data_2spz_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 2spz _Structure_validation_residue.Date_analyzed 2016-10-08 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 ' 8' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.452 -0.329 0 CA-C-O 121.958 0.885 . . . . 0.0 110.962 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . 0.266 7.6 tt0 -45.95 -55.56 6.63 Favored 'General case' 0 N--CA 1.425 -1.702 0 C-N-CA 127.609 2.364 . . . . 0.0 110.925 177.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -70.04 -45.3 67.44 Favored 'General case' 0 CA--C 1.512 -0.486 0 O-C-N 118.743 -2.473 . . . . 0.0 112.894 177.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -50.57 -49.05 57.24 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 123.788 1.756 . . . . 0.0 111.39 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.17 -43.53 98.74 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 111.166 -2.743 . . . . 0.0 110.801 177.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -54.79 -51.37 65.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 123.36 1.552 . . . . 0.0 111.556 177.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -58.59 -55.84 29.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 113.16 -1.836 . . . . 0.0 111.033 177.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -53.52 -37.87 63.2 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 123.64 1.686 . . . . 0.0 110.1 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.457 ' O ' ' NH1' ' A' ' 27' ' ' ARG . 1.6 mt -61.24 -60.69 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 177.161 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 96.2 mt -53.12 -35.81 60.08 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 121.294 1.861 . . . . 0.0 113.318 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -61.8 -19.64 62.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 112.9 -1.954 . . . . 0.0 114.072 177.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.5 mt -59.45 115.28 11.83 Favored Pre-proline 0 CA--C 1.537 0.445 0 O-C-N 120.661 -1.274 . . . . 0.0 111.196 177.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -80.57 -13.79 11.86 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 123.61 2.873 . . . . 0.0 115.592 -177.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.512 ' ND2' ' HB2' ' A' ' 56' ' ' ALA . 1.5 p-10 -139.38 40.35 2.07 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 125.612 2.625 . . . . 0.0 113.536 -178.569 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.8 tt -149.7 121.84 8.32 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 103.849 -2.649 . . . . 0.0 103.849 177.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -153.35 -19.32 0.15 Allowed 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 -177.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.669 ' H ' ' CD ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -73.36 -133.04 0.01 OUTLIER 'General case' 0 N--CA 1.424 -1.774 0 CA-C-O 126.052 2.834 . . . . 0.0 113.128 -177.54 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.464 ' HA ' HD21 ' A' ' 28' ' ' ASN . 0.3 OUTLIER -61.34 -30.8 70.74 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 109.028 -3.715 . . . . 0.0 114.637 -177.017 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.467 ' NE2' HE22 ' A' ' 55' ' ' GLN . 19.0 mt-30 -69.68 -50.71 41.25 Favored 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 177.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.457 ' NH1' ' O ' ' A' ' 16' ' ' ILE . 2.1 tpp180 -50.77 -48.43 59.29 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 122.277 1.037 . . . . 0.0 110.898 177.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.464 HD21 ' HA ' ' A' ' 25' ' ' GLU . 68.9 m-80 -57.19 -54.0 51.72 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 114.005 -1.452 . . . . 0.0 111.672 177.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.41 -47.42 75.94 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-O 121.654 0.74 . . . . 0.0 110.595 -178.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -61.9 -47.89 82.94 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 118.139 -0.934 . . . . 0.0 110.566 177.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 84.2 mt -54.44 -46.05 70.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-N 121.877 2.126 . . . . 0.0 110.247 177.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.31 5.7 tp60 -56.61 -50.64 71.39 Favored 'General case' 0 N--CA 1.44 -0.952 0 C-N-CA 124.798 1.239 . . . . 0.0 112.146 178.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 20.2 t -63.09 -42.01 99.51 Favored 'General case' 0 C--O 1.217 -0.611 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -58.56 -38.43 77.85 Favored 'General case' 0 CA--C 1.529 0.172 0 O-C-N 120.106 -1.621 . . . . 0.0 111.92 177.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.581 ' HZ2' ' CG ' ' A' ' 36' ' ' ASP . 1.9 ttpm? -68.15 -43.88 77.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 113.624 -1.626 . . . . 0.0 113.574 177.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.581 ' CG ' ' HZ2' ' A' ' 35' ' ' LYS . 89.4 m-20 -88.53 -42.44 12.08 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 116.823 2.157 . . . . 0.0 116.823 177.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -96.11 133.49 25.08 Favored Pre-proline 0 CA--C 1.543 0.691 0 N-CA-C 118.717 2.858 . . . . 0.0 118.717 -177.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -71.14 -83.48 0.01 OUTLIER 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 124.287 3.324 . . . . 0.0 116.08 177.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.3 m -100.74 -11.24 20.08 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 118.407 2.744 . . . . 0.0 118.407 -177.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -69.46 -36.21 76.36 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 125.477 3.762 . . . . 0.0 111.529 -177.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.447 ' HA ' ' CG ' ' A' ' 44' ' ' LEU . 60.3 m -49.84 -27.1 4.64 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 112.244 -2.253 . . . . 0.0 113.969 -179.183 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.4 ' O ' ' HB3' ' A' ' 45' ' ' LEU . . . -60.98 -36.86 80.56 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 121.748 2.067 . . . . 0.0 112.364 177.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -65.9 -41.88 90.92 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 125.28 2.467 . . . . 0.0 106.739 177.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.447 ' CG ' ' HA ' ' A' ' 41' ' ' SER . 0.7 OUTLIER -66.21 -21.79 66.32 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 112.455 -2.157 . . . . 0.0 112.972 177.122 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.4 ' HB3' ' O ' ' A' ' 42' ' ' ALA . 14.8 tp -70.93 -49.25 47.71 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 104.597 -2.371 . . . . 0.0 104.597 177.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.79 -37.81 69.08 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 113.262 -1.79 . . . . 0.0 106.679 176.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -64.11 -49.96 70.15 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 118.416 -1.314 . . . . 0.0 112.447 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -52.68 -44.94 66.57 Favored 'General case' 0 C--O 1.236 0.378 0 O-C-N 120.293 -1.505 . . . . 0.0 111.454 177.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 25.6 tptp -61.11 -44.82 96.76 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 121.432 -0.793 . . . . 0.0 111.641 177.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 21.6 mmmt -66.56 -28.62 68.67 Favored 'General case' 0 CA--C 1.511 -0.553 0 O-C-N 121.072 -1.017 . . . . 0.0 110.609 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 37.1 mt -66.58 -46.81 74.75 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 122.539 1.161 . . . . 0.0 108.454 176.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.485 ' ND2' HD22 ' A' ' 21' ' ' ASN . 0.7 OUTLIER -49.3 -51.31 34.81 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 124.633 2.158 . . . . 0.0 108.067 177.427 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -60.63 -40.04 90.48 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 112.076 -2.329 . . . . 0.0 111.778 177.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.45 -44.35 89.18 Favored 'General case' 0 CA--C 1.517 -0.307 0 O-C-N 120.182 -1.574 . . . . 0.0 111.724 177.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.467 HE22 ' NE2' ' A' ' 26' ' ' GLN . 1.8 pm0 -74.48 -50.67 17.34 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 116.977 -1.889 . . . . 0.0 110.923 177.203 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.512 ' HB2' ' ND2' ' A' ' 21' ' ' ASN . . . . . . . . 0 CA--C 1.553 1.062 0 N-CA-C 114.514 1.302 . . . . 0.0 114.514 177.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.424 ' CD ' ' H ' ' A' ' 8' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.461 0.096 0 CA-C-O 123.458 1.599 . . . . 0.0 108.559 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.414 ' CD ' ' HA ' ' A' ' 38' ' ' PRO 0.274 8.2 tt0 -43.38 -45.41 6.12 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 127.655 2.382 . . . . 0.0 110.778 177.372 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -73.21 -44.63 59.36 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 112.877 -1.965 . . . . 0.0 113.473 178.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 18.8 t30 -54.71 -47.19 74.04 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-O 123.857 1.789 . . . . 0.0 108.931 177.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.412 ' CB ' HD21 ' A' ' 45' ' ' LEU . . . -57.9 -48.05 81.01 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 111.678 -2.51 . . . . 0.0 111.307 177.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -55.29 -41.62 72.53 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 124.253 1.978 . . . . 0.0 111.949 177.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -62.71 -52.35 63.59 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 112.955 -1.929 . . . . 0.0 110.426 177.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -53.06 -42.88 66.23 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 122.178 0.989 . . . . 0.0 109.648 177.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.413 ' O ' ' HD2' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -54.29 -59.47 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.159 0 CA-C-N 114.563 -1.199 . . . . 0.0 109.636 177.496 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 35.0 mt -49.69 -49.4 47.74 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.902 0.858 . . . . 0.0 111.377 177.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -61.5 -10.84 8.66 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 113.608 -1.633 . . . . 0.0 115.347 178.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 75.7 mt -58.56 104.72 0.45 Allowed Pre-proline 0 CA--C 1.541 0.617 0 CA-C-N 122.307 2.322 . . . . 0.0 111.26 177.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -82.08 -4.17 11.82 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 124.191 3.261 . . . . 0.0 116.657 -177.025 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -140.64 44.15 1.84 Allowed 'General case' 0 N--CA 1.456 -0.157 0 CA-C-O 123.309 1.528 . . . . 0.0 112.485 177.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.7 tt -126.94 137.93 53.2 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 113.333 -1.758 . . . . 