . . . 0.0 111.2 177.053 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -71.29 149.26 56.95 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 121.78 1.654 . . . . 0.0 110.209 172.662 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -74.94 -72.86 1.0 Allowed Glycine 0 CA--C 1.527 0.797 0 CA-C-O 119.067 -0.852 . . . . 0.0 111.664 177.335 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 172.2 -37.26 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 128.324 2.65 . . . . 0.0 111.448 173.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -152.75 105.08 2.93 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.842 2.057 . . . . 0.0 108.689 -178.47 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -165.06 83.23 1.15 Allowed Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 124.678 1.191 . . . . 0.0 110.003 175.341 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -71.19 163.01 40.64 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.316 2.011 . . . . 0.0 110.951 175.504 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 89.63 17.25 0.05 OUTLIER 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 127.717 2.407 . . . . 0.0 112.589 179.656 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -166.42 151.17 7.85 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 127.375 2.27 . . . . 0.0 105.682 -177.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.1 t70 68.79 -45.0 0.53 Allowed 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 129.043 2.937 . . . . 0.0 113.569 179.443 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.418 ' C ' ' H ' ' A' ' 19' ' ' GLN . 53.5 tp -54.45 -25.41 24.94 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.45 1.9 . . . . 0.0 112.861 173.661 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.6 32.85 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 127.948 2.499 . . . . 0.0 113.752 169.848 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.418 ' H ' ' C ' ' A' ' 17' ' ' LEU . 21.9 tt0 -153.93 -38.12 0.1 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 127.015 2.126 . . . . 0.0 111.314 176.285 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 91.7 t80 -55.41 -55.3 33.25 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.924 1.238 . . . . 0.0 110.942 179.523 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.66 -33.0 69.61 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.884 177.347 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.34 -47.59 41.18 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 126.517 1.927 . . . . 0.0 112.228 178.321 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.87 -47.9 76.51 Favored 'General case' 0 N--CA 1.46 0.058 0 C-N-CA 124.582 1.153 . . . . 0.0 109.521 174.151 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.8 mt -64.34 -38.15 90.03 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 119.162 -0.447 . . . . 0.0 111.968 176.844 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.76 -34.14 77.63 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.042 1.337 . . . . 0.0 113.81 171.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 46.2 t60 -75.12 -49.86 18.23 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 125.053 1.341 . . . . 0.0 110.174 178.173 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -50.39 -55.11 17.14 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 124.491 1.116 . . . . 0.0 110.038 172.411 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -58.18 -41.12 80.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 118.867 0.758 . . . . 0.0 112.543 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -58.32 -49.47 77.06 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 123.373 0.669 . . . . 0.0 110.559 175.07 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.3 mt -62.79 -44.2 96.81 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 118.822 -0.609 . . . . 0.0 111.985 176.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 5.3 mm -61.24 -56.13 19.96 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.294 0 C-N-CA 125.593 1.557 . . . . 0.0 110.158 178.193 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.2 t -57.32 -39.59 76.14 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 119.589 1.086 . . . . 0.0 111.48 179.081 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 16.7 mtp85 -78.8 11.48 2.61 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.36 1.464 . . . . 0.0 114.796 172.618 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.0 tm0? -142.64 20.05 2.01 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 126.688 1.995 . . . . 0.0 112.351 179.364 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -129.28 -141.81 0.25 Allowed 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.443 -1.411 . . . . 0.0 111.355 -177.619 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 30.1 p90 -42.9 -32.48 0.63 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 127.669 2.387 . . . . 0.0 113.564 170.265 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.356 0 O-C-N 119.672 -1.892 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 68.2 m-85 . . . . . 0 N--CA 1.478 0.972 0 CA-C-O 119.249 -0.405 . . . . 0.0 111.369 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -72.89 -63.89 0.04 OUTLIER 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 121.936 1.757 . . . . 0.0 111.168 178.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.1 t -165.44 -170.67 1.91 Allowed 'General case' 0 C--O 1.237 0.442 0 C-N-CA 125.476 1.51 . . . . 0.0 109.83 176.347 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.0 mttt -53.67 152.18 9.96 Favored Pre-proline 0 N--CA 1.473 0.681 0 C-N-CA 124.825 1.25 . . . . 0.0 111.593 174.829 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -71.34 145.0 47.2 Favored 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 122.002 1.801 . . . . 0.0 110.553 179.355 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -128.79 162.88 26.42 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.142 2.177 . . . . 0.0 107.89 178.256 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 70.02 154.79 0.15 Allowed Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 127.559 2.344 . . . . 0.0 111.988 -176.375 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -73.24 179.04 5.83 Favored 'Trans proline' 0 CA--C 1.549 1.232 0 C-N-CA 122.409 2.073 . . . . 0.0 111.003 172.338 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -165.41 91.08 0.1 Allowed Glycine 0 C--N 1.339 0.74 0 N-CA-C 112.036 -0.426 . . . . 0.0 112.036 -178.424 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -149.06 116.03 6.01 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 126.031 1.733 . . . . 0.0 108.229 -179.138 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.2 t70 71.62 -58.1 0.59 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 127.376 2.27 . . . . 0.0 111.474 -179.425 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 43.0 72.52 1.14 Allowed Pre-proline 0 CA--C 1.54 0.581 0 C-N-CA 127.855 2.462 . . . . 0.0 112.478 -178.2 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -69.45 80.54 0.79 Allowed 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 124.079 3.186 . . . . 0.0 110.994 -173.453 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 70.95 33.16 2.19 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.623 2.369 . . . . 0.0 113.797 -173.456 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -119.26 -6.83 10.34 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 -175.736 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -175.81 -36.83 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 127.646 2.378 . . . . 0.0 111.09 -179.858 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.427 ' C ' ' H ' ' A' ' 19' ' ' GLN . 38.7 tp -58.7 -21.55 55.06 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.664 1.186 . . . . 0.0 112.685 176.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.63 30.67 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 128.111 2.564 . . . . 0.0 113.839 174.474 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLN . . . . . 0.427 ' H ' ' C ' ' A' ' 17' ' ' LEU . 7.3 tm0? -154.24 -37.77 0.09 Allowed 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 127.45 2.3 . . . . 0.0 111.186 178.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.425 ' HB3' HD12 ' A' ' 17' ' ' LEU . 74.7 t80 -59.88 -59.12 5.94 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.453 1.101 . . . . 0.0 110.481 177.409 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.73 -34.11 62.04 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 119.351 -0.357 . . . . 0.0 111.212 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.15 -45.31 57.4 Favored 'General case' 0 C--O 1.212 -0.882 0 C-N-CA 126.261 1.824 . . . . 0.0 112.261 176.498 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.65 -49.36 70.77 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 120.69 1.586 . . . . 0.0 109.15 174.524 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 mp -61.46 -55.72 28.14 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-O 118.847 -0.597 . . . . 0.0 111.022 175.353 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.85 -45.66 64.13 Favored 'General case' 0 C--O 1.208 -1.127 0 CA-C-O 118.134 -0.936 . . . . 0.0 112.027 177.131 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 18.7 t60 -60.0 -52.62 64.59 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 124.629 1.172 . . . . 0.0 109.697 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -70.52 19.7 0.05 OUTLIER 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.908 1.683 . . . . 0.0 114.962 176.56 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -141.69 -48.24 0.22 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.415 0 C-N-CA 125.656 1.582 . . . . 0.0 110.289 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.422 ' HA ' HG22 ' A' ' 32' ' ' THR . 0.7 OUTLIER -65.99 -31.92 73.11 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 125.684 1.594 . . . . 0.0 110.376 176.297 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 17.1 mt -76.01 -36.68 59.06 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 119.09 0.859 . . . . 0.0 112.155 175.514 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 10.9 mm -75.42 -47.92 32.89 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 123.236 0.615 . . . . 0.0 109.81 -179.303 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.422 HG22 ' HA ' ' A' ' 29' ' ' ASN . 4.8 t -53.74 -43.31 68.99 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.312 1.045 . . . . 0.0 111.601 179.16 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.37 2.63 18.04 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.545 1.138 . . . . 0.0 113.809 178.636 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -132.93 15.97 4.24 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.875 2.47 . . . . 0.0 113.07 -173.414 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.95 -144.01 0.25 Allowed 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.166 0.986 . . . . 0.0 110.333 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 7.5 p90 -41.32 -34.81 0.55 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.237 1.815 . . . . 0.0 113.588 172.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.333 0 O-C-N 119.639 -1.913 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 27.5 p90 . . . . . 0 N--CA 1.481 1.093 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -76.64 -71.68 0.01 OUTLIER 'Trans proline' 0 CA--C 1.536 0.575 0 C-N-CA 122.064 1.843 . . . . 0.0 111.583 178.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 9.0 p -112.37 -66.05 1.12 Allowed 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 126.259 1.824 . . . . 0.0 110.625 -177.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 58.83 80.61 0.27 Allowed Pre-proline 0 N--CA 1.473 0.725 0 C-N-CA 126.951 2.1 . . . . 0.0 111.811 -178.81 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -70.26 -53.17 0.25 Allowed 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 123.107 2.538 . . . . 0.0 112.752 -175.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -160.4 -86.41 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.628 1.571 . . . . 0.0 107.724 174.024 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -161.3 102.17 1.23 Allowed Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 126.847 2.059 . . . . 0.0 108.936 179.156 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -78.86 102.26 1.52 Allowed 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 123.37 2.713 . . . . 0.0 112.215 175.735 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 174.79 78.44 0.05 OUTLIER Glycine 0 CA--C 1.526 0.738 0 CA-C-O 118.525 -1.153 . . . . 0.0 113.285 178.646 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 172.24 -28.18 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 127.271 2.228 . . . . 0.0 112.456 -179.601 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -138.34 84.96 2.06 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.87 1.668 . . . . 0.0 109.065 177.694 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.591 ' HB1' ' HD2' ' A' ' 13' ' ' PRO . . . -154.84 171.5 7.09 Favored Pre-proline 0 CA--C 1.544 0.748 0 O-C-N 121.265 -0.897 . . . . 0.0 111.207 177.646 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.591 ' HD2' ' HB1' ' A' ' 12' ' ' ALA . 38.6 Cg_endo -70.68 -179.85 3.64 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 122.373 2.049 . . . . 0.0 111.06 169.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 82.12 46.81 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.709 2.004 . . . . 0.0 112.973 179.261 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -117.67 -1.58 11.59 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 -176.642 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -163.2 -63.21 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.983 1.713 . . . . 0.0 108.226 -178.047 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.596 HD13 ' N ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -51.74 -27.35 11.72 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.615 1.566 . . . . 0.0 113.463 -179.562 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.596 ' N ' HD13 ' A' ' 17' ' ' LEU . . . -61.18 -52.09 66.28 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 126.124 1.77 . . . . 0.0 111.248 174.717 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -28.54 62.53 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-O 118.877 -0.583 . . . . 0.0 111.041 174.265 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.449 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 10.7 m-30 -60.82 -48.27 82.54 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 119.464 1.029 . . . . 0.0 110.152 178.215 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.12 -31.84 70.44 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 118.657 -0.687 . . . . 0.0 112.378 173.334 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.49 -48.05 24.36 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 125.34 1.456 . . . . 0.0 112.346 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -55.35 -49.13 73.04 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.543 1.537 . . . . 0.0 109.3 174.069 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.0 mt -63.03 -41.79 99.62 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 118.64 -0.695 . . . . 0.0 111.705 176.247 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -37.68 77.73 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.96 0.904 . . . . 0.0 113.155 172.101 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 39.3 t60 -70.39 -54.05 14.02 Favored 'General case' 0 C--N 1.334 -0.094 0 C-N-CA 124.941 1.296 . . . . 0.0 110.804 177.285 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -52.16 -51.09 60.11 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 124.3 1.04 . . . . 0.0 110.72 176.557 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -57.12 -45.21 84.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 CA-C-O 118.653 -0.689 . . . . 0.0 111.888 177.523 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -64.95 -27.99 69.22 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 176.793 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.6 mt -73.71 -52.95 11.55 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 124.962 1.305 . . . . 0.0 111.325 172.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 2.1 mp -59.57 -50.24 80.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-O 118.029 -0.986 . . . . 0.0 109.431 177.08 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.552 ' HA ' ' CG ' ' A' ' 35' ' ' ARG . 0.5 OUTLIER -54.01 -27.22 30.54 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 119.772 1.169 . . . . 0.0 113.181 179.826 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -77.82 4.74 11.06 Favored 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 174.427 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -142.37 -42.37 0.33 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 127.515 2.326 . . . . 0.0 113.746 -174.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.552 ' CG ' ' HA ' ' A' ' 32' ' ' THR . 0.2 OUTLIER -54.13 160.52 1.53 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 119.353 0.979 . . . . 0.0 110.33 168.795 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 26.1 p90 48.09 14.35 0.05 Allowed 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 126.641 1.976 . . . . 0.0 115.62 -179.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.482 0 O-C-N 118.173 -2.83 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 . . . . . 0 N--CA 1.476 0.851 0 CA-C-O 119.636 -0.221 . . . . 0.0 110.42 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -76.02 86.84 1.47 Allowed 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.398 2.732 . . . . 0.0 111.059 178.128 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.19 -45.93 0.08 Allowed 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.072 1.349 . . . . 0.0 111.316 178.88 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -119.14 83.35 24.31 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 124.82 1.248 . . . . 0.0 109.904 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -69.1 171.9 12.94 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 123.077 2.518 . . . . 0.0 111.748 178.507 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -85.74 171.61 11.47 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.108 0.563 . . . . 0.0 111.704 173.051 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -136.54 133.89 19.39 Favored Pre-proline 0 CA--C 1.541 0.609 0 C-N-CA 123.744 0.818 . . . . 0.0 109.902 175.829 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -73.21 103.05 1.54 Allowed 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 123.003 2.469 . . . . 0.0 110.828 176.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 97.58 116.41 3.49 Favored Glycine 0 CA--C 1.526 0.779 0 C-N-CA 124.841 1.21 . . . . 0.0 111.612 -177.83 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.59 -29.99 67.64 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 175.752 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -169.44 102.5 0.34 Allowed 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 127.089 2.156 . . . . 0.0 106.583 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.606 ' HB1' ' O ' ' A' ' 15' ' ' GLU . . . 52.72 80.99 0.27 Allowed Pre-proline 0 CA--C 1.555 1.147 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 173.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -71.97 73.79 2.46 Favored 'Trans proline' 0 C--N 1.355 0.869 0 C-N-CA 124.029 3.153 . . . . 0.0 111.392 -176.194 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 72.21 38.85 0.82 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 128.011 2.524 . . . . 0.0 112.956 179.776 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.606 ' O ' ' HB1' ' A' ' 12' ' ' ALA . 1.4 tp10 -172.85 143.56 1.23 Allowed 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 125.357 1.463 . . . . 0.0 108.479 -178.216 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.6 t0 84.17 -42.72 0.08 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 128.781 2.833 . . . . 0.0 110.758 -177.627 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.592 HD13 ' N ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -48.53 -26.47 2.2 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.935 1.694 . . . . 0.0 114.049 177.224 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.592 ' N ' HD13 ' A' ' 17' ' ' LEU . . . -61.39 -56.48 19.86 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.629 1.971 . . . . 0.0 110.36 172.744 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -69.73 -28.79 66.1 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.708 0.803 . . . . 0.0 112.358 177.682 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.511 ' O ' HD12 ' A' ' 24' ' ' LEU . 6.1 m-85 -53.65 -52.82 58.72 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.762 0.825 . . . . 0.0 110.288 169.225 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.9 -30.45 69.03 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 118.358 -0.83 . . . . 0.0 113.028 176.768 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.54 -48.75 30.64 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.403 1.481 . . . . 0.0 112.358 176.027 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.4 -48.1 79.97 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 118.411 0.55 . . . . 0.0 109.733 176.532 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.511 HD12 ' O ' ' A' ' 20' ' ' TYR . 0.9 OUTLIER -59.94 -42.54 94.24 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.429 0.692 . . . . 0.0 111.394 174.911 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.07 -36.18 76.79 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.724 1.209 . . . . 0.0 113.18 174.16 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 32.9 t60 -75.85 -50.77 14.15 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 123.724 0.809 . . . . 0.0 110.34 177.102 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.87 -46.89 64.65 Favored 'General case' 0 C--O 1.222 -0.393 0 C-N-CA 124.888 1.275 . . . . 0.0 112.51 175.148 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.4 ' O ' HG23 ' A' ' 32' ' ' THR . 0.1 OUTLIER -57.55 -49.18 81.28 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 CA-C-N 119.19 0.905 . . . . 0.0 110.374 176.176 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -64.12 -22.61 67.0 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.334 1.053 . . . . 0.0 112.821 177.629 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.7 mt -80.55 -62.17 1.75 Allowed 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 124.237 1.015 . . . . 0.0 111.103 171.098 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 21.8 mm -48.8 -44.84 15.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 C-N-CA 125.44 1.496 . . . . 0.0 111.011 179.519 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.4 HG23 ' O ' ' A' ' 28' ' ' ILE . 18.6 p -51.91 -42.96 63.18 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.183 -0.948 . . . . 0.0 113.163 173.972 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -79.69 17.33 0.92 Allowed 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 174.721 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -159.18 33.58 0.2 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.703 1.601 . . . . 0.0 113.273 -177.023 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.6 ttt-85 -138.53 -138.49 0.14 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.668 0.787 . . . . 0.0 111.265 -178.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 51.6 p90 -37.67 -39.02 0.31 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 127.821 2.449 . . . . 0.0 113.51 172.078 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.468 0 O-C-N 119.512 -1.993 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 . . . . . 0 N--CA 1.477 0.881 0 CA-C-O 117.534 -1.222 . . . . 0.0 109.824 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -72.54 162.31 41.72 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 123.648 2.899 . . . . 0.0 111.198 173.333 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 8.1 t 50.28 93.24 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.883 1.673 . . . . 0.0 112.118 -173.8 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 33.1 mttt -112.97 83.19 5.8 Favored Pre-proline 0 CA--C 1.534 0.361 0 C-N-CA 123.947 0.899 . . . . 0.0 109.006 179.067 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -73.8 65.35 4.91 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.609 2.873 . . . . 0.0 109.784 175.467 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -57.9 130.23 45.53 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.078 0.951 . . . . 0.0 109.755 175.084 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 27.1 p30 -151.02 158.75 34.59 Favored Pre-proline 0 CA--C 1.538 0.493 0 C-N-CA 123.448 0.699 . . . . 0.0 110.538 178.097 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -74.91 169.0 23.58 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 121.914 1.742 . . . . 0.0 111.219 168.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -170.64 -72.64 0.04 OUTLIER Glycine 0 C--N 1.332 0.33 0 N-CA-C 110.078 -1.209 . . . . 0.0 110.078 178.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 65.42 -52.09 0.36 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 126.555 1.942 . . . . 0.0 112.426 -176.425 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.9 t0 70.69 -62.98 0.43 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.996 2.518 . . . . 0.0 109.323 -177.382 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.456 ' HB1' ' HD2' ' A' ' 13' ' ' PRO . . . -159.26 166.64 15.88 Favored Pre-proline 0 CA--C 1.544 0.747 0 C-N-CA 126.615 1.966 . . . . 0.0 111.778 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PRO . . . . . 0.456 ' HD2' ' HB1' ' A' ' 12' ' ' ALA . 41.1 Cg_endo -74.01 78.93 2.44 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 123.773 2.982 . . . . 0.0 112.176 177.91 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -154.52 164.26 38.95 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.235 1.414 . . . . 0.0 109.415 175.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 62.45 -6.74 0.14 Allowed 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 126.459 1.904 . . . . 0.0 115.949 -178.016 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -138.43 -71.45 0.42 Allowed 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 127.899 2.48 . . . . 0.0 108.08 -176.168 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.544 HD23 ' C ' ' A' ' 17' ' ' LEU . 4.9 tt -61.2 -49.5 76.9 Favored 'General case' 0 C--N 1.344 0.338 0 C-N-CA 123.627 0.771 . . . . 0.0 111.126 177.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.28 -42.87 66.99 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.891 0.769 . . . . 0.0 110.9 -176.566 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.4 tm0? -67.4 -44.91 77.68 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.838 1.655 . . . . 0.0 111.785 175.167 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 68.9 t80 -58.45 -54.29 48.7 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.117 1.367 . . . . 0.0 112.342 175.595 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.9 -34.32 69.69 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.45 1.1 . . . . 0.0 110.598 177.174 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.25 -49.16 46.02 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 124.789 1.235 . . . . 0.0 111.796 175.78 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -51.4 -47.38 62.93 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.302 1.041 . . . . 0.0 109.957 172.6 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.3 mt -66.45 -41.03 89.7 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 178.484 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.92 -29.03 70.24 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.581 1.152 . . . . 0.0 113.788 172.132 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 57.9 t60 -78.75 -51.52 9.66 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.544 1.538 . . . . 0.0 110.061 177.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -49.92 -48.81 51.53 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 124.29 1.036 . . . . 0.0 110.387 175.781 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -59.47 -46.39 92.86 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-N 118.405 0.548 . . . . 0.0 111.857 178.457 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -57.97 -46.74 84.66 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.799 1.24 . . . . 0.0 110.288 177.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.0 mt -65.62 -38.37 89.23 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.866 1.266 . . . . 0.0 112.924 175.339 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.431 HD13 ' HA ' ' A' ' 31' ' ' ILE . 6.8 mm -60.76 -46.58 95.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 C-N-CA 123.803 0.841 . . . . 0.0 109.823 173.008 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.2 p -60.17 -17.75 43.06 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 175.095 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.9 ttt-85 -71.72 -3.94 24.7 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 171.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -146.18 11.44 1.18 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 127.279 2.232 . . . . 0.0 112.92 179.021 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.46 160.11 17.58 Favored 'General case' 0 C--O 1.217 -0.643 0 O-C-N 121.007 -1.058 . . . . 0.0 111.316 -178.586 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -177.12 -38.13 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.207 1.403 . . . . 0.0 109.238 -174.581 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.414 0 O-C-N 119.079 -2.263 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.6 t80 . . . . . 0 N--CA 1.469 0.523 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.63 -37.52 70.84 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.373 1.069 . . . . 0.0 110.412 176.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.64 -46.04 60.23 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 124.799 1.24 . . . . 0.0 111.956 177.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.73 -46.89 71.0 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 119.676 1.126 . . . . 0.0 109.358 173.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.6 mt -65.57 -47.18 76.7 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 118.855 -0.593 . . . . 0.0 111.182 176.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.97 -31.91 67.35 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 117.968 -1.015 . . . . 0.0 113.593 174.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 36.9 t60 -76.44 -51.21 12.25 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 126.4 1.88 . . . . 0.0 110.497 177.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.95 -47.03 84.1 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 123.822 0.849 . . . . 0.0 110.832 177.265 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.221 -0.432 0 CA-C-O 117.185 -1.388 . . . . 0.0 110.318 175.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.691 ' O ' HD12 ' A' ' 24' ' ' LEU . 3.9 t80 . . . . . 0 C--O 1.221 -0.405 0 CA-C-O 119.435 -0.317 . . . . 0.0 110.698 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.87 -34.01 18.78 Favored 'General case' 0 C--N 1.343 0.314 0 CA-C-O 118.071 -0.966 . . . . 0.0 112.165 177.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.23 -50.43 40.0 Favored 'General case' 0 C--N 1.343 0.283 0 C-N-CA 125.789 1.635 . . . . 0.0 112.21 172.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -49.73 -49.19 49.0 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.931 1.241 . . . . 0.0 111.397 172.225 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.691 HD12 ' O ' ' A' ' 20' ' ' TYR . 2.9 mp -63.93 -49.59 71.99 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-O 118.754 -0.641 . . . . 0.0 110.988 177.055 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.82 -37.96 64.11 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.93 1.292 . . . . 0.0 113.286 175.053 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 20.2 t60 -73.13 -51.91 16.18 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 124.785 1.234 . . . . 0.0 110.881 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -49.82 -60.88 2.49 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 124.54 1.136 . . . . 0.0 110.227 172.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.47 0.529 0 C-N-CA 124.173 0.989 . . . . 0.0 111.806 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 78.7 t80 . . . . . 0 C--O 1.226 -0.137 0 CA-C-O 121.505 0.669 . . . . 0.0 111.841 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.61 -35.33 68.15 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.673 1.189 . . . . 0.0 111.368 176.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.18 -49.69 33.6 Favored 'General case' 0 C--O 1.22 -0.464 0 C-N-CA 125.967 1.707 . . . . 0.0 111.456 177.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -54.72 -44.01 73.1 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 119.57 1.077 . . . . 0.0 110.17 173.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 mt -67.45 -40.26 85.39 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 118.89 -0.576 . . . . 0.0 111.461 177.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.98 -38.17 87.56 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.762 1.225 . . . . 0.0 113.178 172.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 51.7 t60 -71.16 -51.65 23.7 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 125.163 1.385 . . . . 0.0 108.961 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -50.34 -53.25 30.28 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 124.538 1.135 . . . . 0.0 111.569 174.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.467 0.393 0 CA-C-N 118.837 0.744 . . . . 0.0 110.525 178.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 89.5 t80 . . . . . 0 N--CA 1.468 0.441 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.62 -32.67 67.45 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 118.488 -0.768 . . . . 0.0 111.49 176.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.82 -50.18 45.43 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 125.431 1.492 . . . . 0.0 111.592 174.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.14 -45.57 75.63 Favored 'General case' 0 N--CA 1.462 0.156 0 C-N-CA 123.753 0.821 . . . . 0.0 110.135 176.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.1 mt -66.39 -40.36 89.62 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 119.14 -0.457 . . . . 0.0 111.702 177.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -39.94 91.68 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.497 1.119 . . . . 0.0 113.03 172.433 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 42.8 t60 -69.53 -50.38 45.56 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 125.136 1.374 . . . . 0.0 110.499 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -50.6 -59.04 4.45 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 124.342 1.057 . . . . 0.0 110.0 173.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.473 0.705 0 CA-C-N 118.444 0.565 . . . . 0.0 111.374 -178.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 44.4 t80 . . . . . 0 N--CA 1.471 0.578 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.42 -35.49 70.12 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.055 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.67 -51.18 52.83 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 125.16 1.384 . . . . 0.0 111.82 174.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -50.75 -46.51 59.35 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 119.454 1.025 . . . . 0.0 110.211 174.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.5 mt -67.73 -47.31 69.67 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 118.99 -0.529 . . . . 0.0 111.279 178.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -35.08 68.63 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.029 1.331 . . . . 0.0 113.514 174.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -74.54 -52.95 10.43 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 126.033 1.733 . . . . 0.0 110.35 178.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -48.52 -62.51 1.46 Allowed 'General case' 0 C--N 1.344 0.332 0 CA-C-O 117.857 -1.068 . . . . 0.0 109.907 171.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.475 0.789 0 C-N-CA 124.511 1.124 . . . . 0.0 111.946 -177.121 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 87.9 t80 . . . . . 0 N--CA 1.471 0.619 0 CA-C-O 121.097 0.475 . . . . 0.0 111.828 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.2 -32.1 66.13 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.475 1.11 . . . . 0.0 111.168 175.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.42 -48.13 43.67 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 125.125 1.37 . . . . 0.0 111.533 175.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -54.83 -47.68 73.8 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 124.029 0.932 . . . . 0.0 109.716 175.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mt -65.93 -39.6 90.64 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 177.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.35 -43.91 96.06 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.457 1.103 . . . . 0.0 112.304 172.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 54.9 t60 -65.43 -50.9 63.69 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.81 1.244 . . . . 0.0 110.513 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -50.91 -57.26 8.96 Favored 'General case' 0 C--N 1.344 0.347 0 C-N-CA 124.386 1.074 . . . . 0.0 110.731 172.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.222 -0.347 0 CA-C-N 118.867 0.758 . . . . 0.0 110.881 178.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.528 ' O ' HD12 ' A' ' 24' ' ' LEU . 4.2 m-85 . . . . . 0 N--CA 1.467 0.397 0 N-CA-C 110.133 -0.321 . . . . 0.0 110.133 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.77 -29.01 67.89 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 118.708 -0.663 . . . . 0.0 112.386 176.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.55 -49.61 21.22 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.742 1.617 . . . . 0.0 111.735 177.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -58.67 -46.06 88.05 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.224 0.61 . . . . 0.0 109.976 176.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.528 HD12 ' O ' ' A' ' 20' ' ' TYR . 1.1 mt -62.27 -39.72 93.87 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 118.713 -0.66 . . . . 0.0 111.682 174.276 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.87 -34.57 76.24 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.789 1.235 . . . . 0.0 113.123 173.144 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 45.7 t60 -78.82 -53.12 7.43 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 118.706 -0.664 . . . . 0.0 110.172 178.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -46.69 -43.77 18.09 Favored 'General case' 0 C--O 1.214 -0.796 0 C-N-CA 124.679 1.192 . . . . 0.0 111.228 171.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.466 0.369 0 CA-C-N 119.607 1.094 . . . . 0.0 111.001 175.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.3 t80 . . . . . 0 N--CA 1.465 0.28 0 CA-C-O 121.012 0.434 . . . . 0.0 111.301 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.78 -29.07 69.21 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 176.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.02 -49.47 19.7 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.834 1.654 . . . . 0.0 112.037 177.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -54.66 -48.43 72.35 Favored 'General case' 0 CA--C 1.528 0.105 0 C-N-CA 124.717 1.207 . . . . 0.0 109.17 175.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.1 mt -64.01 -38.83 92.5 Favored 'General case' 0 C--N 1.347 0.478 0 CA-C-O 119.021 -0.514 . . . . 0.0 111.673 177.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.54 -37.48 86.27 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.414 1.086 . . . . 0.0 113.138 172.184 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 35.9 t60 -71.7 -52.05 19.8 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.197 1.399 . . . . 0.0 110.291 178.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.49 -52.04 56.42 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 124.605 1.162 . . . . 0.0 111.039 174.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.219 -0.525 0 CA-C-N 118.638 0.654 . . . . 0.0 111.43 176.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 69.4 t80 . . . . . 0 N--CA 1.47 0.573 0 CA-C-O 120.871 0.367 . . . . 0.0 110.677 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.78 -31.17 69.43 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.832 177.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.49 -48.16 35.59 Favored 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 126.631 1.972 . . . . 0.0 111.953 178.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.04 -47.0 78.68 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 125.145 1.378 . . . . 0.0 109.998 174.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.3 mt -65.3 -39.65 92.8 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.397 0.279 . . . . 0.0 111.556 176.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.02 -41.6 96.86 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.125 1.37 . . . . 0.0 113.379 172.226 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 44.5 t60 -69.8 -48.51 58.84 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 124.776 1.23 . . . . 0.0 110.493 178.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.47 -55.33 19.43 Favored 'General case' 0 C--O 1.223 -0.322 0 C-N-CA 124.016 0.926 . . . . 0.0 110.717 171.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.492 0 CA-C-N 119.272 0.942 . . . . 0.0 111.34 179.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.539 0.557 0 N-CA-C 111.641 0.237 . . . . 0.0 111.641 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.88 -33.6 74.51 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.295 1.038 . . . . 0.0 111.035 176.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.39 -49.52 33.28 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 126.643 1.977 . . . . 0.0 111.359 176.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.7 -49.93 69.5 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 119.674 1.125 . . . . 0.0 109.503 174.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.2 mt -63.18 -39.48 94.77 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 118.487 -0.768 . . . . 0.0 112.44 177.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -50.07 75.14 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 119.169 0.895 . . . . 0.0 112.066 171.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 26.2 t60 -58.55 -46.89 85.91 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.161 0.984 . . . . 0.0 110.015 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -70.88 19.79 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.716 1.606 . . . . 0.0 115.019 176.133 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.508 0 C-N-CA 125.707 1.603 . . . . 0.0 110.387 -179.155 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 91.5 t80 . . . . . 0 N--CA 1.465 0.324 0 CA-C-O 121.441 0.638 . . . . 0.0 111.934 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.72 -36.02 66.76 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.077 1.351 . . . . 0.0 111.012 177.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.08 -49.19 38.36 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 124.471 1.108 . . . . 0.0 111.912 176.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -51.28 -47.2 62.6 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 125.207 1.403 . . . . 0.0 109.192 173.194 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.1 mt -67.33 -43.58 81.21 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.185 177.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.43 -34.2 72.2 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 172.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 41.5 t60 -75.24 -52.72 10.21 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 125.792 1.637 . . . . 0.0 110.139 178.418 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -51.18 -52.81 40.74 Favored 'General case' 0 C--O 1.221 -0.431 0 C-N-CA 124.189 0.996 . . . . 0.0 111.702 172.