0.0 106.679 177.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -67.82 131.49 45.64 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 124.141 1.924 . . . . 0.0 113.698 -177.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -40.59 -45.48 2.32 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 112.983 -1.917 . . . . 0.0 114.778 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.473 ' CD ' ' H ' ' A' ' 25' ' ' GLU . 16.1 mp0 -55.79 -55.25 34.61 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 123.247 1.498 . . . . 0.0 111.2 177.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.401 ' NE2' ' HB3' ' A' ' 51' ' ' LEU . 35.0 tt0 -59.06 -38.97 80.68 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.305 177.18 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.413 ' HD2' ' O ' ' A' ' 16' ' ' ILE . 0.0 OUTLIER -56.62 -50.73 71.16 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 120.731 -1.231 . . . . 0.0 108.123 176.963 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 46.9 m-80 -57.99 -46.14 85.68 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 177.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.16 -47.51 78.11 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 122.117 0.961 . . . . 0.0 109.414 177.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -62.44 -50.67 70.54 Favored 'General case' 0 C--O 1.217 -0.61 0 O-C-N 121.447 -0.783 . . . . 0.0 110.111 177.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.7 mt -45.6 -49.82 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-O 123.359 1.552 . . . . 0.0 112.387 177.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.406 ' O ' ' HB3' ' A' ' 35' ' ' LYS 0.405 4.8 tp-100 -60.0 -56.23 24.26 Favored 'General case' 0 N--CA 1.424 -1.726 0 CA-C-N 113.522 -1.672 . . . . 0.0 109.169 179.265 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.9 t -61.62 -33.83 74.61 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 120.443 -1.41 . . . . 0.0 114.064 177.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 31.7 mt -65.95 -36.18 82.64 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 125.397 1.479 . . . . 0.0 109.668 177.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.472 ' HZ2' ' CG ' ' A' ' 36' ' ' ASP . 1.3 ttpm? -66.59 -41.08 89.04 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 114.48 -1.236 . . . . 0.0 109.779 176.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.472 ' CG ' ' HZ2' ' A' ' 35' ' ' LYS . 73.7 m-20 -71.83 -66.68 0.61 Allowed 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 115.802 1.779 . . . . 0.0 115.802 177.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -102.83 126.76 31.73 Favored Pre-proline 0 C--O 1.239 0.535 0 CA-C-N 120.656 1.571 . . . . 0.0 114.215 -177.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.414 ' HA ' ' CD ' ' A' ' 9' ' ' GLN . 39.8 Cg_endo -77.82 -50.09 0.09 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 123.091 2.528 . . . . 0.0 114.713 177.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 95.8 p -60.5 -43.51 96.95 Favored 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 -177.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.436 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 58.0 mt-30 -74.51 -21.23 59.65 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 117.766 -1.111 . . . . 0.0 112.929 -178.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.412 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 94.2 p -48.35 -37.73 17.43 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 121.238 1.836 . . . . 0.0 114.515 -177.318 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.33 -42.19 77.3 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 123.655 1.693 . . . . 0.0 109.739 177.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -70.75 -52.6 19.76 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 105.993 -1.854 . . . . 0.0 105.993 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 40' ' ' GLN . 1.1 mt -50.31 -30.46 12.07 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 115.636 1.717 . . . . 0.0 115.636 177.29 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.412 HD21 ' CB ' ' A' ' 12' ' ' ALA . 26.3 tp -75.75 -52.95 9.3 Favored 'General case' 0 CA--C 1.504 -0.795 0 N-CA-C 107.308 -1.368 . . . . 0.0 107.308 -177.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.51 -41.08 63.11 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 113.073 -1.876 . . . . 0.0 107.811 177.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -65.98 -51.85 54.75 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 119.174 -1.01 . . . . 0.0 112.397 -177.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.13 -38.77 73.97 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 120.503 -1.373 . . . . 0.0 112.208 177.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 9.1 tmtm? -65.4 -45.11 85.29 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.752 0.787 . . . . 0.0 109.552 177.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 46.8 mtpt -60.59 -41.22 94.24 Favored 'General case' 0 C--O 1.233 0.218 0 O-C-N 119.915 -1.741 . . . . 0.0 108.859 -178.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.517 ' C ' HE21 ' A' ' 55' ' ' GLN . 39.4 mt -65.64 -51.1 62.12 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 114.418 -1.265 . . . . 0.0 110.955 177.531 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -46.85 -49.68 19.75 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 123.856 1.789 . . . . 0.0 110.975 178.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -62.6 -46.89 86.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 111.684 -2.507 . . . . 0.0 111.263 177.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.3 -39.93 73.52 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 119.299 -2.126 . . . . 0.0 110.809 176.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.517 HE21 ' C ' ' A' ' 51' ' ' LEU . 39.8 mt-30 -75.41 -5.69 46.24 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.332 1.053 . . . . 0.0 112.902 177.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.308 0 O-C-N 120.092 -1.63 . . . . 0.0 113.555 -177.67 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.447 -0.602 0 CA-C-O 123.417 1.579 . . . . 0.0 108.649 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . 0.329 0.1 OUTLIER -44.63 -80.61 0.01 OUTLIER 'General case' 0 N--CA 1.426 -1.675 0 N-CA-C 117.197 2.295 . . . . 0.0 117.197 -176.989 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 -65.49 -25.61 67.55 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 111.448 -2.614 . . . . 0.0 112.297 -179.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.41 -49.78 62.33 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 120.531 1.514 . . . . 0.0 107.569 177.582 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.06 -45.51 86.95 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.061 177.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -53.2 -51.14 63.07 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 123.652 1.691 . . . . 0.0 111.266 177.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -54.45 -55.58 27.49 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 113.636 -1.62 . . . . 0.0 112.296 177.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -61.73 -33.36 73.91 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 121.708 0.766 . . . . 0.0 111.362 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 14.6 mt -60.48 -53.39 49.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 O-C-N 120.359 -1.463 . . . . 0.0 108.354 177.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 51.9 mt -51.22 -49.74 60.49 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 122.856 1.313 . . . . 0.0 110.297 177.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 26.8 t-80 -59.39 -16.53 23.67 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 112.661 -2.063 . . . . 0.0 116.208 179.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 71.7 mt -58.33 102.55 0.31 Allowed Pre-proline 0 CA--C 1.547 0.847 0 CA-C-N 122.926 2.603 . . . . 0.0 114.733 -177.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -80.52 -17.0 10.28 Favored 'Trans proline' 0 N--CA 1.463 -0.299 0 C-N-CA 123.47 2.78 . . . . 0.0 114.37 -177.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.722 HD21 ' HB3' ' A' ' 56' ' ' ALA . 1.5 p-10 -118.61 40.66 3.18 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 126.223 2.916 . . . . 0.0 111.204 177.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -141.19 141.55 34.07 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 109.725 -3.398 . . . . 0.0 106.68 177.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -87.55 158.68 18.85 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 122.36 1.076 . . . . 0.0 112.846 -177.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -50.25 -43.53 53.14 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.036 -0.984 . . . . 0.0 112.413 178.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -52.47 -54.93 25.83 Favored 'General case' 0 C--O 1.237 0.422 0 O-C-N 121.547 -0.72 . . . . 0.0 111.83 177.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.534 ' NE2' HE22 ' A' ' 55' ' ' GLN . 32.7 mt-30 -60.56 -43.91 96.73 Favored 'General case' 0 C--N 1.343 0.31 0 O-C-N 120.409 -1.432 . . . . 0.0 110.49 177.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 20.3 ttm-85 -50.83 -54.55 22.81 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 122.336 1.065 . . . . 0.0 110.931 178.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 62.1 m-80 -60.25 -44.12 95.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.577 177.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.29 -47.76 77.99 Favored 'General case' 0 CA--C 1.528 0.099 0 O-C-N 120.715 -1.24 . . . . 0.0 110.807 177.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -63.22 -45.04 93.52 Favored 'General case' 0 C--N 1.331 -0.208 0 O-C-N 121.389 -0.82 . . . . 0.0 110.287 177.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 34.1 mt -53.55 -47.73 59.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-O 122.822 1.296 . . . . 0.0 110.409 176.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.323 1.5 tp60 -55.4 -49.63 71.84 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 125.127 1.371 . . . . 0.0 110.703 177.166 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 34.2 t -63.58 -32.93 74.55 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.128 177.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.77 -37.92 88.55 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.546 1.539 . . . . 0.0 109.99 177.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.597 ' HZ2' ' CG ' ' A' ' 36' ' ' ASP . 0.0 OUTLIER -67.21 -49.1 65.82 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 113.056 -1.884 . . . . 0.0 110.041 177.106 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.597 ' CG ' ' HZ2' ' A' ' 35' ' ' LYS . 71.3 m-20 -72.26 -48.13 44.93 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 116.407 2.002 . . . . 0.0 116.407 177.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -79.47 118.72 73.95 Favored Pre-proline 0 CA--C 1.535 0.381 0 N-CA-C 116.488 2.033 . . . . 0.0 116.488 -177.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -95.64 -14.55 0.56 Allowed 'Trans proline' 0 CA--C 1.532 0.419 0 C-N-CA 125.096 3.864 . . . . 0.0 113.262 177.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 60.6 p -100.77 -39.97 7.56 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 119.046 2.98 . . . . 