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.222 -0.353 0 CA-C-O 118.64 -0.695 . . . . 0.0 110.727 178.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 12.7 m-30 . . . . . 0 N--CA 1.467 0.404 0 N-CA-C 110.27 -0.271 . . . . 0.0 110.27 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.67 -34.22 64.8 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 118.382 -0.818 . . . . 0.0 111.707 173.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.58 -48.46 32.61 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.138 1.375 . . . . 0.0 112.081 177.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.53 -49.08 65.55 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.947 0.899 . . . . 0.0 110.534 172.544 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.4 mt -61.89 -49.03 77.83 Favored 'General case' 0 C--N 1.346 0.434 0 CA-C-O 118.916 -0.564 . . . . 0.0 110.923 175.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.1 -30.32 61.89 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 174.344 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 40.3 t60 -79.41 -53.48 6.87 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 124.836 1.255 . . . . 0.0 110.756 177.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -51.72 -50.08 61.24 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 124.434 1.094 . . . . 0.0 110.448 175.661 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.467 0.413 0 CA-C-N 118.766 0.712 . . . . 0.0 111.564 177.061 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.5 t80 . . . . . 0 N--CA 1.467 0.421 0 CA-C-O 121.212 0.53 . . . . 0.0 111.444 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.64 -36.15 66.72 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 125.163 1.385 . . . . 0.0 110.96 176.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.4 -47.1 51.9 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-O 117.785 -1.102 . . . . 0.0 112.13 176.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -54.54 -46.92 73.69 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 119.758 1.163 . . . . 0.0 109.312 173.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.3 mt -65.48 -42.49 92.16 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 118.855 -0.593 . . . . 0.0 111.041 177.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.06 -44.12 91.79 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.109 0.963 . . . . 0.0 112.406 173.292 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 41.2 t60 -66.7 -52.57 43.08 Favored 'General case' 0 C--O 1.231 0.103 0 C-N-CA 125.576 1.551 . . . . 0.0 109.952 -179.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -50.16 -56.71 9.86 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-O 118.156 -0.926 . . . . 0.0 110.946 171.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.465 0.298 0 CA-C-N 119.167 0.894 . . . . 0.0 110.293 -179.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 . . . . . 0 N--CA 1.464 0.245 0 N-CA-C 110.467 -0.197 . . . . 0.0 110.467 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.56 -29.62 70.71 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 175.532 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -76.49 -47.44 22.83 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.445 1.498 . . . . 0.0 112.519 178.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.6 -50.31 70.46 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 124.319 1.048 . . . . 0.0 109.946 172.759 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.6 mt -62.84 -37.46 86.92 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 118.746 -0.645 . . . . 0.0 111.431 177.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -45.32 94.79 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.539 1.136 . . . . 0.0 113.078 171.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 38.6 t60 -64.62 -51.13 64.27 Favored 'General case' 0 C--N 1.334 -0.107 0 C-N-CA 124.097 0.959 . . . . 0.0 109.923 179.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -50.97 -56.5 12.11 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 123.956 0.902 . . . . 0.0 110.982 173.329 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.343 0.32 0 CA-C-N 118.746 0.703 . . . . 0.0 112.472 179.243 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 87.4 t80 . . . . . 0 N--CA 1.47 0.542 0 CA-C-O 121.003 0.43 . . . . 0.0 111.835 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.42 -31.98 64.43 Favored 'General case' 0 C--O 1.219 -0.513 0 C-N-CA 124.986 1.315 . . . . 0.0 111.203 175.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.93 -51.03 24.13 Favored 'General case' 0 C--O 1.219 -0.534 0 C-N-CA 124.996 1.318 . . . . 0.0 111.699 174.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -52.2 -47.76 65.43 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.851 0.86 . . . . 0.0 109.888 174.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.1 mt -65.83 -40.57 91.9 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.681 -0.676 . . . . 0.0 111.466 177.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.3 -37.07 79.41 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.621 1.168 . . . . 0.0 113.042 172.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -73.12 -51.67 17.1 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.151 1.381 . . . . 0.0 110.197 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -52.01 -54.69 26.87 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.767 0.827 . . . . 0.0 110.764 173.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.467 0.415 0 CA-C-N 119.244 0.929 . . . . 0.0 111.748 178.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 91.7 t80 . . . . . 0 N--CA 1.469 0.483 0 CA-C-O 121.213 0.53 . . . . 0.0 110.942 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.66 -33.0 69.61 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.884 177.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.34 -47.59 41.18 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 126.517 1.927 . . . . 0.0 112.228 178.321 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.87 -47.9 76.51 Favored 'General case' 0 N--CA 1.46 0.058 0 C-N-CA 124.582 1.153 . . . . 0.0 109.521 174.151 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.8 mt -64.34 -38.15 90.03 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 119.162 -0.447 . . . . 0.0 111.968 176.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.76 -34.14 77.63 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.042 1.337 . . . . 0.0 113.81 171.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 46.2 t60 -75.12 -49.86 18.23 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 125.053 1.341 . . . . 0.0 110.174 178.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -50.39 -55.11 17.14 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 124.491 1.116 . . . . 0.0 110.038 172.411 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.47 0.544 0 CA-C-N 118.867 0.758 . . . . 0.0 112.543 179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 74.7 t80 . . . . . 0 N--CA 1.468 0.429 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.73 -34.11 62.04 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 119.351 -0.357 . . . . 0.0 111.212 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.15 -45.31 57.4 Favored 'General case' 0 C--O 1.212 -0.882 0 C-N-CA 126.261 1.824 . . . . 0.0 112.261 176.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.65 -49.36 70.77 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 120.69 1.586 . . . . 0.0 109.15 174.524 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 mp -61.46 -55.72 28.14 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-O 118.847 -0.597 . . . . 0.0 111.022 175.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.85 -45.66 64.13 Favored 'General case' 0 C--O 1.208 -1.127 0 CA-C-O 118.134 -0.936 . . . . 0.0 112.027 177.131 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 18.7 t60 -60.0 -52.62 64.59 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 124.629 1.172 . . . . 0.0 109.697 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -70.52 19.7 0.05 OUTLIER 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.908 1.683 . . . . 0.0 114.962 176.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.221 -0.415 0 C-N-CA 125.656 1.582 . . . . 0.0 110.289 179.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 10.7 m-30 . . . . . 0 N--CA 1.467 0.423 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.12 -31.84 70.44 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 118.657 -0.687 . . . . 0.0 112.378 173.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.49 -48.05 24.36 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 125.34 1.456 . . . . 0.0 112.346 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -55.35 -49.13 73.04 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.543 1.537 . . . . 0.0 109.3 174.069 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.0 mt -63.03 -41.79 99.62 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 118.64 -0.695 . . . . 0.0 111.705 176.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -37.68 77.73 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.96 0.904 . . . . 0.0 113.155 172.101 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 39.3 t60 -70.39 -54.05 14.02 Favored 'General case' 0 C--N 1.334 -0.094 0 C-N-CA 124.941 1.296 . . . . 0.0 110.804 177.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -52.16 -51.09 60.11 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 124.3 1.04 . . . . 0.0 110.72 176.557 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.468 0.474 0 CA-C-O 118.653 -0.689 . . . . 0.0 111.888 177.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.511 ' O ' HD12 ' A' ' 24' ' ' LEU . 6.1 m-85 . . . . . 0 CA--C 1.534 0.36 0 CA-C-O 119.535 -0.269 . . . . 0.0 110.288 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.9 -30.45 69.03 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 118.358 -0.83 . . . . 0.0 113.028 176.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.54 -48.75 30.64 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.403 1.481 . . . . 0.0 112.358 176.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.4 -48.1 79.97 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 118.411 0.55 . . . . 0.0 109.733 176.532 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.511 HD12 ' O ' ' A' ' 20' ' ' TYR . 0.9 OUTLIER -59.94 -42.54 94.24 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.429 0.692 . . . . 0.0 111.394 174.911 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.07 -36.18 76.79 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.724 1.209 . . . . 0.0 113.18 174.16 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 32.9 t60 -75.85 -50.77 14.15 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 123.724 0.809 . . . . 0.0 110.34 177.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.87 -46.89 64.65 Favored 'General case' 0 C--O 1.222 -0.393 0 C-N-CA 124.888 1.275 . . . . 0.0 112.51 175.148 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.538 0.512 0 CA-C-N 119.19 0.905 . . . . 0.0 110.374 176.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 68.9 t80 . . . . . 0 CA--C 1.532 0.263 0 N-CA-C 112.342 0.497 . . . . 0.0 112.342 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.9 -34.32 69.69 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.45 1.1 . . . . 0.0 110.598 177.174 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.25 -49.16 46.02 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 124.789 1.235 . . . . 0.0 111.796 175.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -51.4 -47.38 62.93 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.302 1.041 . . . . 0.0 109.957 172.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.3 mt -66.45 -41.03 89.7 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 178.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.92 -29.03 70.24 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.581 1.152 . . . . 0.0 113.788 172.132 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 57.9 t60 -78.75 -51.52 9.66 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.544 1.538 . . . . 0.0 110.061 177.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -49.92 -48.81 51.53 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 124.29 1.036 . . . . 0.0 110.387 175.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.469 0.511 0 CA-C-N 118.405 0.548 . . . . 0.0 111.857 178.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 . . . . . 0 N--CA 1.477 0.897 0 CA-C-O 119.307 -0.378 . . . . 0.0 110.989 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -74.01 -178.87 4.14 Favored 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 121.672 1.581 . . . . 0.0 111.593 172.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 12.0 p -129.39 -49.59 1.18 Allowed 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 126.513 1.925 . . . . 0.0 111.748 179.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -166.84 81.85 0.94 Allowed Pre-proline 0 CA--C 1.55 0.95 0 C-N-CA 126.958 2.103 . . . . 0.0 110.137 -179.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -71.63 147.69 51.75 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 121.667 1.578 . . . . 0.0 110.326 175.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -169.1 123.61 0.84 Allowed 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 126.005 1.722 . . . . 0.0 108.112 177.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -163.43 141.76 6.2 Favored Pre-proline 0 CA--C 1.542 0.638 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 171.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -81.85 169.73 14.63 Favored 'Trans proline' 0 CA--C 1.542 0.904 0 C-N-CA 123.08 2.52 . . . . 0.0 111.772 166.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 73.2 86.5 0.21 Allowed Glycine 0 CA--C 1.528 0.881 0 C-N-CA 125.965 1.745 . . . . 0.0 112.722 176.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -166.52 113.11 0.84 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.616 1.166 . . . . 0.0 109.066 -176.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -70.82 73.9 0.59 Allowed 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 125.252 1.421 . . . . 0.0 108.794 174.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.88 153.96 87.12 Favored Pre-proline 0 CA--C 1.546 0.805 0 O-C-N 121.253 -0.905 . . . . 0.0 110.116 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -72.86 175.13 10.79 Favored 'Trans proline' 0 CA--C 1.539 0.74 0 C-N-CA 121.166 1.244 . . . . 0.0 110.854 172.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 90.23 20.08 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 127.52 2.328 . . . . 0.0 113.672 179.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -106.21 -3.01 21.82 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.205 1.402 . . . . 0.0 114.688 -176.011 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -176.57 -43.58 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 127.569 2.348 . . . . 0.0 109.957 179.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 26.1 tp -58.61 -37.84 76.72 Favored 'General case' 0 C--N 1.348 0.51 0 C-N-CA 124.109 0.964 . . . . 0.0 111.647 176.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.61 -41.32 63.59 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 119.892 1.223 . . . . 0.0 111.507 173.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -65.59 -46.77 78.09 Favored 'General case' 0 C--O 1.219 -0.51 0 CA-C-N 118.267 0.485 . . . . 0.0 111.208 175.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -62.32 -54.01 46.78 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.151 0.98 . . . . 0.0 112.222 179.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.63 -37.52 70.84 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 124.373 1.069 . . . . 0.0 110.412 176.652 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.64 -46.04 60.23 Favored 'General case' 0 C--O 1.223 -0.304 0 C-N-CA 124.799 1.24 . . . . 0.0 111.956 177.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -53.73 -46.89 71.0 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 119.676 1.126 . . . . 0.0 109.358 173.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.6 mt -65.57 -47.18 76.7 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 118.855 -0.593 . . . . 0.0 111.182 176.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.97 -31.91 67.35 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 117.968 -1.015 . . . . 0.0 113.593 174.174 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 36.9 t60 -76.44 -51.21 12.25 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 126.4 1.88 . . . . 0.0 110.497 177.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.95 -47.03 84.1 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 123.822 0.849 . . . . 0.0 110.832 177.265 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.451 ' O ' HG23 ' A' ' 32' ' ' THR . 0.1 OUTLIER -60.06 -49.68 83.12 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.432 0 CA-C-O 117.185 -1.388 . . . . 0.0 110.318 175.414 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -57.48 -26.69 61.64 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-N 119.65 1.114 . . . . 0.0 113.295 177.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.4 mt -72.19 -64.19 0.99 Allowed 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.052 0.941 . . . . 0.0 110.139 170.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 7.6 mt -55.56 -38.48 49.92 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 123.488 0.715 . . . . 0.0 112.33 -178.059 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.451 HG23 ' O ' ' A' ' 28' ' ' ILE . 27.0 p -51.3 -43.68 61.72 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 124.761 1.225 . . . . 0.0 111.605 178.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.3 ttt85 -88.94 19.4 4.14 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 179.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 92.7 mm-40 -140.12 -27.71 0.75 Allowed 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.722 1.609 . . . . 0.0 114.427 -175.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.1 ttt85 -70.81 -137.12 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 126.362 1.865 . . . . 0.0 111.52 179.407 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 29.5 p90 -46.69 -32.53 3.62 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 125.37 1.468 . . . . 0.0 112.896 168.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.427 0 O-C-N 119.082 -2.261 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 30.0 p90 . . . . . 0 N--CA 1.484 1.259 0 CA-C-O 118.567 -0.73 . . . . 0.0 110.071 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -72.23 139.78 32.83 Favored 'Trans proline' 0 C--N 1.35 0.62 0 C-N-CA 122.525 2.15 . . . . 0.0 111.146 174.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 36.7 t -61.06 -49.67 76.42 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 124.102 0.961 . . . . 0.0 111.926 177.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 53.67 79.17 0.36 Allowed Pre-proline 0 CA--C 1.545 0.773 0 C-N-CA 126.022 1.729 . . . . 0.0 111.219 -175.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -73.6 59.44 4.07 Favored 'Trans proline' 0 CA--C 1.54 0.799 0 C-N-CA 124.386 3.391 . . . . 0.0 111.608 177.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -131.47 97.18 4.17 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 127.162 2.185 . . . . 0.0 108.62 -179.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -153.81 151.23 24.51 Favored Pre-proline 0 CA--C 1.541 0.6 0 C-N-CA 123.347 0.659 . . . . 0.0 109.383 174.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -72.76 169.55 21.72 Favored 'Trans proline' 0 CA--C 1.543 0.935 0 C-N-CA 123.144 2.563 . . . . 0.0 111.594 171.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -55.3 -72.31 0.58 Allowed Glycine 0 CA--C 1.537 1.451 0 C-N-CA 125.063 1.316 . . . . 0.0 113.204 -176.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -118.19 -21.12 8.33 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 172.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 168.69 109.23 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 127.135 2.174 . . . . 0.0 108.897 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.4 ' HB1' ' HD2' ' A' ' 13' ' ' PRO . . . 62.55 166.25 0.11 Allowed Pre-proline 0 CA--C 1.558 1.254 0 C-N-CA 124.711 1.204 . . . . 0.0 113.373 -176.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.4 ' HD2' ' HB1' ' A' ' 12' ' ' ALA . 37.5 Cg_endo -74.01 162.96 37.94 Favored 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 121.69 1.594 . . . . 0.0 110.42 170.18 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 81.32 17.05 0.49 Allowed 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.899 2.08 . . . . 0.0 114.103 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -111.15 -2.34 15.84 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 126.055 1.742 . . . . 0.0 113.786 -177.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -163.56 -43.44 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.008 1.723 . . . . 0.0 110.523 176.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.46 HD13 ' C ' ' A' ' 17' ' ' LEU . 3.1 tm? -52.27 -40.22 61.44 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.67 0.788 . . . . 0.0 111.895 178.159 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.41 -27.14 14.63 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.601 0.76 . . . . 0.0 112.833 176.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -76.09 -45.19 35.22 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 125.642 1.577 . . . . 0.0 111.773 172.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.691 ' O ' HD12 ' A' ' 24' ' ' LEU . 3.9 t80 -63.33 -60.11 3.82 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 124.265 1.026 . . . . 0.0 110.698 176.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -49.87 -34.01 18.78 Favored 'General case' 0 C--N 1.343 0.314 0 CA-C-O 118.071 -0.966 . . . . 0.0 112.165 177.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.23 -50.43 40.0 Favored 'General case' 0 C--N 1.343 0.283 0 C-N-CA 125.789 1.635 . . . . 0.0 112.21 172.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -49.73 -49.19 49.0 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.931 1.241 . . . . 0.0 111.397 172.225 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.691 HD12 ' O ' ' A' ' 20' ' ' TYR . 2.9 mp -63.93 -49.59 71.99 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-O 118.754 -0.641 . . . . 0.0 110.988 177.055 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.82 -37.96 64.11 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.93 1.292 . . . . 0.0 113.286 175.053 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 20.2 t60 -73.13 -51.91 16.18 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 124.785 1.234 . . . . 0.0 110.881 179.215 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -49.82 -60.88 2.49 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 124.54 1.136 . . . . 0.0 110.227 172.084 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -52.17 -39.37 26.92 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 C-N-CA 124.173 0.989 . . . . 0.0 111.806 -179.155 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -56.13 -61.37 2.43 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.01 0.823 . . . . 0.0 111.08 175.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.4 mt -80.59 30.95 0.29 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.624 1.57 . . . . 0.0 112.09 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 8.1 mt -139.87 -52.51 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 127.304 2.242 . . . . 0.0 109.65 178.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.1 t -63.39 -35.5 80.6 Favored 'General case' 0 N--CA 1.467 0.425 0 O-C-N 120.696 -1.253 . . . . 0.0 111.459 -176.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.5 mtt85 -80.95 11.05 4.27 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 126.351 1.86 . . . . 0.0 113.905 176.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -143.07 15.78 1.9 Allowed 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.62 1.568 . . . . 0.0 113.001 177.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.6 ttt180 -114.88 -140.48 0.38 Allowed 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.537 1.135 . . . . 0.0 111.21 -177.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 7.9 p90 -41.4 -33.32 0.4 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 127.4 2.28 . . . . 0.0 113.394 170.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.392 0 O-C-N 119.318 -2.114 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.142 0 CA-C-O 116.806 -1.569 . . . . 0.0 112.232 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 28.6 Cg_endo -74.43 -42.17 0.71 Allowed 'Trans proline' 0 C--O 1.213 -0.771 0 C-N-CA 122.566 2.177 . . . . 0.0 112.884 -176.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 56.2 m 53.2 88.07 0.03 OUTLIER 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 126.244 1.817 . . . . 0.0 113.357 179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.9 mttt -124.26 83.8 56.44 Favored Pre-proline 0 CA--C 1.536 0.416 0 C-N-CA 124.939 1.295 . . . . 0.0 109.494 -177.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -71.88 101.16 1.16 Allowed 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 123.592 2.861 . . . . 0.0 109.899 178.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -55.12 -61.11 2.54 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.245 1.018 . . . . 0.0 111.366 179.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 9.9 p-10 -106.04 153.36 40.25 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 124.951 1.3 . . . . 0.0 110.759 176.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -75.49 122.89 7.24 Favored 'Trans proline' 0 N--CA 1.456 -0.689 0 C-N-CA 122.835 2.357 . . . . 0.0 110.685 174.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 149.15 123.22 1.24 Allowed Glycine 0 CA--C 1.525 0.702 0 C-N-CA 125.292 1.425 . . . . 0.0 110.399 -179.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.56 -24.11 65.15 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 113.236 0.828 . . . . 0.0 113.236 177.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -176.7 97.2 0.05 Allowed 'General case' 0 N--CA 1.466 0.358 0 C-N-CA 127.247 2.219 . . . . 0.0 107.096 175.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 59.88 166.6 0.09 OUTLIER Pre-proline 0 CA--C 1.564 1.495 0 C-N-CA 124.221 1.008 . . . . 0.0 113.637 -177.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -78.81 161.32 27.37 Favored 'Trans proline' 0 N--CA 1.457 -0.674 0 C-N-CA 122.111 1.874 . . . . 0.0 111.124 168.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 82.69 23.88 0.17 Allowed 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.916 2.086 . . . . 0.0 113.659 -179.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.59 -2.09 9.99 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 124.835 1.254 . . . . 0.0 114.254 -176.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -173.97 -45.86 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 127.258 2.223 . . . . 0.0 109.123 178.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 57.0 tp -57.25 -36.37 70.87 Favored 'General case' 0 C--N 1.343 0.317 0 CA-C-O 118.315 -0.85 . . . . 0.0 112.014 178.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -49.4 -43.09 44.13 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 118.679 0.672 . . . . 0.0 110.861 173.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -65.65 -45.68 82.05 Favored 'General case' 0 C--O 1.224 -0.28 0 C-N-CA 124.31 1.044 . . . . 0.0 111.925 177.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -60.89 -58.03 10.17 Favored 'General case' 0 C--O 1.226 -0.137 0 C-N-CA 124.354 1.062 . . . . 0.0 111.841 176.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.61 -35.33 68.15 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.673 1.189 . . . . 0.0 111.368 176.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.18 -49.69 33.6 Favored 'General case' 0 C--O 1.22 -0.464 0 C-N-CA 125.967 1.707 . . . . 0.0 111.456 177.538 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -54.72 -44.01 73.1 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 119.57 1.077 . . . . 0.0 110.17 173.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.4 mt -67.45 -40.26 85.39 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-O 118.89 -0.576 . . . . 0.0 111.461 177.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.98 -38.17 87.56 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 124.762 1.225 . . . . 0.0 113.178 172.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 51.7 t60 -71.16 -51.65 23.7 Favored 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 125.163 1.385 . . . . 0.0 108.961 178.81 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -50.34 -53.25 30.28 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 124.538 1.135 . . . . 0.0 111.569 174.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -53.63 -51.65 41.03 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 118.837 0.744 . . . . 0.0 110.525 178.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.81 -42.14 88.44 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.928 0.891 . . . . 0.0 111.481 177.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 30' ' ' LEU . 6.2 mt -64.96 -54.72 26.1 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.726 1.611 . . . . 0.0 111.572 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 43.8 mt -52.37 -51.22 34.29 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.345 0 C-N-CA 124.821 1.248 . . . . 0.0 108.228 175.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 42.4 p -55.83 -38.45 70.03 Favored 'General case' 0 N--CA 1.472 0.675 0 CA-C-N 119.181 0.901 . . . . 0.0 112.365 175.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -72.6 3.74 4.66 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 115.123 1.527 . . . . 0.0 115.123 173.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -151.59 34.73 0.56 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.971 1.708 . . . . 0.0 113.406 -178.331 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -129.73 172.35 11.72 Favored 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.055 1.342 . . . . 0.0 109.791 178.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 15.1 p90 48.0 26.4 0.97 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 125.23 1.412 . . . . 0.0 114.475 174.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.487 0 O-C-N 119.229 -2.169 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 . . . . . 0 N--CA 1.469 0.505 0 CA-C-O 117.84 -1.076 . . . . 0.0 110.564 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -72.92 48.99 1.49 Allowed 'Trans proline' 0 CA--C 1.548 1.18 0 C-N-CA 125.05 3.833 . . . . 0.0 112.73 175.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 97.5 p -163.83 88.32 0.54 Allowed 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.891 1.277 . . . . 0.0 110.027 179.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -140.67 161.92 51.81 Favored Pre-proline 0 CA--C 1.541 0.634 0 C-N-CA 124.614 1.166 . . . . 0.0 111.175 178.38 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -68.95 -174.68 0.79 Allowed 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 123.032 2.488 . . . . 0.0 111.787 178.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -44.39 126.06 5.04 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-O 121.861 0.839 . . . . 0.0 111.442 172.047 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 44.8 m-80 -106.55 128.4 26.29 Favored Pre-proline 0 CA--C 1.537 0.461 0 CA-C-O 118.102 -0.951 . . . . 0.0 108.826 178.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -73.72 61.57 4.55 Favored 'Trans proline' 0 CA--C 1.544 1.022 0 C-N-CA 124.189 3.259 . . . . 0.0 110.833 174.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -109.06 -109.75 3.31 Favored Glycine 0 C--N 1.343 0.948 0 C-N-CA 126.234 1.874 . . . . 0.0 110.0 174.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 36.8 mt-10 58.1 99.05 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 126.165 1.786 . . . . 0.0 113.486 -175.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -135.89 108.97 7.69 Favored 'General case' 0 CA--C 1.539 0.545 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 -176.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.48 154.13 45.83 Favored Pre-proline 0 CA--C 1.554 1.098 0 O-C-N 121.073 -1.017 . . . . 0.0 111.514 176.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 48.7 Cg_endo -74.36 63.79 5.41 Favored 'Trans proline' 0 CA--C 1.548 1.178 0 C-N-CA 123.863 3.042 . . . . 0.0 111.994 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.456 ' HA ' ' HB2' ' A' ' 18' ' ' ALA . . . -166.61 23.37 0.04 OUTLIER 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 126.755 2.022 . . . . 0.0 113.017 -176.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -122.23 -132.97 0.29 Allowed 'General case' 0 CA--C 1.544 0.724 0 O-C-N 121.02 -1.05 . . . . 0.0 111.325 -177.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -57.12 -32.14 66.03 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.692 1.197 . . . . 0.0 111.112 175.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.65 HD12 ' O ' ' A' ' 17' ' ' LEU . 1.0 OUTLIER -62.02 -46.75 87.79 Favored 'General case' 0 C--N 1.346 0.43 0 C-N-CA 124.707 1.203 . . . . 0.0 112.06 170.658 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.456 ' HB2' ' HA ' ' A' ' 14' ' ' ALA . . . -53.23 -36.12 60.69 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 119.752 1.16 . . . . 0.0 111.29 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -67.71 -46.04 73.35 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.333 1.053 . . . . 0.0 112.355 172.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -57.5 -53.94 52.48 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 124.806 1.242 . . . . 0.0 112.177 176.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.62 -32.67 67.45 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 118.488 -0.768 . . . . 0.0 111.49 176.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.82 -50.18 45.43 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 125.431 1.492 . . . . 0.0 111.592 174.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.14 -45.57 75.63 Favored 'General case' 0 N--CA 1.462 0.156 0 C-N-CA 123.753 0.821 . . . . 0.0 110.135 176.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.1 mt -66.39 -40.36 89.62 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 119.14 -0.457 . . . . 0.0 111.702 177.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.02 -39.94 91.68 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.497 1.119 . . . . 0.0 113.03 172.433 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 42.8 t60 -69.53 -50.38 45.56 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 125.136 1.374 . . . . 0.0 110.499 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -50.6 -59.04 4.45 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 124.342 1.057 . . . . 0.0 110.0 173.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -52.6 -46.51 49.13 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 CA-C-N 118.444 0.565 . . . . 0.0 111.374 -178.549 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -54.65 -55.25 31.57 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 123.816 0.846 . . . . 0.0 110.361 176.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.8 mt -59.08 -46.13 89.06 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.841 1.656 . . . . 0.0 112.8 179.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.479 HG23 ' NE ' ' A' ' 35' ' ' ARG . 13.2 mm -52.8 -60.07 1.34 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.39 0 C-N-CA 125.161 1.384 . . . . 0.0 108.661 172.014 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 26.0 p -57.73 -28.2 63.67 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 119.356 0.98 . . . . 0.0 113.119 175.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -76.37 -1.0 24.69 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 114.992 1.479 . . . . 0.0 114.992 173.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -149.58 20.69 0.92 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.778 1.631 . . . . 0.0 113.737 -176.042 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.479 ' NE ' HG23 ' A' ' 31' ' ' ILE . 0.0 OUTLIER -110.48 -3.79 15.86 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.768 1.627 . . . . 0.0 114.489 179.554 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 14.3 p90 -125.62 13.34 8.08 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.076 1.75 . . . . 0.0 111.193 -177.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.56 0 O-C-N 119.115 -2.241 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.478 0.955 0 CA-C-O 117.417 -1.278 . . . . 0.0 112.632 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -72.53 -54.89 0.12 Allowed 'Trans proline' 0 C--N 1.353 0.767 0 C-N-CA 122.211 1.941 . . . . 0.0 111.779 -177.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 87.9 p -168.81 167.38 11.11 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 126.899 2.079 . . . . 0.0 109.436 175.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.1 68.99 22.99 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 124.925 1.29 . . . . 0.0 109.506 171.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -71.73 143.64 42.22 Favored 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 122.198 1.932 . . . . 0.0 110.503 176.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -118.71 -54.72 2.24 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 125.441 1.496 . . . . 0.0 111.095 -179.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -113.47 152.78 45.61 Favored Pre-proline 0 CA--C 1.546 0.79 0 C-N-CA 125.296 1.438 . . . . 0.0 110.227 177.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -75.03 157.59 42.54 Favored 'Trans proline' 0 N--CA 1.453 -0.875 0 C-N-CA 122.323 2.015 . . . . 0.0 111.378 173.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 146.35 -67.96 0.4 Allowed Glycine 0 C--N 1.34 0.756 0 CA-C-O 118.553 -1.137 . . . . 0.0 110.322 175.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 59.93 104.67 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 127.514 2.326 . . . . 0.0 112.524 178.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 26.3 t0 56.53 91.28 0.03 OUTLIER 'General case' 0 C--O 1.216 -0.66 0 C-N-CA 125.074 1.349 . . . . 0.0 111.734 -173.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 62.08 159.6 0.12 Allowed Pre-proline 0 CA--C 1.556 1.183 0 C-N-CA 125.187 1.395 . . . . 0.0 114.246 -171.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_endo -78.16 112.54 3.25 Favored 'Trans proline' 0 C--N 1.352 0.735 0 C-N-CA 122.45 2.1 . . . . 0.0 110.891 178.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 75.49 47.43 0.1 Allowed 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 126.349 1.86 . . . . 0.0 113.236 177.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.1 -9.34 10.54 Favored 'General case' 0 N--CA 1.482 1.167 0 N-CA-C 114.733 1.383 . . . . 0.0 114.733 -177.614 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -140.47 -63.53 0.48 Allowed 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 127.625 2.37 . . . . 0.0 108.925 178.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.595 HD22 ' O ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -58.92 -18.13 30.62 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.704 0.802 . . . . 0.0 112.458 176.806 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.522 ' N ' HD13 ' A' ' 17' ' ' LEU . . . -48.6 -32.12 7.67 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.193 0.997 . . . . 0.0 112.167 175.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -77.11 -40.73 44.77 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.242 1.017 . . . . 0.0 113.215 174.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -61.52 -56.32 21.34 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.826 1.65 . . . . 0.0 111.848 174.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.42 -35.49 70.12 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.055 179.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.67 -51.18 52.83 Favored 'General case' 0 C--O 1.224 -0.27 0 C-N-CA 125.16 1.384 . . . . 0.0 111.82 174.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -50.75 -46.51 59.35 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 119.454 1.025 . . . . 0.0 110.211 174.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.5 mt -67.73 -47.31 69.67 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 118.99 -0.529 . . . . 0.0 111.279 178.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -35.08 68.63 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 125.029 1.331 . . . . 0.0 113.514 174.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 29.4 t60 -74.54 -52.95 10.43 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 126.033 1.733 . . . . 0.0 110.35 178.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -48.52 -62.51 1.46 Allowed 'General case' 0 C--N 1.344 0.332 0 CA-C-O 117.857 -1.068 . . . . 0.0 109.907 171.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -49.76 -43.81 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 124.511 1.124 . . . . 0.0 111.946 -177.121 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -58.43 -59.65 5.01 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.837 1.255 . . . . 0.0 111.661 175.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.0 mt -76.19 23.99 0.14 Allowed 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.218 1.807 . . . . 0.0 113.179 176.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 2.2 mm -125.95 -50.71 1.81 Allowed 'Isoleucine or valine' 0 C--O 1.223 -0.325 0 C-N-CA 126.805 2.042 . . . . 0.0 108.23 177.751 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 18.2 p -56.82 -30.31 63.62 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 120.068 1.304 . . . . 0.0 113.228 179.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 3.8 mtp85 -81.64 3.89 23.63 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.122 1.369 . . . . 0.0 114.521 174.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -154.58 29.66 0.43 Allowed 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 125.83 1.652 . . . . 0.0 113.425 -177.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -101.05 -2.29 31.97 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 120.434 -1.416 . . . . 0.0 113.769 -178.248 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -123.65 21.73 9.21 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 128.084 2.553 . . . . 0.0 111.086 -174.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.513 0 O-C-N 118.686 -2.509 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 117.33 -1.319 . . . . 0.0 110.241 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -69.92 148.23 63.58 Favored 'Trans proline' 0 N--CA 1.453 -0.865 0 C-N-CA 121.158 1.239 . . . . 0.0 109.616 -174.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 16.4 m -145.13 -55.52 0.32 Allowed 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 124.377 1.071 . . . . 0.0 109.465 177.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.3 mtmt 51.36 72.1 1.32 Allowed Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 126.422 1.889 . . . . 0.0 111.24 -172.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -67.68 163.65 34.35 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 121.786 1.657 . . . . 0.0 110.913 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.7 p30 -118.6 164.48 15.25 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 125.071 1.348 . . . . 0.0 109.637 174.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -177.54 133.91 0.36 Allowed Pre-proline 0 CA--C 1.538 0.493 0 C-N-CA 126.659 1.984 . . . . 0.0 108.0 175.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_endo -71.73 -176.02 1.86 Allowed 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.939 2.426 . . . . 0.0 111.352 169.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -65.99 -96.33 0.03 OUTLIER Glycine 0 CA--C 1.529 0.922 0 CA-C-O 118.814 -0.992 . . . . 0.0 112.424 176.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER 159.3 -37.47 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 128.431 2.692 . . . . 0.0 111.829 178.025 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -173.2 -57.16 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 126.027 1.731 . . . . 0.0 108.189 -179.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 65.08 66.72 0.86 Allowed Pre-proline 0 CA--C 1.548 0.899 0 C-N-CA 128.07 2.548 . . . . 0.0 112.7 -170.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_endo -75.66 98.78 1.21 Allowed 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 122.702 2.268 . . . . 0.0 111.143 -173.