0.0 119.046 -177.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.42 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 36.1 mt-30 -121.72 43.25 2.89 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 120.73 3.604 . . . . 0.0 120.73 -177.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.466 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 58.2 m -54.64 -36.41 64.52 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 125.609 3.822 . . . . 0.0 111.62 179.068 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.97 -37.36 66.41 Favored 'General case' 0 C--O 1.223 -0.311 0 O-C-N 120.018 -1.676 . . . . 0.0 109.589 176.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -62.98 -50.12 72.02 Favored 'General case' 0 C--O 1.223 -0.314 0 O-C-N 120.227 -1.545 . . . . 0.0 107.245 177.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.466 ' HG ' ' HA ' ' A' ' 41' ' ' SER . 1.1 mt -54.83 -34.62 63.04 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 115.442 1.645 . . . . 0.0 115.442 177.285 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 29.0 tp -76.61 -50.18 14.46 Favored 'General case' 0 CA--C 1.509 -0.61 0 C-N-CA 124.887 1.275 . . . . 0.0 108.987 -177.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.72 -34.51 71.42 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 113.771 -1.559 . . . . 0.0 107.302 177.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.405 ' CD ' ' HZ3' ' A' ' 50' ' ' LYS . 35.4 mm-40 -64.79 -58.23 6.8 Favored 'General case' 0 CA--C 1.522 -0.13 0 CA-C-O 122.056 0.932 . . . . 0.0 113.057 178.365 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -53.52 -39.86 65.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.85 0.833 . . . . 0.0 112.756 177.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -67.81 -41.19 83.5 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.197 177.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.405 ' HZ3' ' CD ' ' A' ' 47' ' ' GLU . 8.3 mtpm? -60.65 -40.93 93.84 Favored 'General case' 0 CA--C 1.511 -0.525 0 O-C-N 120.725 -1.234 . . . . 0.0 109.448 178.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 19.9 mt -64.29 -53.41 49.38 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.024 -1.444 . . . . 0.0 109.247 177.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.41 ' HA ' ' NE2' ' A' ' 55' ' ' GLN . 2.4 t30 -49.06 -46.61 44.73 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 123.003 1.383 . . . . 0.0 112.13 -178.061 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -69.26 -50.22 48.96 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 113.533 -1.667 . . . . 0.0 111.478 177.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.68 -42.52 79.19 Favored 'General case' 0 N--CA 1.458 -0.058 0 O-C-N 120.402 -1.436 . . . . 0.0 113.424 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.534 HE22 ' NE2' ' A' ' 26' ' ' GLN . 1.2 pt20 -78.24 -0.58 29.14 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 121.217 -0.927 . . . . 0.0 112.944 179.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.722 ' HB3' HD21 ' A' ' 21' ' ' ASN . . . . . . . . 0 CA--C 1.541 0.608 0 CA-C-O 116.125 -1.893 . . . . 0.0 115.291 -177.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.303 0 CA-C-O 122.293 1.044 . . . . 0.0 112.592 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.403 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 1.5 tm0? -37.41 -55.47 1.05 Allowed 'General case' 0 N--CA 1.422 -1.873 0 C-N-CA 129.061 2.944 . . . . 0.0 114.952 177.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -72.13 -36.23 69.33 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 118.733 -1.187 . . . . 0.0 112.619 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -58.89 -49.05 79.24 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 121.194 1.815 . . . . 0.0 107.75 177.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.41 ' HA ' HD21 ' A' ' 45' ' ' LEU . . . -56.12 -44.37 79.06 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 113.203 -1.817 . . . . 0.0 110.376 177.228 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -52.57 -55.63 20.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 123.523 1.63 . . . . 0.0 111.3 177.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -56.98 -44.47 82.72 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.568 -1.196 . . . . 0.0 111.618 177.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -46.12 89.11 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 123.017 1.389 . . . . 0.0 108.947 177.358 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.2 mt -56.1 -46.81 81.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 O-C-N 119.845 -1.784 . . . . 0.0 109.585 -178.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 72.0 mt -65.23 -38.08 89.28 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.95 0.881 . . . . 0.0 111.189 177.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -59.61 -38.9 82.55 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.555 1.142 . . . . 0.0 113.175 177.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 87.2 mt -54.25 104.85 0.46 Allowed Pre-proline 0 CA--C 1.539 0.534 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 -178.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . 0.507 ' C ' ' H ' ' A' ' 22' ' ' LEU . 33.4 Cg_endo -81.21 -50.72 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 123.525 2.816 . . . . 0.0 114.945 -177.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.573 HD22 ' CG ' ' A' ' 52' ' ' ASN . 2.5 p-10 -83.85 30.7 0.5 Allowed 'General case' 0 C--O 1.236 0.352 0 CA-C-O 125.579 2.609 . . . . 0.0 111.611 -177.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.507 ' H ' ' C ' ' A' ' 20' ' ' PRO . 6.8 tp -109.3 139.67 43.95 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 111.013 -2.812 . . . . 0.0 109.487 177.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 -70.52 129.94 40.54 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 123.245 1.497 . . . . 0.0 110.145 177.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.5 mp0 -55.56 -27.26 47.99 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 120.427 -1.421 . . . . 0.0 112.117 177.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.49 ' HA ' ' ND2' ' A' ' 28' ' ' ASN . 1.8 tm-20 -60.47 -68.19 0.32 Allowed 'General case' 0 C--O 1.236 0.371 0 O-C-N 121.253 -0.904 . . . . 0.0 108.952 177.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.48 ' NE2' HE22 ' A' ' 55' ' ' GLN . 10.6 pt20 -50.8 -46.3 59.68 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 120.722 -1.236 . . . . 0.0 110.224 177.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 18.6 ttm105 -48.82 -51.37 29.83 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.134 -1.604 . . . . 0.0 112.356 177.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.49 ' ND2' ' HA ' ' A' ' 25' ' ' GLU . 12.7 p30 -61.33 -46.17 91.36 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 115.395 -0.821 . . . . 0.0 112.565 177.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.82 -44.51 66.73 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 122.32 1.057 . . . . 0.0 110.587 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . 0.444 ' CE2' ' HA ' ' A' ' 48' ' ' ALA . 47.1 m-85 -62.47 -52.31 64.0 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 176.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 14.7 mt -50.17 -48.86 23.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 CA-C-O 122.338 1.066 . . . . 0.0 112.603 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.29 0.0 OUTLIER -60.51 -53.77 53.51 Favored 'General case' 0 N--CA 1.432 -1.367 0 C-N-CA 127.591 2.356 . . . . 0.0 111.639 -178.386 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 23.0 t -63.66 -41.99 98.15 Favored 'General case' 0 C--N 1.332 -0.187 0 O-C-N 120.694 -1.254 . . . . 0.0 110.941 177.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 21.1 tp -58.49 -41.33 85.09 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 121.029 -1.045 . . . . 0.0 112.557 177.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.561 ' HZ1' ' CG ' ' A' ' 36' ' ' ASP . 0.0 OUTLIER -69.78 -42.6 73.59 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.912 0.863 . . . . 0.0 111.15 177.26 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.561 ' CG ' ' HZ1' ' A' ' 35' ' ' LYS . 1.6 m-20 -73.51 -53.55 10.33 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 117.971 2.582 . . . . 0.0 117.971 -179.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -143.7 -58.73 0.02 OUTLIER Pre-proline 0 C--O 1.237 0.41 0 N-CA-C 118.343 2.72 . . . . 0.0 118.343 -176.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 0.5 OUTLIER -43.65 127.69 6.24 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 124.36 3.373 . . . . 0.0 115.484 177.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.5 t -100.73 -28.67 12.7 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 111.268 -2.696 . . . . 0.0 112.058 -177.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -79.28 63.54 3.94 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 124.907 2.289 . . . . 0.0 110.386 177.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.403 ' CB ' ' HA ' ' A' ' 9' ' ' GLN . 66.8 p -55.21 -38.35 68.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 112.978 -1.919 . . . . 0.0 112.9 -178.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.89 -39.36 65.7 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.712 -0.617 . . . . 0.0 110.009 177.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -71.06 -55.5 8.11 Favored 'General case' 0 N--CA 1.454 -0.258 0 O-C-N 121.187 -0.946 . . . . 0.0 108.77 177.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.7 tp -57.25 -23.55 48.9 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-O 125.454 2.55 . . . . 0.0 111.751 -177.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.41 HD21 ' HA ' ' A' ' 12' ' ' ALA . 35.8 tp -77.42 -53.18 7.96 Favored 'General case' 0 CA--C 1.503 -0.865 0 CA-C-N 112.585 -2.098 . . . . 0.0 106.83 -177.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.44 -33.9 46.23 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 177.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -64.01 -59.26 4.71 Favored 'General case' 0 C--N 1.345 0.412 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.89 177.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.444 ' HA ' ' CE2' ' A' ' 30' ' ' PHE . . . -50.88 -43.09 59.51 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 122.944 1.354 . . . . 0.0 112.475 177.461 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.73 -40.29 96.74 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 121.39 -0.819 . . . . 0.0 110.096 177.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.87 -41.65 92.0 Favored 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 52.8 mt -63.36 -50.37 70.22 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 119.32 -0.952 . . . . 0.0 109.465 177.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.573 ' CG ' HD22 ' A' ' 21' ' ' ASN . 3.2 t-20 -49.9 -41.73 46.48 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 119.908 -1.745 . . . . 0.0 110.706 177.2 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -60.52 -50.29 74.13 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 114.222 -1.353 . . . . 0.0 112.093 177.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.97 -43.13 77.28 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 122.105 0.955 . . . . 0.0 111.723 177.