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.66 40.93 0.09 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.016 1.726 . . . . 0.0 112.561 179.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -125.26 -5.96 7.17 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.054 1.742 . . . . 0.0 113.062 -177.822 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -156.23 -46.01 0.07 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.438 2.295 . . . . 0.0 110.564 -179.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.568 HD23 ' C ' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -53.16 -27.93 23.71 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.547 0.739 . . . . 0.0 111.781 175.745 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.448 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -50.77 -39.3 52.1 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 119.038 0.835 . . . . 0.0 110.846 178.028 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 5.5 tm0? -67.28 -49.1 65.62 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.306 1.042 . . . . 0.0 111.63 174.037 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -56.52 -53.21 60.21 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 124.972 1.309 . . . . 0.0 111.828 178.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.2 -32.1 66.13 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.475 1.11 . . . . 0.0 111.168 175.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.42 -48.13 43.67 Favored 'General case' 0 C--O 1.221 -0.437 0 C-N-CA 125.125 1.37 . . . . 0.0 111.533 175.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -54.83 -47.68 73.8 Favored 'General case' 0 N--CA 1.464 0.27 0 C-N-CA 124.029 0.932 . . . . 0.0 109.716 175.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mt -65.93 -39.6 90.64 Favored 'General case' 0 C--N 1.344 0.357 0 N-CA-C 112.047 0.388 . . . . 0.0 112.047 177.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.35 -43.91 96.06 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.457 1.103 . . . . 0.0 112.304 172.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 54.9 t60 -65.43 -50.9 63.69 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 124.81 1.244 . . . . 0.0 110.513 179.334 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -50.91 -57.26 8.96 Favored 'General case' 0 C--N 1.344 0.347 0 C-N-CA 124.386 1.074 . . . . 0.0 110.731 172.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.675 ' O ' HG23 ' A' ' 32' ' ' THR . 0.1 OUTLIER -52.8 -50.16 43.86 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.347 0 CA-C-N 118.867 0.758 . . . . 0.0 110.881 178.358 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.06 -36.93 71.11 Favored 'General case' 0 CA--C 1.54 0.595 0 CA-C-N 119.147 0.885 . . . . 0.0 112.715 177.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.439 HD23 ' HA ' ' A' ' 30' ' ' LEU . 10.1 mt -72.7 -29.43 63.37 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.584 1.154 . . . . 0.0 113.754 174.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 29.2 mm -82.16 -42.27 18.69 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 C-N-CA 125.341 1.456 . . . . 0.0 110.882 177.421 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.675 HG23 ' O ' ' A' ' 28' ' ' ILE . 59.7 p -49.33 -51.44 34.37 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.915 1.286 . . . . 0.0 111.154 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -84.87 25.97 0.88 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.103 1.361 . . . . 0.0 113.215 175.09 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -157.94 32.08 0.26 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 125.027 1.331 . . . . 0.0 111.64 -178.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.6 ttt180 -142.52 163.36 33.05 Favored 'General case' 0 C--O 1.235 0.331 0 O-C-N 120.667 -1.271 . . . . 0.0 109.017 178.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 39.4 p90 48.27 20.6 0.29 Allowed 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 126.148 1.779 . . . . 0.0 114.114 177.156 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.468 0 O-C-N 118.025 -2.922 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.481 1.097 0 CA-C-O 117.137 -1.411 . . . . 0.0 111.911 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -72.34 171.8 16.23 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.0 1.8 . . . . 0.0 110.467 177.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -159.93 -178.49 7.07 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 124.578 1.151 . . . . 0.0 109.415 175.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 61.8 74.25 0.51 Allowed Pre-proline 0 CA--C 1.545 0.759 0 C-N-CA 125.373 1.469 . . . . 0.0 110.798 -178.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -71.05 174.88 9.95 Favored 'Trans proline' 0 N--CA 1.454 -0.817 0 C-N-CA 121.988 1.792 . . . . 0.0 111.213 175.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -133.38 -60.79 0.83 Allowed 'General case' 0 C--N 1.328 -0.357 0 C-N-CA 126.519 1.927 . . . . 0.0 109.21 -175.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 5.9 m120 51.58 82.99 0.23 Allowed Pre-proline 0 CA--C 1.543 0.699 0 C-N-CA 126.431 1.892 . . . . 0.0 111.255 -177.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_endo -66.93 171.75 10.7 Favored 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 122.129 1.886 . . . . 0.0 111.015 -178.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -93.66 -130.06 5.53 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.371 -1.091 . . . . 0.0 110.371 175.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -167.52 106.37 0.55 Allowed 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.882 1.673 . . . . 0.0 108.386 -179.05 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 167.04 91.53 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 127.517 2.327 . . . . 0.0 108.518 -179.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -73.44 157.79 87.42 Favored Pre-proline 0 CA--C 1.548 0.882 0 O-C-N 121.456 -0.778 . . . . 0.0 111.25 173.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -75.32 169.05 23.3 Favored 'Trans proline' 0 N--CA 1.456 -0.729 0 C-N-CA 122.564 2.176 . . . . 0.0 112.578 175.055 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -155.07 29.88 0.4 Allowed 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.85 1.26 . . . . 0.0 112.284 -178.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -123.18 -150.55 0.45 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 124.777 1.231 . . . . 0.0 109.225 -178.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -73.79 -45.0 54.3 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.224 1.009 . . . . 0.0 110.489 179.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.528 HD13 ' N ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -50.41 -25.05 3.48 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.152 1.381 . . . . 0.0 112.9 179.04 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.528 ' N ' HD13 ' A' ' 17' ' ' LEU . . . -66.29 -52.74 44.38 Favored 'General case' 0 N--CA 1.45 -0.451 0 C-N-CA 126.23 1.812 . . . . 0.0 109.96 176.026 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.34 -28.25 63.94 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.467 0.707 . . . . 0.0 112.693 176.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.528 ' O ' HD12 ' A' ' 24' ' ' LEU . 4.2 m-85 -53.14 -51.93 60.38 Favored 'General case' 0 N--CA 1.467 0.397 0 C-N-CA 124.401 1.08 . . . . 0.0 110.133 170.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.77 -29.01 67.89 Favored 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 118.708 -0.663 . . . . 0.0 112.386 176.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.55 -49.61 21.22 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.742 1.617 . . . . 0.0 111.735 177.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -58.67 -46.06 88.05 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 123.224 0.61 . . . . 0.0 109.976 176.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.528 HD12 ' O ' ' A' ' 20' ' ' TYR . 1.1 mt -62.27 -39.72 93.87 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 118.713 -0.66 . . . . 0.0 111.682 174.276 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.87 -34.57 76.24 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 124.789 1.235 . . . . 0.0 113.123 173.144 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 45.7 t60 -78.82 -53.12 7.43 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 118.706 -0.664 . . . . 0.0 110.172 178.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -46.69 -43.77 18.09 Favored 'General case' 0 C--O 1.214 -0.796 0 C-N-CA 124.679 1.192 . . . . 0.0 111.228 171.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.413 ' O ' HG23 ' A' ' 32' ' ' THR . 0.0 OUTLIER -57.57 -56.84 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 CA-C-N 119.607 1.094 . . . . 0.0 111.001 175.637 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -66.11 -26.38 67.43 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.857 1.263 . . . . 0.0 113.15 -177.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.452 HD23 ' HA ' ' A' ' 30' ' ' LEU . 5.5 mt -78.49 -55.66 5.04 Favored 'General case' 0 CA--C 1.527 0.074 0 C-N-CA 124.641 1.176 . . . . 0.0 111.208 174.546 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 5.8 mm -56.26 -44.96 80.93 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.552 0 C-N-CA 125.442 1.497 . . . . 0.0 109.818 177.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.413 HG23 ' O ' ' A' ' 28' ' ' ILE . 15.3 p -47.85 -48.0 31.19 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 119.482 1.037 . . . . 0.0 111.249 176.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.56 24.66 1.9 Allowed 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 177.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -162.73 37.36 0.11 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.23 1.412 . . . . 0.0 113.469 -175.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -141.6 -173.11 3.69 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 125.437 1.495 . . . . 0.0 109.59 178.666 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 28.0 p90 50.78 17.7 0.43 Allowed 'General case' 0 CA--C 1.56 1.359 0 C-N-CA 126.87 2.068 . . . . 0.0 115.243 173.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.563 0 O-C-N 119.328 -2.108 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 88.3 m-85 . . . . . 0 N--CA 1.486 1.34 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_endo -76.53 -61.22 0.04 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 123.826 3.017 . . . . 0.0 111.052 175.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 8.5 t -162.39 -55.56 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 123.367 0.667 . . . . 0.0 111.723 178.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.5 mtpm? -64.13 156.16 75.94 Favored Pre-proline 0 CA--C 1.542 0.66 0 C-N-CA 123.856 0.863 . . . . 0.0 111.273 176.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -75.67 81.27 2.38 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.993 2.462 . . . . 0.0 110.722 176.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -112.16 136.95 50.91 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.93 1.292 . . . . 0.0 110.559 173.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -143.15 156.3 61.49 Favored Pre-proline 0 CA--C 1.541 0.632 0 C-N-CA 124.133 0.973 . . . . 0.0 109.219 176.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -72.83 145.11 40.1 Favored 'Trans proline' 0 N--CA 1.442 -1.529 0 C-N-CA 122.752 2.301 . . . . 0.0 111.262 171.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -169.82 -73.64 0.04 OUTLIER Glycine 0 CA--C 1.525 0.715 0 N-CA-C 109.849 -1.3 . . . . 0.0 109.849 179.435 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 58.71 96.58 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.512 1.525 . . . . 0.0 112.783 -175.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -125.5 -63.85 1.11 Allowed 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 124.258 1.023 . . . . 0.0 108.627 178.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 67.38 155.28 0.14 Allowed Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 126.849 2.059 . . . . 0.0 112.404 -171.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -73.29 142.88 34.35 Favored 'Trans proline' 0 N--CA 1.454 -0.846 0 C-N-CA 121.51 1.473 . . . . 0.0 109.808 175.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 82.49 15.86 0.4 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 126.403 1.881 . . . . 0.0 113.952 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -114.43 -2.91 13.1 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.715 1.206 . . . . 0.0 113.978 -173.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -167.22 -40.93 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 127.444 2.298 . . . . 0.0 111.141 -179.402 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.456 HD13 ' O ' ' A' ' 17' ' ' LEU . 3.4 tm? -54.72 -35.85 64.11 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.283 -0.885 . . . . 0.0 112.033 178.028 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.4 32.84 0.02 OUTLIER 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 127.82 2.448 . . . . 0.0 113.573 174.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.41 ' H ' ' C ' ' A' ' 17' ' ' LEU . 3.1 tt0 -154.99 -36.95 0.09 Allowed 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 127.525 2.33 . . . . 0.0 111.547 179.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -56.37 -54.77 41.61 Favored 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 123.892 0.877 . . . . 0.0 111.301 178.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.78 -29.07 69.21 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 176.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.02 -49.47 19.7 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.834 1.654 . . . . 0.0 112.037 177.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -54.66 -48.43 72.35 Favored 'General case' 0 CA--C 1.528 0.105 0 C-N-CA 124.717 1.207 . . . . 0.0 109.17 175.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.1 mt -64.01 -38.83 92.5 Favored 'General case' 0 C--N 1.347 0.478 0 CA-C-O 119.021 -0.514 . . . . 0.0 111.673 177.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.54 -37.48 86.27 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.414 1.086 . . . . 0.0 113.138 172.184 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 35.9 t60 -71.7 -52.05 19.8 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.197 1.399 . . . . 0.0 110.291 178.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.49 -52.04 56.42 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 124.605 1.162 . . . . 0.0 111.039 174.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -55.99 -44.79 79.43 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.525 0 CA-C-N 118.638 0.654 . . . . 0.0 111.43 176.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -63.43 -29.62 70.88 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 118.64 0.654 . . . . 0.0 112.386 177.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.3 mt -75.36 -50.95 14.35 Favored 'General case' 0 CA--C 1.527 0.096 0 C-N-CA 124.379 1.072 . . . . 0.0 111.656 174.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.2 mp -64.19 -48.85 83.84 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.607 0 C-N-CA 124.893 1.277 . . . . 0.0 109.355 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -54.41 -36.15 63.66 Favored 'General case' 0 C--O 1.222 -0.373 0 CA-C-N 120.007 1.276 . . . . 0.0 111.649 176.048 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 4.0 ttp180 -79.51 5.67 12.32 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 114.438 1.274 . . . . 0.0 114.438 176.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 46.0 tp60 -161.69 54.08 0.25 Allowed 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 127.141 2.176 . . . . 0.0 112.28 -178.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -147.63 176.24 10.24 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.108 0.963 . . . . 0.0 108.821 174.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 22.3 p90 48.19 25.01 0.75 Allowed 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.39 1.476 . . . . 0.0 113.919 176.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.318 -0.802 0 O-C-N 118.84 -2.412 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 20.4 p90 . . . . . 0 N--CA 1.482 1.174 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -74.82 163.99 34.48 Favored 'Trans proline' 0 N--CA 1.46 -0.465 0 C-N-CA 121.65 1.567 . . . . 0.0 111.349 176.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 7.5 t -166.93 95.64 0.5 Allowed 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 124.548 1.139 . . . . 0.0 110.015 178.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.0 mmtt 175.52 -60.28 0.0 OUTLIER Pre-proline 0 N--CA 1.477 0.888 0 C-N-CA 126.933 2.093 . . . . 0.0 111.487 -177.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -73.07 151.54 49.98 Favored 'Trans proline' 0 N--CA 1.452 -0.924 0 C-N-CA 122.606 2.204 . . . . 0.0 110.614 175.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -160.15 162.52 33.94 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 126.349 1.859 . . . . 0.0 108.81 176.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -58.25 154.96 28.7 Favored Pre-proline 0 CA--C 1.546 0.81 0 C-N-CA 123.497 0.719 . . . . 0.0 112.184 173.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -72.75 103.46 1.57 Allowed 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 122.28 1.987 . . . . 0.0 110.561 176.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 157.47 -79.07 0.18 Allowed Glycine 0 CA--C 1.525 0.709 0 C-N-CA 124.743 1.163 . . . . 0.0 111.91 177.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -169.54 -39.82 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.364 1.065 . . . . 0.0 113.059 176.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.573 ' O ' HD22 ' A' ' 17' ' ' LEU . 28.3 t0 -174.54 98.3 0.09 Allowed 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 127.182 2.193 . . . . 0.0 107.595 174.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.716 ' HB1' ' HB3' ' A' ' 15' ' ' GLU . . . 46.2 64.53 8.0 Favored Pre-proline 0 CA--C 1.565 1.52 0 N-CA-C 114.541 1.311 . . . . 0.0 114.541 175.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -66.26 110.53 1.8 Allowed 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 123.067 2.511 . . . . 0.0 110.569 -171.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 68.69 33.05 3.94 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 125.344 1.457 . . . . 0.0 112.899 -176.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.716 ' HB3' ' HB1' ' A' ' 12' ' ' ALA . 1.9 tt0 -121.98 -139.9 0.32 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.286 1.434 . . . . 0.0 110.568 -179.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -59.92 -16.52 30.29 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.874 1.27 . . . . 0.0 112.309 -178.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.573 HD22 ' O ' ' A' ' 11' ' ' ASP . 61.1 tp -55.65 -25.44 39.26 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 126.149 1.779 . . . . 0.0 112.807 169.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.43 30.4 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 126.716 2.006 . . . . 0.0 113.798 171.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.436 ' H ' ' C ' ' A' ' 17' ' ' LEU . 19.0 tp60 -149.41 -39.58 0.15 Allowed 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 126.952 2.101 . . . . 0.0 111.106 175.323 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.414 ' HB3' HD12 ' A' ' 17' ' ' LEU . 69.4 t80 -56.18 -55.41 33.41 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.603 1.161 . . . . 0.0 110.677 -179.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.78 -31.17 69.43 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.832 177.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.49 -48.16 35.59 Favored 'General case' 0 C--O 1.218 -0.6 0 C-N-CA 126.631 1.972 . . . . 0.0 111.953 178.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.04 -47.0 78.68 Favored 'General case' 0 C--N 1.345 0.383 0 C-N-CA 125.145 1.378 . . . . 0.0 109.998 174.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 4.3 mt -65.3 -39.65 92.8 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 122.397 0.279 . . . . 0.0 111.556 176.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.02 -41.6 96.86 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.125 1.37 . . . . 0.0 113.379 172.226 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 44.5 t60 -69.8 -48.51 58.84 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 124.776 1.23 . . . . 0.0 110.493 178.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.47 -55.33 19.43 Favored 'General case' 0 C--O 1.223 -0.322 0 C-N-CA 124.016 0.926 . . . . 0.0 110.717 171.406 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -55.99 -42.81 73.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.492 0 CA-C-N 119.272 0.942 . . . . 0.0 111.34 179.254 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -61.71 -31.4 71.55 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.422 0.897 . . . . 0.0 113.422 176.111 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.6 mt -75.62 -54.27 7.25 Favored 'General case' 0 C--N 1.328 -0.337 0 C-N-CA 125.161 1.384 . . . . 0.0 110.663 173.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 20.0 mt -58.11 -48.39 84.56 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.447 0 C-N-CA 125.303 1.441 . . . . 0.0 110.194 -179.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -54.77 -30.61 57.13 Favored 'General case' 0 N--CA 1.48 1.042 0 O-C-N 120.812 -1.18 . . . . 0.0 112.155 176.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.9 -0.03 37.34 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 176.606 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -159.8 45.68 0.24 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.905 2.082 . . . . 0.0 113.245 -176.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -145.87 -179.05 6.44 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 120.747 -1.221 . . . . 0.0 109.513 177.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 25.7 p90 49.08 17.09 0.15 Allowed 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 127.275 2.23 . . . . 0.0 115.478 175.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.546 0 O-C-N 118.705 -2.497 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 . . . . . 0 N--CA 1.481 1.115 0 CA-C-O 119.363 -0.351 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_endo -75.2 -60.36 0.04 OUTLIER 'Trans proline' 0 C--N 1.351 0.665 0 C-N-CA 121.684 1.589 . . . . 0.0 111.551 177.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 52.2 p -175.79 58.96 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.063 1.345 . . . . 0.0 110.48 -177.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.7 pttt -149.95 84.24 5.93 Favored Pre-proline 0 CA--C 1.543 0.697 0 C-N-CA 124.885 1.274 . . . . 0.0 109.778 -179.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -66.28 155.76 68.36 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 121.15 1.233 . . . . 0.0 110.227 176.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -59.2 169.23 1.17 Allowed 'General case' 0 C--O 1.237 0.404 0 CA-C-O 122.12 0.962 . . . . 0.0 111.856 174.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 33.5 t30 -113.74 98.25 46.75 Favored Pre-proline 0 CA--C 1.537 0.452 0 C-N-CA 123.851 0.86 . . . . 0.0 109.544 177.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -74.08 54.88 3.3 Favored 'Trans proline' 0 CA--C 1.551 1.345 0 C-N-CA 123.66 2.907 . . . . 0.0 111.724 174.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 111.73 -78.12 0.24 Allowed Glycine 0 N--CA 1.47 0.92 0 C-N-CA 125.444 1.497 . . . . 0.0 111.419 -179.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.9 tt0 -138.93 6.2 2.4 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 113.348 0.87 . . . . 0.0 113.348 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -85.37 69.11 10.67 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.569 1.548 . . . . 0.0 109.837 177.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -155.41 159.17 31.92 Favored Pre-proline 0 CA--C 1.538 0.508 0 O-C-N 120.967 -1.083 . . . . 0.0 111.824 173.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -71.85 161.24 45.6 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 121.586 1.524 . . . . 0.0 110.947 171.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 77.0 28.34 0.65 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 126.098 1.759 . . . . 0.0 113.478 179.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 -118.42 -6.25 10.77 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.105 1.362 . . . . 0.0 114.065 -177.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -163.99 -43.46 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.957 2.103 . . . . 0.0 110.57 -178.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.494 HD13 ' C ' ' A' ' 17' ' ' LEU . 2.8 tm? -51.68 -43.53 62.77 Favored 'General case' 0 C--O 1.222 -0.38 0 C-N-CA 123.322 0.649 . . . . 0.0 110.825 178.568 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -48.93 -45.55 41.82 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 118.612 -0.709 . . . . 0.0 112.4 175.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -60.63 -40.34 91.56 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.774 0.829 . . . . 0.0 111.832 175.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -62.88 -52.28 63.72 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.007 1.723 . . . . 0.0 111.641 174.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.88 -33.6 74.51 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 124.295 1.038 . . . . 0.0 111.035 176.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.39 -49.52 33.28 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 126.643 1.977 . . . . 0.0 111.359 176.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.7 -49.93 69.5 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 119.674 1.125 . . . . 0.0 109.503 174.434 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 12.2 mt -63.18 -39.48 94.77 Favored 'General case' 0 C--N 1.341 0.238 0 CA-C-O 118.487 -0.768 . . . . 0.0 112.44 177.29 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.15 -50.07 75.14 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 119.169 0.895 . . . . 0.0 112.066 171.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 26.2 t60 -58.55 -46.89 85.91 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 124.161 0.984 . . . . 0.0 110.015 -179.269 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -70.88 19.79 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.716 1.606 . . . . 0.0 115.019 176.133 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -144.65 -48.99 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 C-N-CA 125.707 1.603 . . . . 0.0 110.387 -179.155 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -68.17 -23.36 64.85 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.501 1.52 . . . . 0.0 111.626 176.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.4 mt -79.12 -47.98 15.12 Favored 'General case' 0 C--N 1.344 0.328 0 CA-C-N 118.797 0.726 . . . . 0.0 111.041 171.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 6.3 mm -63.71 -42.38 95.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 C-N-CA 122.985 0.514 . . . . 0.0 110.701 -176.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -54.78 -38.05 66.78 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 121.32 -0.863 . . . . 0.0 111.972 174.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.35 18.78 1.35 Allowed 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 126.616 1.966 . . . . 0.0 113.689 176.049 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -142.89 -39.74 0.33 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.991 0.916 . . . . 0.0 113.386 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.76 -144.51 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.474 1.91 . . . . 0.0 111.29 179.325 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 25.8 p90 -40.48 -33.83 0.3 Allowed 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.984 1.314 . . . . 0.0 114.207 171.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.388 0 O-C-N 119.439 -2.038 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.483 1.214 0 CA-C-O 117.072 -1.442 . . . . 0.0 111.451 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -72.98 -40.49 1.76 Allowed 'Trans proline' 0 C--N 1.355 0.882 0 C-N-CA 122.283 1.988 . . . . 0.0 112.27 -177.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.2 p -132.34 80.19 1.89 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.886 1.675 . . . . 0.0 109.078 177.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.3 pttm -57.73 150.65 46.28 Favored Pre-proline 0 CA--C 1.543 0.682 0 O-C-N 121.599 -0.688 . . . . 0.0 111.01 176.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 26.0 Cg_endo -71.42 -31.95 13.16 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 122.123 1.882 . . . . 0.0 113.001 -178.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 67.52 -62.8 0.32 Allowed 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 126.751 2.02 . . . . 0.0 111.691 -178.244 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 26.5 m-20 -77.39 132.99 68.36 Favored Pre-proline 0 CA--C 1.545 0.777 0 C-N-CA 124.748 1.219 . . . . 0.0 110.999 172.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -70.38 -178.87 2.8 Favored 'Trans proline' 0 CA--C 1.547 1.148 0 C-N-CA 123.35 2.7 . . . . 0.0 111.426 170.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -39.86 -64.22 1.11 Allowed Glycine 0 N--CA 1.475 1.282 0 C-N-CA 125.344 1.449 . . . . 0.0 112.857 177.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 9.4 mp0 -136.08 -59.27 0.75 Allowed 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.714 1.206 . . . . 0.0 111.955 174.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -159.63 78.87 0.71 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.522 1.129 . . . . 0.0 111.553 178.16 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 59.8 164.62 0.09 OUTLIER Pre-proline 0 CA--C 1.561 1.387 0 C-N-CA 125.769 1.627 . . . . 0.0 113.409 -173.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -78.5 57.08 6.14 Favored 'Trans proline' 0 CA--C 1.55 1.283 0 C-N-CA 123.136 2.557 . . . . 0.0 112.294 177.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -173.91 26.17 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 125.349 1.46 . . . . 0.0 114.441 -176.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -166.93 156.0 10.5 Favored 'General case' 0 N--CA 1.461 0.088 0 N-CA-C 106.56 -1.644 . . . . 0.0 106.56 -179.199 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.0 t70 65.89 -57.6 0.34 Allowed 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 129.559 3.144 . . . . 0.0 112.135 -176.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.533 HD23 ' C ' ' A' ' 17' ' ' LEU . 2.5 tt -58.32 -46.75 85.58 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 125.678 1.591 . . . . 0.0 110.107 172.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -54.2 -38.08 65.26 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 119.389 0.995 . . . . 0.0 110.252 -177.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.83 -50.34 64.95 Favored 'General case' 0 C--O 1.221 -0.442 0 C-N-CA 124.408 1.083 . . . . 0.0 111.25 172.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 91.5 t80 -57.0 -60.23 3.9 Favored 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 124.666 1.187 . . . . 0.0 111.934 178.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.72 -36.02 66.76 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.077 1.351 . . . . 0.0 111.012 177.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.08 -49.19 38.36 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 124.471 1.108 . . . . 0.0 111.912 176.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -51.28 -47.2 62.6 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 125.207 1.403 . . . . 0.0 109.192 173.194 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.1 mt -67.33 -43.58 81.21 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 118.613 -0.708 . . . . 0.0 111.185 177.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.43 -34.2 72.2 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 172.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 41.5 t60 -75.24 -52.72 10.21 Favored 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 125.792 1.637 . . . . 0.0 110.139 178.418 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -51.18 -52.81 40.74 Favored 'General case' 0 C--O 1.221 -0.431 0 C-N-CA 124.189 0.996 . . . . 0.0 111.702 172.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -57.51 -44.44 84.85 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.353 0 CA-C-O 118.64 -0.695 . . . . 0.0 110.727 178.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.14 -34.3 73.35 Favored 'General case' 0 C--O 1.221 -0.426 0 CA-C-N 118.544 0.611 . . . . 0.0 112.018 176.441 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.98 -60.9 2.02 Favored 'General case' 0 C--O 1.215 -0.732 0 C-N-CA 124.249 1.02 . . . . 0.0 110.845 174.568 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 35.0 mm -54.0 -45.02 64.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 C-N-CA 124.625 1.17 . . . . 0.0 110.387 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.8 t -65.16 -40.72 94.71 Favored 'General case' 0 N--CA 1.47 0.525 0 O-C-N 120.417 -1.427 . . . . 0.0 112.574 176.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 9.6 ttm180 -85.23 13.23 6.65 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.222 1.409 . . . . 0.0 112.515 176.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.66 39.11 1.04 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.176 1.39 . . . . 0.0 110.514 -179.405 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -156.77 -141.86 0.1 Allowed 'General case' 0 N--CA 1.464 0.231 0 O-C-N 121.217 -0.927 . . . . 0.0 111.018 177.456 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 36.4 p90 -39.36 -38.07 0.51 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 127.527 2.331 . . . . 0.0 113.26 168.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 -0.17 0 O-C-N 119.203 -2.185 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 5.2 p90 . . . . . 0 CA--C 1.548 0.878 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -71.02 102.99 1.31 Allowed 'Trans proline' 0 C--N 1.353 0.777 0 C-N-CA 122.789 2.326 . . . . 0.0 110.561 -179.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -167.16 -55.49 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.144 0.978 . . . . 0.0 110.723 176.057 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 37.92 64.01 3.36 Favored Pre-proline 0 CA--C 1.551 0.992 0 C-N-CA 126.849 2.06 . . . . 0.0 112.163 -174.217 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -67.82 -54.3 0.35 Allowed 'Trans proline' 0 N--CA 1.441 -1.571 0 C-N-CA 122.459 2.106 . . . . 0.0 110.213 -172.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 45.44 83.93 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.097 1.759 . . . . 0.0 110.702 -178.564 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -102.78 92.77 3.73 Favored Pre-proline 0 CA--C 1.544 0.736 0 O-C-N 121.74 -0.6 . . . . 0.0 110.406 -179.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -71.28 178.7 5.2 Favored 'Trans proline' 0 CA--C 1.538 0.678 0 C-N-CA 123.092 2.528 . . . . 0.0 111.769 177.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -85.32 36.14 3.1 Favored Glycine 0 CA--C 1.531 1.057 0 C-N-CA 124.203 0.906 . . . . 0.0 113.873 177.333 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -99.5 -6.99 26.59 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.305 1.042 . . . . 0.0 112.929 -178.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -143.65 93.9 2.53 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.75 2.02 . . . . 0.0 107.613 178.766 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 55.79 86.32 0.17 Allowed Pre-proline 0 CA--C 1.545 0.782 0 C-N-CA 125.348 1.459 . . . . 0.0 113.637 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -72.16 67.77 3.36 Favored 'Trans proline' 0 CA--C 1.546 1.083 0 C-N-CA 124.155 3.237 . . . . 0.0 112.801 -177.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -171.38 39.32 0.02 OUTLIER 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 126.847 2.059 . . . . 0.0 111.312 -174.402 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -117.64 -137.33 0.35 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.976 0.91 . . . . 0.0 109.366 179.373 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -54.58 -37.99 66.17 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.828 1.251 . . . . 0.0 111.345 -178.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.474 HD23 ' N ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -48.71 -30.98 6.15 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.78 1.632 . . . . 0.0 112.963 172.55 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.474 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -63.05 -42.99 99.83 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 123.693 0.797 . . . . 0.0 110.803 177.244 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -78.44 -29.04 46.79 Favored 'General case' 0 C--O 1.225 -0.207 0 C-N-CA 123.4 0.68 . . . . 0.0 111.566 173.56 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.463 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 12.7 m-30 -62.25 -50.17 72.81 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 119.363 0.983 . . . . 0.0 110.27 178.671 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.67 -34.22 64.8 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-O 118.382 -0.818 . . . . 0.0 111.707 173.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.58 -48.46 32.61 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 125.138 1.375 . . . . 0.0 112.081 177.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.53 -49.08 65.55 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 123.947 0.899 . . . . 0.0 110.534 172.544 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.4 mt -61.89 -49.03 77.83 Favored 'General case' 0 C--N 1.346 0.434 0 CA-C-O 118.916 -0.564 . . . . 0.0 110.923 175.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.1 -30.32 61.89 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 113.786 1.032 . . . . 0.0 113.786 174.344 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 40.3 t60 -79.41 -53.48 6.87 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 124.836 1.255 . . . . 0.0 110.756 177.326 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -51.72 -50.08 61.24 Favored 'General case' 0 C--O 1.221 -0.412 0 C-N-CA 124.434 1.094 . . . . 0.0 110.448 175.661 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -55.68 -45.77 79.26 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.413 0 CA-C-N 118.766 0.712 . . . . 0.0 111.564 177.061 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -68.53 -23.98 64.59 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 113.178 0.807 . . . . 0.0 113.178 178.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.7 mt -75.87 -52.35 10.54 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 125.36 1.464 . . . . 0.0 110.868 171.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.9 mp -64.15 -47.19 91.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 124.408 1.083 . . . . 0.0 111.344 177.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.7 t -54.13 -42.73 69.84 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 119.896 1.226 . . . . 0.0 110.935 -179.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -88.56 27.13 1.33 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.75 1.22 . . . . 0.0 112.948 179.162 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 -145.61 -41.54 0.22 Allowed 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.729 1.611 . . . . 0.0 113.816 -178.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 4.9 ttt180 -69.62 -152.83 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.655 1.582 . . . . 0.0 109.64 174.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -11.68 80.7 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 128.826 2.851 . . . . 0.0 116.33 173.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.508 0 O-C-N 118.29 -2.756 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.479 0.997 0 CA-C-O 116.846 -1.55 . . . . 0.0 112.086 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -72.49 -61.92 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.795 0 C-N-CA 122.227 1.951 . . . . 0.0 111.229 -176.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.2 t -170.52 -82.45 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 125.379 1.471 . . . . 0.0 108.678 178.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.47 160.05 30.99 Favored Pre-proline 0 CA--C 1.548 0.866 0 C-N-CA 125.931 1.693 . . . . 0.0 110.357 178.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -77.82 107.96 2.45 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 124.5 3.467 . . . . 0.0 111.216 177.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -178.26 160.0 1.3 Allowed 'General case' 0 C--O 1.239 0.501 0 C-N-CA 126.65 1.98 . . . . 0.0 108.597 176.089 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -174.48 90.32 0.32 Allowed Pre-proline 0 N--CA 1.468 0.453 0 C-N-CA 124.823 1.249 . . . . 0.0 109.308 174.2 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -71.27 172.34 14.27 Favored 'Trans proline' 0 C--N 1.352 0.746 0 C-N-CA 121.913 1.742 . . . . 0.0 111.507 175.532 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -100.45 -119.3 4.37 Favored Glycine 0 CA--C 1.525 0.679 0 N-CA-C 110.662 -0.975 . . . . 0.0 110.662 176.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -178.79 -48.16 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 126.919 2.088 . . . . 0.0 110.46 179.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.95 107.6 0.36 Allowed 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 126.075 1.75 . . . . 0.0 109.465 -179.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -161.9 76.27 2.23 Favored Pre-proline 0 CA--C 1.545 0.778 0 C-N-CA 123.98 0.912 . . . . 0.0 111.278 174.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -74.88 46.9 1.59 Allowed 'Trans proline' 0 CA--C 1.548 1.218 0 C-N-CA 123.432 2.755 . . . . 0.0 113.794 -178.348 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -174.75 122.65 0.25 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.92 1.688 . . . . 0.0 109.025 -176.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 67.09 143.26 0.03 OUTLIER 'General case' 0 C--N 1.346 0.434 0 C-N-CA 126.539 1.936 . . . . 0.0 110.407 -173.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.9 t70 74.35 -47.45 0.64 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.266 1.826 . . . . 0.0 111.233 179.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 59.2 tp -55.64 -41.33 73.41 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 125.14 1.376 . . . . 0.0 111.441 175.076 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -52.58 -41.59 63.74 Favored 'General case' 0 C--O 1.223 -0.319 0 CA-C-N 119.206 0.912 . . . . 0.0 110.371 174.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.6 -45.71 74.71 Favored 'General case' 0 C--O 1.221 -0.417 0 C-N-CA 123.773 0.829 . . . . 0.0 111.693 176.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -61.29 -59.16 5.72 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 124.272 1.029 . . . . 0.0 111.444 177.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.64 -36.15 66.72 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 125.163 1.385 . . . . 0.0 110.96 176.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.4 -47.1 51.9 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-O 117.785 -1.102 . . . . 0.0 112.13 176.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -54.54 -46.92 73.69 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 119.758 1.163 . . . . 0.0 109.312 173.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.3 mt -65.48 -42.49 92.16 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 118.855 -0.593 . . . . 0.0 111.041 177.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.06 -44.12 91.79 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 124.109 0.963 . . . . 0.0 112.406 173.292 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 41.2 t60 -66.7 -52.57 43.08 Favored 'General case' 0 C--O 1.231 0.103 0 C-N-CA 125.576 1.551 . . . . 0.0 109.952 -179.201 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -50.16 -56.71 9.86 Favored 'General case' 0 C--O 1.221 -0.415 0 CA-C-O 118.156 -0.926 . . . . 0.0 110.946 171.