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.48 HE22 ' NE2' ' A' ' 26' ' ' GLN . 0.0 OUTLIER -69.96 -54.29 13.96 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 115.423 1.638 . . . . 0.0 115.423 177.356 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.572 0 N-CA-C 117.247 2.314 . . . . 0.0 117.247 -177.959 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.432 ' HG2' ' H ' ' A' ' 9' ' ' GLN . 1.7 pm0 . . . . . 0 C--O 1.236 0.385 0 CA-C-O 124.521 2.105 . . . . 0.0 112.182 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.432 ' H ' ' HG2' ' A' ' 8' ' ' GLU 0.309 10.4 tt0 -53.53 -45.33 69.76 Favored 'General case' 0 N--CA 1.428 -1.527 0 C-N-CA 127.358 2.263 . . . . 0.0 110.051 177.798 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 33.5 mm-40 -70.04 -49.89 46.75 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.097 -0.956 . . . . 0.0 112.528 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -51.71 -45.8 63.68 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.029 1.286 . . . . 0.0 109.526 178.091 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.26 -42.44 99.34 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 114.582 -1.19 . . . . 0.0 112.242 177.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -57.76 -51.68 68.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 122.825 1.298 . . . . 0.0 112.826 177.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -57.14 -52.06 66.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.173 -0.921 . . . . 0.0 112.566 177.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -59.31 -38.07 79.32 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.164 -0.96 . . . . 0.0 109.651 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -56.01 -51.83 56.91 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 O-C-N 121.078 -1.014 . . . . 0.0 108.831 177.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 81.3 mt -52.65 -45.18 66.59 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 122.664 1.221 . . . . 0.0 109.632 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -66.41 -12.64 58.12 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 117.152 2.279 . . . . 0.0 117.152 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.452 ' CD1' HD11 ' A' ' 22' ' ' LEU . 57.3 mt -60.99 104.11 0.43 Allowed Pre-proline 0 CA--C 1.551 0.994 0 CA-C-N 123.778 2.99 . . . . 0.0 117.104 -177.391 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -63.05 -60.21 0.19 Allowed 'Trans proline' 0 CA--C 1.534 0.479 0 C-N-CA 123.77 2.98 . . . . 0.0 119.752 -177.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.506 HD21 ' HB3' ' A' ' 56' ' ' ALA . 1.3 p-10 -88.51 27.47 1.27 Allowed 'General case' 0 CA--C 1.523 -0.08 0 O-C-N 118.434 -2.666 . . . . 0.0 113.121 -177.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.452 HD11 ' CD1' ' A' ' 19' ' ' LEU . 6.8 tt -102.51 137.47 40.7 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 113.44 -1.709 . . . . 0.0 114.128 177.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 12.7 p30 -87.1 151.02 23.58 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 122.515 1.15 . . . . 0.0 112.832 177.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -62.82 -29.23 70.57 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 115.77 1.767 . . . . 0.0 115.77 -177.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -58.86 -51.21 71.01 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 124.186 1.946 . . . . 0.0 109.49 177.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.423 HE22 ' CD1' ' A' ' 22' ' ' LEU . 0.8 OUTLIER -62.64 -47.99 81.32 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 113.398 -1.728 . . . . 0.0 108.467 177.47 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 12.2 tpp180 -47.84 -52.44 19.01 Favored 'General case' 0 C--O 1.22 -0.486 0 O-C-N 121.196 -0.94 . . . . 0.0 111.112 177.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 37.8 t-20 -57.78 -52.05 67.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 113.462 -1.699 . . . . 0.0 111.879 177.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -51.41 -48.27 62.7 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 123.354 1.549 . . . . 0.0 110.425 177.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -64.96 -47.27 78.21 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.999 177.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 28.6 mt -51.01 -39.08 18.88 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-N 120.913 1.688 . . . . 0.0 110.369 176.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.306 5.0 tp60 -67.02 -54.21 23.91 Favored 'General case' 0 N--CA 1.435 -1.177 0 O-C-N 120.668 -1.27 . . . . 0.0 111.546 177.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.2 t -59.63 -35.15 73.82 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 119.986 -1.696 . . . . 0.0 111.67 177.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -60.12 -46.73 88.63 Favored 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 125.605 1.562 . . . . 0.0 107.914 176.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.583 ' HZ2' ' CG ' ' A' ' 36' ' ' ASP . 0.1 OUTLIER -60.81 -39.86 90.56 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 120.986 -1.071 . . . . 0.0 109.748 176.991 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.583 ' CG ' ' HZ2' ' A' ' 35' ' ' LYS . 55.3 m-20 -72.76 -51.3 19.69 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 115.856 1.799 . . . . 0.0 115.856 177.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -105.66 125.68 32.69 Favored Pre-proline 0 CA--C 1.539 0.523 0 O-C-N 117.972 -2.955 . . . . 0.0 114.883 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -76.28 -72.93 0.01 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.754 2.303 . . . . 0.0 114.421 177.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.428 ' HA ' ' HG3' ' A' ' 8' ' ' GLU . 72.0 m -62.63 -29.47 70.64 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 118.451 -2.655 . . . . 0.0 114.897 -177.391 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.421 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 2.6 mp0 -70.14 -11.27 60.77 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 120.646 -1.284 . . . . 0.0 112.137 177.704 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 25.7 t -43.59 -39.6 3.59 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.945 1.298 . . . . 0.0 113.149 177.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.71 -38.22 72.02 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 120.842 -1.162 . . . . 0.0 111.926 177.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -71.62 -48.67 46.44 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 40' ' ' GLN . 0.7 OUTLIER -54.98 -30.58 59.53 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 123.966 1.841 . . . . 0.0 114.975 177.419 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 13.0 tp -77.24 -54.22 6.76 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-N 113.724 -1.58 . . . . 0.0 108.244 -177.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.88 -35.25 66.3 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 113.684 -1.598 . . . . 0.0 109.027 177.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -67.12 -59.91 3.06 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 114.833 -1.076 . . . . 0.0 112.453 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -51.05 -41.58 59.96 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 121.222 -0.924 . . . . 0.0 112.343 177.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.51 -40.65 96.04 Favored 'General case' 0 C--O 1.241 0.636 0 CA-C-O 122.017 0.913 . . . . 0.0 112.323 177.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.04 -38.44 90.86 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-O 122.595 1.188 . . . . 0.0 108.364 177.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.433 ' C ' HE21 ' A' ' 55' ' ' GLN . 40.9 mt -65.94 -40.84 91.72 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 121.291 -0.88 . . . . 0.0 109.223 177.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -50.34 -52.19 39.12 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 122.468 1.127 . . . . 0.0 108.162 177.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -55.21 -58.68 6.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 112.504 -2.134 . . . . 0.0 110.622 178.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -54.98 -31.23 60.7 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 114.914 1.449 . . . . 0.0 114.914 -177.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.444 HE22 ' HG ' ' A' ' 22' ' ' LEU . 41.8 mt-30 -69.2 -20.56 63.98 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 115.119 1.526 . . . . 0.0 115.119 178.159 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.506 ' HB3' HD21 ' A' ' 21' ' ' ASN . . . . . . . . 0 C--N 1.326 -0.444 0 N-CA-C 114.546 1.313 . . . . 0.0 114.546 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.473 0.682 0 CA-C-O 124.176 1.941 . . . . 0.0 112.155 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . 0.333 12.5 tt0 -38.67 -49.26 1.55 Allowed 'General case' 0 N--CA 1.432 -1.361 1 C-N-CA 133.004 4.522 . . . . 0.0 109.212 176.797 . . . . . . . . 3 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -73.53 -46.8 45.53 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 120.833 -1.167 . . . . 0.0 111.989 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -52.1 -47.54 65.19 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 120.064 -1.647 . . . . 0.0 109.691 177.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.406 ' CB ' ' OG ' ' A' ' 41' ' ' SER . . . -59.29 -44.01 92.53 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 113.369 -1.742 . . . . 0.0 111.104 177.22 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -56.68 -53.53 56.63 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 122.95 1.357 . . . . 0.0 112.023 177.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -55.4 -47.9 75.18 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.767 177.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -63.31 -36.69 84.51 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 120.757 -1.214 . . . . 0.0 111.415 177.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -56.8 -44.57 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 125.454 1.502 . . . . 0.0 108.575 177.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 70.6 mt -64.71 -47.66 77.52 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 122.762 1.268 . . . . 0.0 109.591 176.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -58.82 -32.01 69.0 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 116.797 2.147 . . . . 0.0 116.797 -177.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 84.4 mt -53.1 96.35 0.1 OUTLIER Pre-proline 0 CA--C 1.548 0.868 0 N-CA-C 115.891 1.812 . . . . 0.0 115.891 -177.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 0.3 OUTLIER -80.29 3.02 8.01 Favored 'Trans proline' 0 N--CA 1.462 -0.377 0 C-N-CA 123.922 3.081 . . . . 0.0 113.575 -177.523 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.642 HD22 ' HB3' ' A' ' 56' ' ' ALA . 14.3 t30 -132.59 26.66 4.39 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 124.268 1.985 . . . . 0.0 113.377 -177.891 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.4 tt -121.33 146.58 46.7 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 113.39 -1.732 . . . . 0.0 107.805 177.