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -53.74 -48.1 61.42 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.298 0 CA-C-N 119.167 0.894 . . . . 0.0 110.293 -179.227 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -55.41 -35.2 65.11 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.334 1.054 . . . . 0.0 112.574 178.056 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 70.4 mt -77.05 -54.17 6.88 Favored 'General case' 0 C--O 1.22 -0.461 0 C-N-CA 124.443 1.097 . . . . 0.0 111.01 175.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 21.3 mt -49.85 -41.32 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 C-N-CA 125.946 1.698 . . . . 0.0 109.411 176.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 36.5 p -63.45 -35.83 81.73 Favored 'General case' 0 N--CA 1.472 0.636 0 O-C-N 120.805 -1.185 . . . . 0.0 112.699 175.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 13.8 ttt180 -79.85 9.86 4.8 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.952 1.701 . . . . 0.0 114.3 174.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.4 pt20 -142.82 26.98 1.68 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.965 1.306 . . . . 0.0 112.445 177.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 18.6 ttt180 -128.19 -142.12 0.26 Allowed 'General case' 0 C--N 1.349 0.546 0 C-N-CA 124.159 0.984 . . . . 0.0 111.054 -179.338 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 37.4 p90 -43.37 -32.32 0.81 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 127.753 2.421 . . . . 0.0 114.191 171.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.458 0 O-C-N 120.152 -1.592 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 22.6 m-85 . . . . . 0 N--CA 1.485 1.323 0 CA-C-O 118.42 -0.8 . . . . 0.0 109.325 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 27.9 Cg_endo -77.22 -58.37 0.04 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.585 0 C-N-CA 122.731 2.288 . . . . 0.0 111.597 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -159.33 -51.98 0.06 Allowed 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 123.966 0.906 . . . . 0.0 110.96 174.363 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 30.73 83.24 0.2 Allowed Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 128.233 2.613 . . . . 0.0 111.802 -176.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -75.68 60.95 6.08 Favored 'Trans proline' 0 CA--C 1.542 0.92 0 C-N-CA 122.916 2.411 . . . . 0.0 111.318 -177.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -123.14 171.2 9.49 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 128.376 2.67 . . . . 0.0 109.071 179.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -50.38 128.84 24.68 Favored Pre-proline 0 CA--C 1.551 0.992 0 C-N-CA 123.611 0.764 . . . . 0.0 111.66 -179.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -68.53 130.86 21.74 Favored 'Trans proline' 0 N--CA 1.456 -0.735 0 C-N-CA 121.768 1.646 . . . . 0.0 110.068 179.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -126.45 -138.55 4.85 Favored Glycine 0 CA--C 1.528 0.891 0 C-N-CA 125.411 1.482 . . . . 0.0 109.563 176.152 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -160.94 -48.78 0.05 OUTLIER 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.762 1.225 . . . . 0.0 111.237 177.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -121.36 -64.51 1.22 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 125.999 1.719 . . . . 0.0 108.799 177.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.594 ' HB1' ' HD2' ' A' ' 13' ' ' PRO . . . -137.96 173.04 5.78 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 125.397 1.479 . . . . 0.0 111.879 -176.826 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.594 ' HD2' ' HB1' ' A' ' 12' ' ' ALA . 37.0 Cg_endo -74.82 144.82 31.4 Favored 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 122.416 2.077 . . . . 0.0 110.528 170.505 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 78.12 46.79 0.05 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.938 1.695 . . . . 0.0 113.383 177.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -122.92 -5.34 8.52 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 114.982 1.475 . . . . 0.0 114.982 -176.045 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -138.05 -75.02 0.4 Allowed 'General case' 0 N--CA 1.466 0.33 0 C-N-CA 126.835 2.054 . . . . 0.0 108.972 177.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.484 HD22 ' C ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -51.75 -26.05 8.74 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.256 1.422 . . . . 0.0 113.184 -177.809 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.23 -58.43 8.32 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 126.288 1.835 . . . . 0.0 110.51 172.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -66.54 -29.97 70.18 Favored 'General case' 0 C--O 1.224 -0.253 0 C-N-CA 123.498 0.719 . . . . 0.0 112.247 177.161 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.452 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 4.7 m-85 -53.7 -49.43 68.08 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.715 0.806 . . . . 0.0 110.467 171.224 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.56 -29.62 70.71 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 112.448 0.536 . . . . 0.0 112.448 175.532 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -76.49 -47.44 22.83 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.445 1.498 . . . . 0.0 112.519 178.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -55.6 -50.31 70.46 Favored 'General case' 0 N--CA 1.465 0.281 0 C-N-CA 124.319 1.048 . . . . 0.0 109.946 172.759 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.6 mt -62.84 -37.46 86.92 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 118.746 -0.645 . . . . 0.0 111.431 177.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.43 -45.32 94.79 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.539 1.136 . . . . 0.0 113.078 171.961 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 38.6 t60 -64.62 -51.13 64.27 Favored 'General case' 0 C--N 1.334 -0.107 0 C-N-CA 124.097 0.959 . . . . 0.0 109.923 179.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -50.97 -56.5 12.11 Favored 'General case' 0 CA--C 1.517 -0.326 0 C-N-CA 123.956 0.902 . . . . 0.0 110.982 173.329 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -55.33 -42.93 69.18 Favored 'Isoleucine or valine' 0 C--N 1.343 0.32 0 CA-C-N 118.746 0.703 . . . . 0.0 112.472 179.243 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -63.82 -37.59 87.94 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 122.995 0.518 . . . . 0.0 112.049 175.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.7 mt -66.8 -51.58 53.98 Favored 'General case' 0 C--O 1.226 -0.164 0 C-N-CA 124.414 1.086 . . . . 0.0 110.281 176.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 13.6 mm -64.77 -55.53 20.58 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.506 0 C-N-CA 124.118 0.967 . . . . 0.0 110.432 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.7 t -51.34 -41.06 60.32 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 120.658 1.572 . . . . 0.0 111.885 -179.016 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 17.3 ttt180 -84.71 14.73 4.4 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.567 1.147 . . . . 0.0 113.682 177.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -156.71 30.5 0.32 Allowed 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 126.469 1.908 . . . . 0.0 112.942 -176.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.6 ttt180 -123.95 -137.53 0.29 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.218 1.007 . . . . 0.0 110.257 -179.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 46.6 p90 -22.09 85.47 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 130.091 3.356 . . . . 0.0 114.347 172.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.316 -0.869 0 O-C-N 117.762 -3.087 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 . . . . . 0 N--CA 1.473 0.686 0 CA-C-O 119.276 -0.393 . . . . 0.0 110.424 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -73.23 -62.15 0.04 OUTLIER 'Trans proline' 0 C--N 1.348 0.521 0 C-N-CA 122.6 2.2 . . . . 0.0 111.808 -179.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 26.6 t -168.03 -53.48 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.261 1.424 . . . . 0.0 110.891 176.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 18.1 mttp -127.09 70.81 75.35 Favored Pre-proline 0 CA--C 1.545 0.756 0 C-N-CA 126.822 2.049 . . . . 0.0 110.166 -179.006 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -73.86 75.77 3.07 Favored 'Trans proline' 0 C--N 1.355 0.89 0 C-N-CA 124.075 3.184 . . . . 0.0 111.199 179.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -163.84 91.84 0.66 Allowed 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.612 1.165 . . . . 0.0 109.463 178.478 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -158.86 131.08 4.25 Favored Pre-proline 0 C--O 1.241 0.636 0 O-C-N 121.103 -0.998 . . . . 0.0 109.753 176.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -68.8 138.75 41.84 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 121.852 1.701 . . . . 0.0 110.093 172.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -124.56 -128.92 3.34 Favored Glycine 0 C--N 1.334 0.419 0 N-CA-C 108.744 -1.742 . . . . 0.0 108.744 173.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 63.65 114.86 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 126.32 1.848 . . . . 0.0 111.158 -175.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 48.08 79.63 0.07 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.342 1.057 . . . . 0.0 113.584 179.192 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.24 142.3 38.48 Favored Pre-proline 0 CA--C 1.544 0.745 0 O-C-N 121.576 -0.702 . . . . 0.0 112.356 -176.081 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -69.12 116.4 4.47 Favored 'Trans proline' 0 C--N 1.355 0.91 0 C-N-CA 122.986 2.458 . . . . 0.0 111.208 -174.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -165.59 44.3 0.08 Allowed 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.113 0.965 . . . . 0.0 112.504 -178.901 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -119.33 -134.07 0.32 Allowed 'General case' 0 CA--C 1.542 0.672 0 O-C-N 121.33 -0.856 . . . . 0.0 111.693 -175.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -48.55 -43.81 35.96 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.607 1.563 . . . . 0.0 111.397 174.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.544 HD23 ' C ' ' A' ' 17' ' ' LEU . 4.0 tt -52.76 -46.59 67.59 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-O 117.96 -1.019 . . . . 0.0 111.382 172.172 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -55.65 -40.96 72.93 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 119.746 1.157 . . . . 0.0 110.138 -178.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -45.77 78.2 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.196 0.999 . . . . 0.0 112.326 174.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -60.07 -53.3 59.39 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.523 1.129 . . . . 0.0 111.835 177.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.42 -31.98 64.43 Favored 'General case' 0 C--O 1.219 -0.513 0 C-N-CA 124.986 1.315 . . . . 0.0 111.203 175.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.93 -51.03 24.13 Favored 'General case' 0 C--O 1.219 -0.534 0 C-N-CA 124.996 1.318 . . . . 0.0 111.699 174.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -52.2 -47.76 65.43 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 123.851 0.86 . . . . 0.0 109.888 174.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.1 mt -65.83 -40.57 91.9 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.681 -0.676 . . . . 0.0 111.466 177.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.3 -37.07 79.41 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.621 1.168 . . . . 0.0 113.042 172.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -73.12 -51.67 17.1 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.151 1.381 . . . . 0.0 110.197 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -52.01 -54.69 26.87 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 123.767 0.827 . . . . 0.0 110.764 173.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -54.71 -42.85 63.62 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 CA-C-N 119.244 0.929 . . . . 0.0 111.748 178.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -60.79 -40.96 94.6 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.035 0.534 . . . . 0.0 111.598 174.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.9 -28.56 65.72 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.627 1.171 . . . . 0.0 113.867 175.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 46.7 mm -83.24 -33.25 9.97 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 C-N-CA 124.492 1.117 . . . . 0.0 110.924 175.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.2 -39.44 54.7 Favored 'General case' 0 N--CA 1.47 0.536 0 O-C-N 120.771 -1.206 . . . . 0.0 111.999 176.587 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.81 -13.02 61.79 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 113.489 0.922 . . . . 0.0 113.489 176.181 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.0 tt0 -76.31 -35.33 58.88 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 124.774 1.23 . . . . 0.0 111.456 177.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -84.62 -134.26 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 123.592 0.757 . . . . 0.0 110.597 -178.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 44.5 p90 -43.81 -34.8 1.68 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 126.845 2.058 . . . . 0.0 113.339 170.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.4 0 O-C-N 119.47 -2.019 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 86.1 m-85 . . . . . 0 N--CA 1.482 1.14 0 CA-C-O 118.715 -0.66 . . . . 0.0 110.668 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -73.25 -49.88 0.21 Allowed 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 122.442 2.094 . . . . 0.0 112.566 -179.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 170.39 -33.54 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 128.243 2.617 . . . . 0.0 112.164 176.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.0 mttm -126.04 79.03 69.8 Favored Pre-proline 0 CA--C 1.537 0.474 0 C-N-CA 126.221 1.808 . . . . 0.0 109.057 175.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -73.49 130.52 15.04 Favored 'Trans proline' 0 N--CA 1.453 -0.872 0 C-N-CA 122.758 2.305 . . . . 0.0 110.93 174.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -69.98 139.67 52.84 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.277 0.631 . . . . 0.0 109.504 177.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 23.7 p-10 -147.58 150.54 37.17 Favored Pre-proline 0 CA--C 1.539 0.542 0 C-N-CA 123.057 0.543 . . . . 0.0 111.2 177.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 28.7 Cg_endo -71.29 149.26 56.95 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 121.78 1.654 . . . . 0.0 110.209 172.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -74.94 -72.86 1.0 Allowed Glycine 0 CA--C 1.527 0.797 0 CA-C-O 119.067 -0.852 . . . . 0.0 111.664 177.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 172.2 -37.26 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 128.324 2.65 . . . . 0.0 111.448 173.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -152.75 105.08 2.93 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.842 2.057 . . . . 0.0 108.689 -178.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -165.06 83.23 1.15 Allowed Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 124.678 1.191 . . . . 0.0 110.003 175.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 37.8 Cg_endo -71.19 163.01 40.64 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.316 2.011 . . . . 0.0 110.951 175.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 89.63 17.25 0.05 OUTLIER 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 127.717 2.407 . . . . 0.0 112.589 179.656 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -166.42 151.17 7.85 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 127.375 2.27 . . . . 0.0 105.682 -177.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.1 t70 68.79 -45.0 0.53 Allowed 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 129.043 2.937 . . . . 0.0 113.569 179.443 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.418 ' C ' ' H ' ' A' ' 19' ' ' GLN . 53.5 tp -54.45 -25.41 24.94 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 126.45 1.9 . . . . 0.0 112.861 173.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.6 32.85 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 127.948 2.499 . . . . 0.0 113.752 169.848 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.418 ' H ' ' C ' ' A' ' 17' ' ' LEU . 21.9 tt0 -153.93 -38.12 0.1 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 127.015 2.126 . . . . 0.0 111.314 176.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 91.7 t80 -55.41 -55.3 33.25 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 119.924 1.238 . . . . 0.0 110.942 179.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.66 -33.0 69.61 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.884 177.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.34 -47.59 41.18 Favored 'General case' 0 C--O 1.222 -0.372 0 C-N-CA 126.517 1.927 . . . . 0.0 112.228 178.321 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -55.87 -47.9 76.51 Favored 'General case' 0 N--CA 1.46 0.058 0 C-N-CA 124.582 1.153 . . . . 0.0 109.521 174.151 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.8 mt -64.34 -38.15 90.03 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 119.162 -0.447 . . . . 0.0 111.968 176.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.76 -34.14 77.63 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.042 1.337 . . . . 0.0 113.81 171.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 46.2 t60 -75.12 -49.86 18.23 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 125.053 1.341 . . . . 0.0 110.174 178.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -50.39 -55.11 17.14 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 124.491 1.116 . . . . 0.0 110.038 172.411 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -58.18 -41.12 80.04 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 118.867 0.758 . . . . 0.0 112.543 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -58.32 -49.47 77.06 Favored 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 123.373 0.669 . . . . 0.0 110.559 175.07 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.3 mt -62.79 -44.2 96.81 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 118.822 -0.609 . . . . 0.0 111.985 176.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 5.3 mm -61.24 -56.13 19.96 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.294 0 C-N-CA 125.593 1.557 . . . . 0.0 110.158 178.193 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.2 t -57.32 -39.59 76.14 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 119.589 1.086 . . . . 0.0 111.48 179.081 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 16.7 mtp85 -78.8 11.48 2.61 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.36 1.464 . . . . 0.0 114.796 172.618 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.0 tm0? -142.64 20.05 2.01 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 126.688 1.995 . . . . 0.0 112.351 179.364 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.7 tpt180 -129.28 -141.81 0.25 Allowed 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.443 -1.411 . . . . 0.0 111.355 -177.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 30.1 p90 -42.9 -32.48 0.63 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 127.669 2.387 . . . . 0.0 113.564 170.265 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.356 0 O-C-N 119.672 -1.892 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 68.2 m-85 . . . . . 0 N--CA 1.478 0.972 0 CA-C-O 119.249 -0.405 . . . . 0.0 111.369 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -72.89 -63.89 0.04 OUTLIER 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 121.936 1.757 . . . . 0.0 111.168 178.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.1 t -165.44 -170.67 1.91 Allowed 'General case' 0 C--O 1.237 0.442 0 C-N-CA 125.476 1.51 . . . . 0.0 109.83 176.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.0 mttt -53.67 152.18 9.96 Favored Pre-proline 0 N--CA 1.473 0.681 0 C-N-CA 124.825 1.25 . . . . 0.0 111.593 174.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -71.34 145.0 47.2 Favored 'Trans proline' 0 N--CA 1.455 -0.791 0 C-N-CA 122.002 1.801 . . . . 0.0 110.553 179.355 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -128.79 162.88 26.42 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 127.142 2.177 . . . . 0.0 107.89 178.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 70.02 154.79 0.15 Allowed Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 127.559 2.344 . . . . 0.0 111.988 -176.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -73.24 179.04 5.83 Favored 'Trans proline' 0 CA--C 1.549 1.232 0 C-N-CA 122.409 2.073 . . . . 0.0 111.003 172.338 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -165.41 91.08 0.1 Allowed Glycine 0 C--N 1.339 0.74 0 N-CA-C 112.036 -0.426 . . . . 0.0 112.036 -178.424 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 mp0 -149.06 116.03 6.01 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 126.031 1.733 . . . . 0.0 108.229 -179.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 5.2 t70 71.62 -58.1 0.59 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 127.376 2.27 . . . . 0.0 111.474 -179.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 43.0 72.52 1.14 Allowed Pre-proline 0 CA--C 1.54 0.581 0 C-N-CA 127.855 2.462 . . . . 0.0 112.478 -178.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -69.45 80.54 0.79 Allowed 'Trans proline' 0 C--N 1.353 0.804 0 C-N-CA 124.079 3.186 . . . . 0.0 110.994 -173.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 70.95 33.16 2.19 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.623 2.369 . . . . 0.0 113.797 -173.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -119.26 -6.83 10.34 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 -175.736 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -175.81 -36.83 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 127.646 2.378 . . . . 0.0 111.09 -179.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.427 ' C ' ' H ' ' A' ' 19' ' ' GLN . 38.7 tp -58.7 -21.55 55.06 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.664 1.186 . . . . 0.0 112.685 176.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.63 30.67 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 128.111 2.564 . . . . 0.0 113.839 174.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.427 ' H ' ' C ' ' A' ' 17' ' ' LEU . 7.3 tm0? -154.24 -37.77 0.09 Allowed 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 127.45 2.3 . . . . 0.0 111.186 178.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.425 ' HB3' HD12 ' A' ' 17' ' ' LEU . 74.7 t80 -59.88 -59.12 5.94 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 124.453 1.101 . . . . 0.0 110.481 177.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.73 -34.11 62.04 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 119.351 -0.357 . . . . 0.0 111.212 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.15 -45.31 57.4 Favored 'General case' 0 C--O 1.212 -0.882 0 C-N-CA 126.261 1.824 . . . . 0.0 112.261 176.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -54.65 -49.36 70.77 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 120.69 1.586 . . . . 0.0 109.15 174.524 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.9 mp -61.46 -55.72 28.14 Favored 'General case' 0 C--N 1.345 0.379 0 CA-C-O 118.847 -0.597 . . . . 0.0 111.022 175.353 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.85 -45.66 64.13 Favored 'General case' 0 C--O 1.208 -1.127 0 CA-C-O 118.134 -0.936 . . . . 0.0 112.027 177.131 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 18.7 t60 -60.0 -52.62 64.59 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 124.629 1.172 . . . . 0.0 109.697 179.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -70.52 19.7 0.05 OUTLIER 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.908 1.683 . . . . 0.0 114.962 176.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -141.69 -48.24 0.22 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.415 0 C-N-CA 125.656 1.582 . . . . 0.0 110.289 179.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.422 ' HA ' HG22 ' A' ' 32' ' ' THR . 0.7 OUTLIER -65.99 -31.92 73.11 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 125.684 1.594 . . . . 0.0 110.376 176.297 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 17.1 mt -76.01 -36.68 59.06 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 119.09 0.859 . . . . 0.0 112.155 175.514 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 10.9 mm -75.42 -47.92 32.89 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 123.236 0.615 . . . . 0.0 109.81 -179.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.422 HG22 ' HA ' ' A' ' 29' ' ' ASN . 4.8 t -53.74 -43.31 68.99 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.312 1.045 . . . . 0.0 111.601 179.16 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.37 2.63 18.04 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.545 1.138 . . . . 0.0 113.809 178.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -132.93 15.97 4.24 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.875 2.47 . . . . 0.0 113.07 -173.414 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.95 -144.01 0.25 Allowed 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 124.166 0.986 . . . . 0.0 110.333 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 7.5 p90 -41.32 -34.81 0.55 Allowed 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.237 1.815 . . . . 0.0 113.588 172.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.333 0 O-C-N 119.639 -1.913 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 27.5 p90 . . . . . 0 N--CA 1.481 1.093 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -76.64 -71.68 0.01 OUTLIER 'Trans proline' 0 CA--C 1.536 0.575 0 C-N-CA 122.064 1.843 . . . . 0.0 111.583 178.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 9.0 p -112.37 -66.05 1.12 Allowed 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 126.259 1.824 . . . . 0.0 110.625 -177.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 58.83 80.61 0.27 Allowed Pre-proline 0 N--CA 1.473 0.725 0 C-N-CA 126.951 2.1 . . . . 0.0 111.811 -178.81 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -70.26 -53.17 0.25 Allowed 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 123.107 2.538 . . . . 0.0 112.752 -175.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -160.4 -86.41 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 125.628 1.571 . . . . 0.0 107.724 174.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 33.9 t-20 -161.3 102.17 1.23 Allowed Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 126.847 2.059 . . . . 0.0 108.936 179.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -78.86 102.26 1.52 Allowed 'Trans proline' 0 CA--C 1.54 0.791 0 C-N-CA 123.37 2.713 . . . . 0.0 112.215 175.735 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 174.79 78.44 0.05 OUTLIER Glycine 0 CA--C 1.526 0.738 0 CA-C-O 118.525 -1.153 . . . . 0.0 113.285 178.646 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 172.24 -28.18 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 127.271 2.228 . . . . 0.0 112.456 -179.601 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -138.34 84.96 2.06 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 125.87 1.668 . . . . 0.0 109.065 177.694 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.591 ' HB1' ' HD2' ' A' ' 13' ' ' PRO . . . -154.84 171.5 7.09 Favored Pre-proline 0 CA--C 1.544 0.748 0 O-C-N 121.265 -0.897 . . . . 0.0 111.207 177.646 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.591 ' HD2' ' HB1' ' A' ' 12' ' ' ALA . 38.6 Cg_endo -70.68 -179.85 3.64 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 122.373 2.049 . . . . 0.0 111.06 169.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 82.12 46.81 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.709 2.004 . . . . 0.0 112.973 179.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -117.67 -1.58 11.59 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 114.376 1.25 . . . . 0.0 114.376 -176.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -163.2 -63.21 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.983 1.713 . . . . 0.0 108.226 -178.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.596 HD13 ' N ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -51.74 -27.35 11.72 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.615 1.566 . . . . 0.0 113.463 -179.562 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.596 ' N ' HD13 ' A' ' 17' ' ' LEU . . . -61.18 -52.09 66.28 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 126.124 1.77 . . . . 0.0 111.248 174.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -28.54 62.53 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-O 118.877 -0.583 . . . . 0.0 111.041 174.265 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.449 ' HB2' ' HA ' ' A' ' 17' ' ' LEU . 10.7 m-30 -60.82 -48.27 82.54 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 119.464 1.029 . . . . 0.0 110.152 178.215 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.12 -31.84 70.44 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 118.657 -0.687 . . . . 0.0 112.378 173.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.49 -48.05 24.36 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 125.34 1.456 . . . . 0.0 112.346 179.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -55.35 -49.13 73.04 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 125.543 1.537 . . . . 0.0 109.3 174.069 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.0 mt -63.03 -41.79 99.62 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-O 118.64 -0.695 . . . . 0.0 111.705 176.247 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -37.68 77.73 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.96 0.904 . . . . 0.0 113.155 172.101 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 39.3 t60 -70.39 -54.05 14.02 Favored 'General case' 0 C--N 1.334 -0.094 0 C-N-CA 124.941 1.296 . . . . 0.0 110.804 177.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -52.16 -51.09 60.11 Favored 'General case' 0 C--N 1.342 0.27 0 C-N-CA 124.3 1.04 . . . . 0.0 110.72 176.557 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -57.12 -45.21 84.25 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 CA-C-O 118.653 -0.689 . . . . 0.0 111.888 177.523 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -64.95 -27.99 69.22 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 113.036 0.754 . . . . 0.0 113.036 176.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.6 mt -73.71 -52.95 11.55 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 124.962 1.305 . . . . 0.0 111.325 172.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 2.1 mp -59.57 -50.24 80.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.304 0 CA-C-O 118.029 -0.986 . . . . 0.0 109.431 177.08 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.552 ' HA ' ' CG ' ' A' ' 35' ' ' ARG . 0.5 OUTLIER -54.01 -27.22 30.54 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 119.772 1.169 . . . . 0.0 113.181 179.826 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -77.82 4.74 11.06 Favored 'General case' 0 C--O 1.223 -0.301 0 N-CA-C 115.067 1.506 . . . . 0.0 115.067 174.427 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -142.37 -42.37 0.33 Allowed 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 127.515 2.326 . . . . 0.0 113.746 -174.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.552 ' CG ' ' HA ' ' A' ' 32' ' ' THR . 0.2 OUTLIER -54.13 160.52 1.53 Allowed 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 119.353 0.979 . . . . 0.0 110.33 168.795 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 26.1 p90 48.09 14.35 0.05 Allowed 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 126.641 1.976 . . . . 0.0 115.62 -179.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.482 0 O-C-N 118.173 -2.83 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 . . . . . 0 N--CA 1.476 0.851 0 CA-C-O 119.636 -0.221 . . . . 0.0 110.42 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -76.02 86.84 1.47 Allowed 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 123.398 2.732 . . . . 0.0 111.059 178.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -155.19 -45.93 0.08 Allowed 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.072 1.349 . . . . 0.0 111.316 178.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -119.14 83.35 24.31 Favored Pre-proline 0 CA--C 1.544 0.723 0 C-N-CA 124.82 1.248 . . . . 0.0 109.904 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -69.1 171.9 12.94 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 123.077 2.518 . . . . 0.0 111.748 178.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -85.74 171.61 11.47 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.108 0.563 . . . . 0.0 111.704 173.051 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -136.54 133.89 19.39 Favored Pre-proline 0 CA--C 1.541 0.609 0 C-N-CA 123.744 0.818 . . . . 0.0 109.902 175.829 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -73.21 103.05 1.54 Allowed 'Trans proline' 0 C--N 1.348 0.537 0 C-N-CA 123.003 2.469 . . . . 0.0 110.828 176.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 97.58 116.41 3.49 Favored Glycine 0 CA--C 1.526 0.779 0 C-N-CA 124.841 1.21 . . . . 0.0 111.612 -177.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.59 -29.99 67.64 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 175.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -169.44 102.5 0.34 Allowed 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 127.089 2.156 . . . . 0.0 106.583 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.606 ' HB1' ' O ' ' A' ' 15' ' ' GLU . . . 52.72 80.99 0.27 Allowed Pre-proline 0 CA--C 1.555 1.147 0 N-CA-C 113.565 0.95 . . . . 0.0 113.565 173.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -71.97 73.79 2.46 Favored 'Trans proline' 0 C--N 1.355 0.869 0 C-N-CA 124.029 3.153 . . . . 0.0 111.392 -176.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . 72.21 38.85 0.82 Allowed 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 128.011 2.524 . . . . 0.0 112.956 179.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.606 ' O ' ' HB1' ' A' ' 12' ' ' ALA . 1.4 tp10 -172.85 143.56 1.23 Allowed 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 125.357 1.463 . . . . 0.0 108.479 -178.216 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.6 t0 84.17 -42.72 0.08 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 128.781 2.833 . . . . 0.0 110.758 -177.627 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.592 HD13 ' N ' ' A' ' 18' ' ' ALA . 0.0 OUTLIER -48.53 -26.47 2.2 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.935 1.694 . . . . 0.0 114.049 177.224 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.592 ' N ' HD13 ' A' ' 17' ' ' LEU . . . -61.39 -56.48 19.86 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.629 1.971 . . . . 0.0 110.36 172.744 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -69.73 -28.79 66.1 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 123.708 0.803 . . . . 0.0 112.358 177.682 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.511 ' O ' HD12 ' A' ' 24' ' ' LEU . 6.1 m-85 -53.65 -52.82 58.72 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.762 0.825 . . . . 0.0 110.288 169.225 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.9 -30.45 69.03 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-O 118.358 -0.83 . . . . 0.0 113.028 176.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.54 -48.75 30.64 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.403 1.481 . . . . 0.0 112.358 176.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.4 -48.1 79.97 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 118.411 0.55 . . . . 0.0 109.733 176.532 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.511 HD12 ' O ' ' A' ' 20' ' ' TYR . 0.9 OUTLIER -59.94 -42.54 94.24 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.429 0.692 . . . . 0.0 111.394 174.911 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.07 -36.18 76.79 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 124.724 1.209 . . . . 0.0 113.18 174.16 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 32.9 t60 -75.85 -50.77 14.15 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 123.724 0.809 . . . . 0.0 110.34 177.102 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -51.87 -46.89 64.65 Favored 'General case' 0 C--O 1.222 -0.393 0 C-N-CA 124.888 1.275 . . . . 0.0 112.51 175.148 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.4 ' O ' HG23 ' A' ' 32' ' ' THR . 0.1 OUTLIER -57.55 -49.18 81.28 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 CA-C-N 119.19 0.905 . . . . 0.0 110.374 176.176 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -64.12 -22.61 67.0 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.334 1.053 . . . . 0.0 112.821 177.629 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.7 mt -80.55 -62.17 1.75 Allowed 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 124.237 1.015 . . . . 0.0 111.103 171.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 21.8 mm -48.8 -44.84 15.3 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 C-N-CA 125.44 1.496 . . . . 0.0 111.011 179.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.4 HG23 ' O ' ' A' ' 28' ' ' ILE . 18.6 p -51.91 -42.96 63.18 Favored 'General case' 0 CA--C 1.545 0.757 0 O-C-N 121.183 -0.948 . . . . 0.0 113.163 173.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -79.69 17.33 0.92 Allowed 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 174.721 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.8 pt20 -159.18 33.58 0.2 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.703 1.601 . . . . 0.0 113.273 -177.023 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.6 ttt-85 -138.53 -138.49 0.14 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.668 0.787 . . . . 0.0 111.265 -178.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 51.6 p90 -37.67 -39.02 0.31 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 127.821 2.449 . . . . 0.0 113.51 172.078 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.468 0 O-C-N 119.512 -1.993 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 . . . . . 0 N--CA 1.477 0.881 0 CA-C-O 117.534 -1.222 . . . . 0.0 109.824 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -72.54 162.31 41.72 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 123.648 2.899 . . . . 0.0 111.198 173.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 8.1 t 50.28 93.24 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.883 1.673 . . . . 0.0 112.118 -173.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 33.1 mttt -112.97 83.19 5.8 Favored Pre-proline 0 CA--C 1.534 0.361 0 C-N-CA 123.947 0.899 . . . . 0.0 109.006 179.067 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -73.8 65.35 4.91 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.609 2.873 . . . . 0.0 109.784 175.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -57.9 130.23 45.53 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.078 0.951 . . . . 0.0 109.755 175.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 27.1 p30 -151.02 158.75 34.59 Favored Pre-proline 0 CA--C 1.538 0.493 0 C-N-CA 123.448 0.699 . . . . 0.0 110.538 178.097 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -74.91 169.0 23.58 Favored 'Trans proline' 0 N--CA 1.452 -0.963 0 C-N-CA 121.914 1.742 . . . . 0.0 111.219 168.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -170.64 -72.64 0.04 OUTLIER Glycine 0 C--N 1.332 0.33 0 N-CA-C 110.078 -1.209 . . . . 0.0 110.078 178.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 65.42 -52.09 0.36 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 126.555 1.942 . . . . 0.0 112.426 -176.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.9 t0 70.69 -62.98 0.43 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.996 2.518 . . . . 0.0 109.323 -177.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.456 ' HB1' ' HD2' ' A' ' 13' ' ' PRO . . . -159.26 166.64 15.88 Favored Pre-proline 0 CA--C 1.544 0.747 0 C-N-CA 126.615 1.966 . . . . 0.0 111.778 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . 0.456 ' HD2' ' HB1' ' A' ' 12' ' ' ALA . 41.1 Cg_endo -74.01 78.93 2.44 Favored 'Trans proline' 0 N--CA 1.454 -0.828 0 C-N-CA 123.773 2.982 . . . . 0.0 112.176 177.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -154.52 164.26 38.95 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.235 1.414 . . . . 0.0 109.415 175.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 62.45 -6.74 0.14 Allowed 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 126.459 1.904 . . . . 0.0 115.949 -178.016 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -138.43 -71.45 0.42 Allowed 'General case' 0 N--CA 1.468 0.438 0 C-N-CA 127.899 2.48 . . . . 0.0 108.08 -176.168 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.544 HD23 ' C ' ' A' ' 17' ' ' LEU . 4.9 tt -61.2 -49.5 76.9 Favored 'General case' 0 C--N 1.344 0.338 0 C-N-CA 123.627 0.771 . . . . 0.0 111.126 177.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -53.28 -42.87 66.99 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 118.891 0.769 . . . . 0.0 110.9 -176.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 2.4 tm0? -67.4 -44.91 77.68 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.838 1.655 . . . . 0.0 111.785 175.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 68.9 t80 -58.45 -54.29 48.7 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 125.117 1.367 . . . . 0.0 112.342 175.595 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.9 -34.32 69.69 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.45 1.1 . . . . 0.0 110.598 177.174 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.25 -49.16 46.02 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 124.789 1.235 . . . . 0.0 111.796 175.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -51.4 -47.38 62.93 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.302 1.041 . . . . 0.0 109.957 172.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 7.3 mt -66.45 -41.03 89.7 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 111.971 0.36 . . . . 0.0 111.971 178.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.92 -29.03 70.24 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.581 1.152 . . . . 0.0 113.788 172.132 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 57.9 t60 -78.75 -51.52 9.66 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.544 1.538 . . . . 0.0 110.061 177.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -49.92 -48.81 51.53 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 124.29 1.036 . . . . 0.0 110.387 175.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -59.47 -46.39 92.86 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 CA-C-N 118.405 0.548 . . . . 0.0 111.857 178.457 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -57.97 -46.74 84.66 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 124.799 1.24 . . . . 0.0 110.288 177.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.0 mt -65.62 -38.37 89.23 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.866 1.266 . . . . 0.0 112.924 175.339 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.431 HD13 ' HA ' ' A' ' 31' ' ' ILE . 6.8 mm -60.76 -46.58 95.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 C-N-CA 123.803 0.841 . . . . 0.0 109.823 173.008 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.2 p -60.17 -17.75 43.06 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 175.095 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.9 ttt-85 -71.72 -3.94 24.7 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 171.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -146.18 11.44 1.18 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 127.279 2.232 . . . . 0.0 112.92 179.021 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -165.46 160.11 17.58 Favored 'General case' 0 C--O 1.217 -0.643 0 O-C-N 121.007 -1.058 . . . . 0.0 111.316 -178.586 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -177.12 -38.13 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.207 1.403 . . . . 0.0 109.238 -174.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.414 0 O-C-N 119.079 -2.263 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_