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 23.1 p-10 -71.82 -155.57 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.746 0 O-C-N 119.403 -2.06 . . . . 0.0 115.536 179.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.538 ' H ' ' CD ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -90.58 -66.6 0.91 Allowed 'General case' 0 N--CA 1.443 -0.793 0 O-C-N 120.022 -1.674 . . . . 0.0 114.544 177.374 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -60.5 -37.28 80.6 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 114.501 1.297 . . . . 0.0 114.501 -177.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -64.66 -37.93 89.27 Favored 'General case' 0 C--N 1.347 0.484 0 CA-C-N 123.391 2.814 . . . . 0.0 108.13 177.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.5 ttm-85 -57.7 -49.69 75.67 Favored 'General case' 0 C--O 1.224 -0.268 0 O-C-N 121.703 -0.623 . . . . 0.0 109.907 177.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -54.8 -52.17 63.49 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 114.39 -1.277 . . . . 0.0 112.257 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.88 -50.65 68.19 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 122.652 1.215 . . . . 0.0 110.74 178.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 -61.09 -47.86 84.35 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-O 117.798 -1.096 . . . . 0.0 110.446 177.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 34.3 mt -49.07 -50.84 14.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-N 121.222 1.828 . . . . 0.0 110.558 176.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.08 -55.17 25.92 Favored 'General case' 0 N--CA 1.424 -1.763 0 CA-C-O 122.564 1.174 . . . . 0.0 109.919 177.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.9 t -58.56 -31.86 68.38 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 178.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.4 mt -69.01 -43.46 74.77 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 120.574 -1.328 . . . . 0.0 108.27 177.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.543 ' HZ2' ' CG ' ' A' ' 36' ' ' ASP . 0.9 OUTLIER -58.22 -37.71 75.38 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.256 177.783 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.543 ' CG ' ' HZ2' ' A' ' 35' ' ' LYS . 12.0 m-20 -84.3 0.15 50.19 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 120.074 -1.642 . . . . 0.0 114.313 176.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -78.9 115.59 53.43 Favored Pre-proline 0 CA--C 1.54 0.593 0 N-CA-C 120.041 3.349 . . . . 0.0 120.041 -177.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_exo -88.86 -21.31 1.34 Allowed 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 124.135 3.223 . . . . 0.0 111.618 177.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 80.1 p -100.24 -88.67 0.35 Allowed 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 115.468 1.655 . . . . 0.0 115.468 -176.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.429 ' O ' HD11 ' A' ' 44' ' ' LEU . 28.5 mm-40 -142.17 91.19 2.31 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 119.311 3.078 . . . . 0.0 119.311 -176.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.406 ' OG ' ' CB ' ' A' ' 12' ' ' ALA . 13.6 t -50.52 -16.8 0.4 Allowed 'General case' 0 N--CA 1.468 0.443 0 O-C-N 120.396 -1.44 . . . . 0.0 109.025 176.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -50.24 -40.35 47.51 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 120.816 1.644 . . . . 0.0 111.581 177.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 17.1 m-80 -67.2 -47.09 71.91 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 123.077 1.418 . . . . 0.0 107.408 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.506 ' CD1' ' H ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -60.18 -25.21 65.39 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 116.373 1.99 . . . . 0.0 116.373 177.221 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.3 tp -80.57 -48.73 12.28 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 106.089 -1.819 . . . . 0.0 106.089 -179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.1 -37.87 75.37 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 177.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.44 ' CD ' ' HZ2' ' A' ' 50' ' ' LYS . 74.3 mm-40 -65.29 -52.51 53.67 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 119.326 -0.949 . . . . 0.0 112.076 179.042 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -55.43 -41.77 73.25 Favored 'General case' 0 C--N 1.334 -0.068 0 O-C-N 121.804 -0.56 . . . . 0.0 112.013 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -61.31 -45.97 92.25 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 121.0 0.428 . . . . 0.0 110.149 177.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.44 ' HZ2' ' CD ' ' A' ' 47' ' ' GLU . 50.5 mtpt -57.14 -40.67 77.62 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 123.154 1.454 . . . . 0.0 108.415 -179.108 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.448 ' C ' HE21 ' A' ' 55' ' ' GLN . 73.7 mt -67.3 -47.15 71.43 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 113.775 -1.557 . . . . 0.0 111.698 177.542 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -47.0 -50.7 18.76 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 119.84 -1.788 . . . . 0.0 109.419 177.294 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -58.86 -58.35 9.0 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 111.509 -2.587 . . . . 0.0 109.694 -179.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.34 -26.67 53.39 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.448 HE21 ' C ' ' A' ' 51' ' ' LEU . 41.4 mt-30 -69.05 -24.45 64.17 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.642 ' HB3' HD22 ' A' ' 21' ' ' ASN . . . . . . . . 0 C--N 1.327 -0.39 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -178.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.225 -0.22 0 CA-C-O 120.939 0.4 . . . . 0.0 110.202 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.4 ' O ' HD12 ' A' ' 34' ' ' LEU . 8.4 tt0 -39.88 -49.6 2.42 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 126.904 2.082 . . . . 0.0 110.753 177.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -69.2 -47.79 63.88 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 119.151 -2.218 . . . . 0.0 113.579 177.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -51.91 -44.42 63.82 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 123.854 1.788 . . . . 0.0 109.743 178.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.83 -49.6 76.84 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 112.222 -2.263 . . . . 0.0 111.738 177.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -55.21 -51.36 66.81 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 123.126 1.441 . . . . 0.0 111.804 177.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -57.24 -51.62 68.63 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 114.422 1.268 . . . . 0.0 114.422 177.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -61.51 -37.16 82.67 Favored 'General case' 0 N--CA 1.455 -0.209 0 O-C-N 121.166 -0.958 . . . . 0.0 110.694 178.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 13.1 mt -57.7 -52.97 50.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 O-C-N 121.135 -0.978 . . . . 0.0 108.995 177.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 90.4 mt -50.99 -49.48 60.24 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-O 122.527 1.156 . . . . 0.0 109.602 177.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 -63.87 -14.09 50.43 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 117.06 2.245 . . . . 0.0 117.06 177.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 93.3 mt -54.61 100.8 0.23 Allowed Pre-proline 0 CA--C 1.547 0.835 0 CA-C-N 123.959 3.072 . . . . 0.0 117.005 -177.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -56.76 -41.1 79.19 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 125.038 3.825 . . . . 0.0 116.108 -177.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 66.0 m-80 -104.98 23.63 13.27 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 122.955 1.36 . . . . 0.0 113.666 -177.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.6 tt -115.59 129.3 56.47 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-O 123.125 1.44 . . . . 0.0 110.527 179.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -78.69 145.42 34.56 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 112.888 -1.96 . . . . 0.0 112.695 178.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -48.9 -33.7 11.26 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.125 -1.398 . . . . 0.0 114.649 -177.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -60.56 -49.52 77.21 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 119.606 -1.934 . . . . 0.0 109.966 177.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -63.16 -43.83 97.17 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 177.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 12.7 tpp180 -47.93 -53.23 16.59 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.06 177.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -60.22 -48.32 82.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.938 -1.028 . . . . 0.0 112.15 177.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.89 -50.88 62.99 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 124.342 2.02 . . . . 0.0 111.389 177.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -60.49 -47.72 84.89 Favored 'General case' 0 C--O 1.215 -0.725 0 CA-C-N 112.471 -2.15 . . . . 0.0 109.308 177.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 41.6 mt -56.05 -40.44 63.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 121.679 2.036 . . . . 0.0 111.667 177.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.31 1.7 tp60 -59.13 -55.89 29.25 Favored 'General case' 0 C--O 1.247 0.942 0 O-C-N 119.904 -1.747 . . . . 0.0 111.346 177.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.3 t -66.77 -29.59 69.59 Favored 'General case' 0 C--O 1.215 -0.751 0 C-N-CA 118.912 -1.115 . . . . 0.0 108.98 177.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.448 HD23 HD21 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -57.64 -48.36 79.67 Favored 'General case' 0 N--CA 1.464 0.26 0 O-C-N 118.373 -2.704 . . . . 0.0 111.183 177.65 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HZ2' ' CG ' ' A' ' 36' ' ' ASP . 12.6 pttp -68.27 -45.41 73.2 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.405 177.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.445 ' CG ' ' HZ2' ' A' ' 35' ' ' LYS . 97.2 m-20 -74.79 -34.99 62.5 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 117.423 2.379 . . . . 0.0 117.423 -177.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.589 ' HB3' ' CG ' ' A' ' 40' ' ' GLN . 45.2 m-20 -104.72 106.7 55.88 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 126.408 1.883 . . . . 0.0 115.685 -177.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -69.02 -96.68 0.01 OUTLIER 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.196 2.598 . . . . 0.0 118.225 -177.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.7 m -59.89 -27.12 66.44 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 117.983 -2.948 . . . . 0.0 115.82 -177.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.589 ' CG ' ' HB3' ' A' ' 37' ' ' ASP . 12.1 pm0 -69.89 -12.25 61.48 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.574 -0.704 . . . . 0.0 111.998 177.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 79.8 p -56.6 -22.85 36.77 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 120.124 -1.61 . . . . 0.0 111.17 177.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.91 -41.43 82.65 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 120.112 -1.617 . . . . 0.0 110.145 177.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -68.23 -46.89 69.31 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.448 HD21 HD23 ' A' ' 34' ' ' LEU . 27.7 tp -56.9 -28.63 62.15 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.978 1.37 . . . . 0.0 112.881 177.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.5 tp -78.9 -51.48 9.62 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 -178.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.73 -34.55 62.64 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 114.344 -1.298 . . . . 0.0 107.966 177.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.41 ' CD ' ' HZ1' ' A' ' 50' ' ' LYS . 30.9 mm-40 -65.4 -60.73 2.66 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 115.183 -0.917 . . . . 0.0 112.825 177.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -51.46 -41.81 61.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 122.026 0.917 . . . . 0.0 112.627 178.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -62.87 -47.38 83.6 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.013 177.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.41 ' HZ1' ' CD ' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -63.7 -35.26 79.99 Favored 'General case' 0 C--N 1.342 0.255 0 O-C-N 120.73 -1.231 . . . . 0.0 109.133 -177.606 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.0 mt -65.63 -51.73 57.37 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 119.818 -0.753 . . . . 0.0 109.048 177.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -46.71 -48.62 20.22 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 123.609 1.671 . . . . 0.0 110.583 179.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -60.51 -46.61 89.51 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 112.571 -2.104 . . . . 0.0 110.87 177.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.14 -44.74 75.37 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 120.954 -1.091 . . . . 0.0 110.333 177.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.08 -23.05 63.0 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 115.769 1.766 . . . . 0.0 115.769 177.696 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.603 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 179.618 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.234 0.256 0 CA-C-O 123.288 1.518 . . . . 0.0 111.838 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -43.27 -49.16 6.76 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 113.143 -1.844 . . . . 0.0 112.736 177.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.1 mm-40 -66.88 -38.45 86.31 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 120.729 -0.388 . . . . 0.0 111.924 177.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -58.8 -47.45 84.73 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.152 -1.593 . . . . 0.0 109.045 177.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.5 -39.32 83.43 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 113.907 -1.497 . . . . 0.0 110.11 177.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -56.48 -53.52 56.56 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 123.284 1.516 . . . . 0.0 109.725 177.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 39.2 m-85 -56.24 -43.53 78.73 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.143 -1.389 . . . . 0.0 110.647 176.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -60.27 -40.09 89.14 Favored 'General case' 0 C--N 1.332 -0.16 0 O-C-N 121.118 -0.989 . . . . 0.0 111.805 177.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.1 mt -58.33 -51.92 65.47 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-O 122.374 1.083 . . . . 0.0 108.489 177.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.42 ' HA ' ' NH1' ' A' ' 27' ' ' ARG . 59.2 mt -59.87 -36.44 76.92 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 122.465 1.126 . . . . 0.0 112.645 177.423 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 22.6 t-160 -69.97 -11.66 61.04 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.624 1.57 . . . . 0.0 112.734 177.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 99.7 mt -62.36 124.85 84.2 Favored Pre-proline 0 CA--C 1.543 0.678 0 O-C-N 119.657 -1.902 . . . . 0.0 114.086 -178.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -70.02 -38.32 7.38 Favored 'Trans proline' 0 CA--C 1.531 0.375 0 C-N-CA 123.732 2.955 . . . . 0.0 117.611 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -103.45 -15.16 15.97 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 126.102 2.858 . . . . 0.0 115.551 -177.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 4.6 tt -90.92 123.37 34.38 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 110.103 -3.226 . . . . 0.0 107.019 177.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -151.5 -34.34 0.14 Allowed 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 118.088 2.625 . . . . 0.0 118.088 -176.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.651 ' H ' ' CD ' ' A' ' 24' ' ' GLU 0.254 0.0 OUTLIER -75.0 -132.66 0.01 OUTLIER 'General case' 0 N--CA 1.432 -1.342 0 CA-C-O 127.384 3.469 . . . . 0.0 116.162 -177.214 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.459 ' H ' ' CG ' ' A' ' 24' ' ' GLU . 13.1 mm-40 -68.0 -26.33 65.85 Favored 'General case' 0 C--N 1.315 -0.902 1 CA-C-N 107.879 -4.237 . . . . 0.0 112.728 -177.377 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.449 HE22 ' CD ' ' A' ' 55' ' ' GLN . 22.0 mt-30 -69.51 -50.15 47.86 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 104.803 -2.295 . . . . 0.0 104.803 177.672 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.42 ' NH1' ' HA ' ' A' ' 17' ' ' LEU . 3.0 tpp85 -48.24 -51.72 24.27 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 114.521 -1.218 . . . . 0.0 110.805 177.513 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -59.81 -51.43 69.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 113.618 -1.628 . . . . 0.0 112.788 177.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.44 -44.11 76.04 Favored 'General case' 0 CA--C 1.528 0.113 0 O-C-N 121.136 -0.978 . . . . 0.0 110.861 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -67.28 -48.88 66.36 Favored 'General case' 0 N--CA 1.452 -0.369 0 O-C-N 121.457 -0.777 . . . . 0.0 110.226 176.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 11.2 mt -52.07 -46.92 43.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 O-C-N 119.516 -1.99 . . . . 0.0 112.547 177.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.305 0.0 OUTLIER -63.98 -49.0 74.2 Favored 'General case' 0 N--CA 1.436 -1.133 0 C-N-CA 124.914 1.285 . . . . 0.0 110.196 177.796 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.6 t -58.28 -37.07 74.27 Favored 'General case' 0 C--O 1.217 -0.616 0 O-C-N 120.978 -1.076 . . . . 0.0 109.842 177.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.8 mp -65.74 -41.18 92.48 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 121.199 1.818 . . . . 0.0 107.92 176.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.77 -42.15 71.36 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 120.203 -1.561 . . . . 0.0 110.345 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -84.0 -27.77 28.17 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 116.998 2.222 . . . . 0.0 116.998 177.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -79.45 160.12 70.77 Favored Pre-proline 0 C--O 1.239 0.518 0 N-CA-C 116.992 2.219 . . . . 0.0 116.992 -178.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -102.38 -92.66 0.0 OUTLIER 'Trans proline' 0 CA--C 1.544 1.004 0 C-N-CA 123.199 2.599 . . . . 0.0 110.937 176.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.0 t -102.08 -11.11 19.11 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 119.499 -2.001 . . . . 0.0 115.337 177.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.2 mp0 -68.53 -8.93 45.74 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 118.12 -2.863 . . . . 0.0 114.946 -177.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.424 ' HA ' ' CG ' ' A' ' 44' ' ' LEU . 61.8 m -42.95 -35.02 1.08 Allowed 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 125.26 1.424 . . . . 0.0 112.384 177.05 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -51.57 -39.96 58.85 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 123.544 1.64 . . . . 0.0 112.962 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -72.13 -46.63 55.81 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 122.677 1.227 . . . . 0.0 107.76 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.424 ' CG ' ' HA ' ' A' ' 41' ' ' SER . 0.8 OUTLIER -56.73 -29.33 62.4 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 124.609 2.147 . . . . 0.0 113.588 177.234 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 52.2 tp -77.11 -51.11 11.58 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 112.766 -2.015 . . . . 0.0 106.474 -178.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.7 -33.19 60.57 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 122.672 1.225 . . . . 0.0 108.31 176.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -64.55 -61.6 2.11 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 114.783 -1.099 . . . . 0.0 111.935 177.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -51.58 -38.05 52.66 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.963 0.887 . . . . 0.0 112.014 177.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -65.25 -43.89 89.89 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 121.675 0.75 . . . . 0.0 110.054 177.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.77 -39.95 95.78 Favored 'General case' 0 C--O 1.233 0.216 0 O-C-N 120.452 -1.405 . . . . 0.0 108.606 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 64.3 mt -62.88 -54.94 30.98 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 121.74 0.781 . . . . 0.0 109.707 177.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -44.82 -44.86 9.78 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 124.029 1.871 . . . . 0.0 111.466 -178.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -67.08 -46.66 73.61 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 111.702 -2.499 . . . . 0.0 111.751 177.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.61 -46.45 77.36 Favored 'General case' 0 C--O 1.233 0.204 0 O-C-N 120.942 -1.099 . . . . 0.0 111.444 177.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.449 ' CD ' HE22 ' A' ' 26' ' ' GLN . 5.7 pm0 -84.98 14.13 5.26 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 177.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.359 0 O-C-N 119.83 -1.794 . . . . 0.0 111.234 177.534 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.456 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.514 HE21 ' CG ' ' A' ' 37' ' ' ASP 0.266 1.4 tm0? -39.42 -61.06 0.84 Allowed 'General case' 0 N--CA 1.432 -1.343 0 C-N-CA 127.261 2.224 . . . . 0.0 113.024 176.802 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -59.79 -37.15 78.32 Favored 'General case' 0 C--O 1.233 0.199 0 O-C-N 120.227 -1.545 . . . . 0.0 111.409 177.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.26 -46.62 88.03 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.97 0.89 . . . . 0.0 109.194 177.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.62 -37.03 85.78 Favored 'General case' 0 C--O 1.211 -0.932 0 C-N-CA 124.097 0.959 . . . . 0.0 109.142 177.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -54.23 -55.5 27.51 Favored 'General case' 0 C--O 1.237 0.416 0 O-C-N 119.708 -1.87 . . . . 0.0 108.723 177.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -58.21 -45.97 86.67 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 113.165 -1.834 . . . . 0.0 112.202 176.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.24 -43.42 74.55 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 123.039 1.4 . . . . 0.0 111.597 177.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -58.65 -52.91 54.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 C-N-CA 126.537 1.935 . . . . 0.0 109.94 178.063 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 49.5 mt -62.62 -36.17 81.91 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 122.098 0.952 . . . . 0.0 113.043 177.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 6.3 t-80 -62.6 -21.51 65.69 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 127.487 2.315 . . . . 0.0 116.14 177.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.442 HD11 ' HB2' ' A' ' 52' ' ' ASN . 21.6 mt -63.08 105.63 0.7 Allowed Pre-proline 0 C--N 1.328 -0.34 0 N-CA-C 118.315 2.709 . . . . 0.0 118.315 -176.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -72.81 -1.95 11.19 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 123.024 2.483 . . . . 0.0 112.64 178.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 36.2 p-10 -132.94 27.41 4.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 122.794 1.283 . . . . 0.0 114.3 178.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.43 HD23 HD13 ' A' ' 19' ' ' LEU . 7.2 tt -160.02 111.82 2.01 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 122.947 1.356 . . . . 0.0 109.203 177.267 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -154.82 2.94 0.21 Allowed 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 117.249 2.315 . . . . 0.0 117.249 -177.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.697 ' H ' ' CD ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -87.16 -132.88 0.07 Allowed 'General case' 0 N--CA 1.418 -2.05 0 CA-C-O 125.485 2.564 . . . . 0.0 112.796 -177.59 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.417 ' H ' ' CG ' ' A' ' 24' ' ' GLU . 0.4 OUTLIER -76.3 -22.07 55.47 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 109.49 -3.504 . . . . 0.0 114.086 -177.227 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.424 ' NE2' ' NE2' ' A' ' 55' ' ' GLN . 27.2 mt-30 -73.86 -48.99 27.19 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 105.251 -2.129 . . . . 0.0 105.251 177.392 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.444 ' HB3' ' CZ ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -56.4 -48.36 77.09 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-N 114.698 -1.137 . . . . 0.0 110.543 177.413 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 -59.97 -47.74 84.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 113.724 -1.58 . . . . 0.0 111.809 177.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.57 -48.09 78.13 Favored 'General case' 0 C--N 1.333 -0.13 0 O-C-N 121.089 -1.007 . . . . 0.0 110.087 178.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -61.99 -47.46 84.69 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 121.633 -0.667 . . . . 0.0 110.679 177.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.6 mt -52.42 -44.81 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 O-C-N 119.111 -2.243 . . . . 0.0 110.405 177.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.271 5.1 tp60 -60.92 -48.2 82.89 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 123.867 0.867 . . . . 0.0 110.383 177.456 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.6 t -65.13 -28.29 69.32 Favored 'General case' 0 C--O 1.225 -0.208 0 O-C-N 121.337 -0.852 . . . . 0.0 111.714 177.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.7 mp -78.67 -24.61 45.03 Favored 'General case' 0 N--CA 1.445 -0.69 0 O-C-N 119.857 -1.777 . . . . 0.0 108.432 176.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.454 ' HZ2' ' CG ' ' A' ' 36' ' ' ASP . 1.1 pttm -69.09 -54.09 16.84 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 102.375 -3.194 . . . . 0.0 102.375 176.067 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.454 ' CG ' ' HZ2' ' A' ' 35' ' ' LYS . 70.3 m-20 -91.31 70.13 6.06 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-O 124.086 1.898 . . . . 0.0 108.581 177.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.514 ' CG ' HE21 ' A' ' 9' ' ' GLN . 24.4 t0 -75.28 115.65 47.13 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 111.482 -2.599 . . . . 0.0 115.068 -177.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 0.2 OUTLIER -97.19 -121.02 0.0 OUTLIER 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 125.246 3.964 . . . . 0.0 114.532 177.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.5 p -102.5 -59.72 1.66 Allowed 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 117.63 2.456 . . . . 0.0 117.63 179.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.1 pm0 -69.95 32.51 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 119.269 3.063 . . . . 0.0 119.269 -176.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.495 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 18.9 m -52.4 -39.39 60.84 Favored 'General case' 0 N--CA 1.475 0.775 0 O-C-N 119.279 -2.138 . . . . 0.0 113.62 178.609 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.8 -38.6 72.79 Favored 'General case' 0 CA--C 1.538 0.488 0 O-C-N 120.297 -1.502 . . . . 0.0 109.092 176.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -64.94 -55.21 20.54 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 104.339 -2.467 . . . . 0.0 104.339 177.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.495 ' HG ' ' HA ' ' A' ' 41' ' ' SER . 2.1 mt -48.37 -28.36 3.14 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 177.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 13.4 tp -74.89 -54.45 7.23 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 -178.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.17 -35.48 69.61 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 113.506 -1.679 . . . . 0.0 110.598 177.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -64.47 -62.01 1.86 Allowed 'General case' 0 C--O 1.237 0.435 0 CA-C-O 122.685 1.231 . . . . 0.0 111.125 -178.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -51.96 -43.13 63.4 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 123.457 1.599 . . . . 0.0 111.02 177.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 35.7 tptt -58.94 -41.9 88.52 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.197 -1.365 . . . . 0.0 110.947 177.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.34 -38.45 91.18 Favored 'General case' 0 N--CA 1.457 -0.077 0 O-C-N 120.399 -1.438 . . . . 0.0 108.591 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 71.5 mt -59.6 -49.65 76.95 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 122.904 1.335 . . . . 0.0 110.418 177.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.563 HD21 ' C ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -50.68 -49.75 56.55 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-O 124.156 1.932 . . . . 0.0 112.51 177.366 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -62.39 -49.12 76.77 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 111.643 -2.526 . . . . 0.0 111.379 177.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.9 -44.77 86.98 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 121.25 -0.906 . . . . 0.0 113.01 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.424 ' NE2' ' NE2' ' A' ' 26' ' ' GLN . 29.8 pt20 -80.09 8.87 6.31 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 177.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.817 0 O-C-N 119.945 -1.722 . . . . 0.0 113.201 177.957 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.471 0.598 0 CA-C-O 122.54 1.162 . . . . 0.0 113.469 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.418 ' NE2' ' O ' ' A' ' 34' ' ' LEU 0.314 3.0 tm0? -38.06 -52.32 1.4 Allowed 'General case' 0 N--CA 1.425 -1.687 0 C-N-CA 128.537 2.735 . . . . 0.0 111.815 177.655 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 48.0 mm-40 -72.82 -31.37 64.75 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.06 -0.973 . . . . 0.0 112.073 -178.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -45.36 86.58 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 177.425 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.7 -42.46 98.97 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-O 121.153 0.502 . . . . 0.0 110.566 177.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -55.45 -50.83 68.81 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 123.672 1.701 . . . . 0.0 111.716 177.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -60.5 -46.89 88.47 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 113.876 -1.511 . . . . 0.0 111.007 177.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.402 ' CD ' ' HZ3' ' A' ' 49' ' ' LYS . 0.7 OUTLIER -55.62 -41.84 74.06 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 122.753 1.264 . . . . 0.0 108.886 177.648 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -57.14 -56.65 13.66 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 177.079 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 69.6 mt -55.79 -28.9 58.48 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 122.883 1.325 . . . . 0.0 113.521 177.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -72.26 -13.2 61.45 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.544 1.538 . . . . 0.0 113.522 177.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 80.8 mt -55.13 119.76 25.15 Favored Pre-proline 0 CA--C 1.544 0.741 0 O-C-N 119.985 -1.697 . . . . 0.0 112.093 177.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -73.86 -11.17 23.65 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 125.129 3.886 . . . . 0.0 118.795 -177.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASN . . . . . 0.474 HD22 ' HB1' ' A' ' 56' ' ' ALA . 4.4 p-10 -155.45 58.93 0.63 Allowed 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 124.27 1.986 . . . . 0.0 112.737 177.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.6 tt -160.28 123.0 3.36 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 112.139 -2.3 . . . . 0.0 108.269 177.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -154.33 -13.29 0.13 Allowed 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 117.061 2.245 . . . . 0.0 117.061 -177.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.669 ' H ' ' CD ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -75.89 -132.3 0.01 OUTLIER 'General case' 0 N--CA 1.425 -1.701 0 CA-C-O 125.911 2.767 . . . . 0.0 113.283 -177.478 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.414 ' H ' ' CG ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -66.07 -27.32 67.99 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 109.69 -3.414 . . . . 0.0 115.159 -177.072 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.582 HE22 ' NE2' ' A' ' 55' ' ' GLN . 16.1 mt-30 -74.1 -52.97 10.96 Favored 'General case' 0 N--CA 1.441 -0.896 0 N-CA-C 105.653 -1.98 . . . . 0.0 105.653 177.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -48.93 -49.11 41.77 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 124.355 2.026 . . . . 0.0 111.665 177.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -55.73 -58.49 7.63 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 109.59 -3.459 . . . . 0.0 111.719 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.6 -46.57 88.55 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 121.599 -0.688 . . . . 0.0 111.324 -178.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -61.5 -46.33 90.43 Favored 'General case' 0 C--O 1.219 -0.502 0 O-C-N 121.188 -0.945 . . . . 0.0 109.859 177.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 29.4 mt -54.62 -51.66 48.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-N 121.425 1.92 . . . . 0.0 110.775 177.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.37 -56.6 9.06 Favored 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 125.88 1.672 . . . . 0.0 111.501 177.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.0 t -63.3 -30.78 71.86 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 112.205 -2.271 . . . . 0.0 111.506 178.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.418 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 1.4 mm? -65.5 -45.0 85.28 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 105.875 -1.898 . . . . 0.0 105.875 177.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . 0.581 ' HZ2' ' CG ' ' A' ' 36' ' ' ASP . 0.0 OUTLIER -60.17 -42.21 94.5 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 119.958 -1.714 . . . . 0.0 110.709 177.419 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.581 ' CG ' ' HZ2' ' A' ' 35' ' ' LYS . 45.4 m-20 -70.97 -46.27 62.62 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 117.503 2.408 . . . . 0.0 117.503 177.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -79.64 142.3 57.18 Favored Pre-proline 0 CA--C 1.531 0.232 0 N-CA-C 119.575 3.176 . . . . 0.0 119.575 -178.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.432 ' HG2' ' H ' ' A' ' 39' ' ' SER . 89.1 Cg_endo -86.51 -74.35 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.098 1.865 . . . . 0.0 110.323 176.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.432 ' H ' ' HG2' ' A' ' 38' ' ' PRO . 61.0 m -102.25 -18.34 15.52 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 120.689 3.589 . . . . 0.0 120.689 -177.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -70.79 -9.71 58.0 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 125.866 3.939 . . . . 0.0 114.296 -177.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 74.9 m -43.87 -29.13 0.51 Allowed 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 125.664 1.586 . . . . 0.0 114.214 177.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.19 -44.43 97.3 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 124.195 1.95 . . . . 0.0 109.572 177.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.37 -52.73 17.07 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 105.15 -2.167 . . . . 0.0 105.15 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.1 mt -51.45 -29.51 16.4 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 123.834 1.778 . . . . 0.0 114.69 177.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 63.0 tp -74.46 -50.67 17.4 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 -177.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.8 -37.98 71.9 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 113.821 -1.536 . . . . 0.0 107.497 177.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -63.63 -52.52 60.46 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 119.498 -0.881 . . . . 0.0 110.992 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -54.42 -40.73 68.56 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 122.428 1.108 . . . . 0.0 111.417 177.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.402 ' HZ3' ' CD ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -63.96 -41.49 97.55 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 121.115 -0.991 . . . . 0.0 110.509 177.288 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -61.89 -39.07 90.68 Favored 'General case' 0 CA--C 1.519 -0.241 0 O-C-N 121.105 -0.997 . . . . 0.0 108.7 177.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 53.4 mt -62.3 -45.58 92.61 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 122.141 0.972 . . . . 0.0 110.454 177.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -59.21 -49.61 77.17 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 119.498 -2.001 . . . . 0.0 110.668 177.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -52.91 -42.75 65.66 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 124.999 1.319 . . . . 0.0 111.31 177.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.01 -30.47 70.32 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.527 -0.733 . . . . 0.0 111.74 177.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.582 ' NE2' HE22 ' A' ' 26' ' ' GLN . 40.0 mt-30 -82.53 -34.31 27.92 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 123.025 1.393 . . . . 0.0 111.994 177.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.474 ' HB1' HD22 ' A' ' 21' ' ' ASN . . . . . . . . 0 CA--C 1.542 0.645 0 CA-C-N 114.784 -1.098 . . . . 0.0 113.378 177.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 84.5 t . . . . . 0 N--CA 1.468 0.466 0 CA-C-O 117.937 -1.03 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 21.8 p30 -71.92 -169.25 0.45 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 121.732 2.06 . . . . 0.0 113.665 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.8 p-10 -69.27 -5.97 26.39 Favored 'General case' 0 CA--C 1.528 0.1 0 O-C-N 120.952 -1.093 . . . . 0.0 113.576 -177.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.5 ttpp -100.75 -52.96 3.19 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.032 0.933 . . . . 0.0 111.389 177.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -67.68 82.39 0.18 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-O 123.622 1.677 . . . . 0.0 112.919 -177.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.456 ' CG ' ' H ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -109.89 -130.24 0.3 Allowed 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 110.085 -3.234 . . . . 0.0 116.309 -177.528 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.456 ' H ' ' CG ' ' A' ' 6' ' ' ASN . 7.7 mtmp? -39.58 -106.55 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 119.318 3.081 . . . . 0.0 119.318 -177.376 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -53.69 -46.52 70.72 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 120.694 -1.254 . . . . 0.0 110.962 -178.061 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . 0.266 7.6 tt0 -45.95 -55.56 6.63 Favored 'General case' 0 N--CA 1.425 -1.702 0 C-N-CA 127.609 2.364 . . . . 0.0 110.925 177.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -70.04 -45.3 67.44 Favored 'General case' 0 CA--C 1.512 -0.486 0 O-C-N 118.743 -2.473 . . . . 0.0 112.894 177.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -50.57 -49.05 57.24 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 123.788 1.756 . . . . 0.0 111.39 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.17 -43.53 98.74 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 111.166 -2.743 . . . . 0.0 110.801 177.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -54.79 -51.37 65.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 123.36 1.552 . . . . 0.0 111.556 177.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -58.59 -55.84 29.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 113.16 -1.836 . . . . 0.0 111.033 177.368 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -53.52 -37.87 63.2 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 123.64 1.686 . . . . 0.0 110.1 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.457 ' O ' ' NH1' ' A' ' 27' ' ' ARG . 1.6 mt -61.24 -60.69 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 177.161 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 96.2 mt -53.12 -35.81 60.08 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 121.294 1.861 . . . . 0.0 113.318 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -61.8 -19.64 62.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 112.9 -1.954 . . . . 0.0 114.072 177.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 70.5 mt -59.45 115.28 11.83 Favored Pre-proline 0 CA--C 1.537 0.445 0 O-C-N 120.661 -1.274 . . . . 0.0 111.196 177.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -80.57 -13.79 11.86 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 123.61 2.873 . . . . 0.0 115.592 -177.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.512 ' ND2' ' HB2' ' A' ' 56' ' ' ALA . 1.5 p-10 -139.38 40.35 2.07 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 125.612 2.625 . . . . 0.0 113.536 -178.569 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.8 tt -149.7 121.84 8.32 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 103.849 -2.649 . . . . 0.0 103.849 177.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -153.35 -19.32 0.15 Allowed 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 -177.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.669 ' H ' ' CD ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -73.36 -133.04 0.01 OUTLIER 'General case' 0 N--CA 1.424 -1.774 0 CA-C-O 126.052 2.834 . . . . 0.0 113.128 -177.54 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.464 ' HA ' HD21 ' A' ' 28' ' ' ASN . 0.3 OUTLIER -61.34 -30.8 70.74 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 109.028 -3.715 . . . . 0.0 114.637 -177.017 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.467 ' NE2' HE22 ' A' ' 55' ' ' GLN . 19.0 mt-30 -69.68 -50.71 41.25 Favored 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 177.607 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.457 ' NH1' ' O ' ' A' ' 16' ' ' ILE . 2.1 tpp180 -50.77 -48.43 59.29 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 122.277 1.037 . . . . 0.0 110.898 177.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.464 HD21 ' HA ' ' A' ' 25' ' ' GLU . 68.9 m-80 -57.19 -54.0 51.72 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 114.005 -1.452 . . . . 0.0 111.672 177.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.41 -47.42 75.94 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-O 121.654 0.74 . . . . 0.0 110.595 -178.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 50.0 m-85 -61.9 -47.89 82.94 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 118.139 -0.934 . . . . 0.0 110.566 177.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 84.2 mt -54.44 -46.05 70.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-N 121.877 2.126 . . . . 0.0 110.247 177.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.31 5.7 tp60 -56.61 -50.64 71.39 Favored 'General case' 0 N--CA 1.44 -0.952 0 C-N-CA 124.798 1.239 . . . . 0.0 112.146 178.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 20.2 t -63.09 -42.01 99.51 Favored 'General case' 0 C--O 1.217 -0.611 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -58.56 -38.43 77.85 Favored 'General case' 0 CA--C 1.529 0.172 0 O-C-N 120.106 -1.621 . . . . 0.0 111.92 177.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.581 ' HZ2' ' CG ' ' A' ' 36' ' ' ASP . 1.9 ttpm? -68.15 -43.88 77.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 113.624 -1.626 . . . . 0.0 113.574 177.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.581 ' CG ' ' HZ2' ' A' ' 35' ' ' LYS . 89.4 m-20 -88.53 -42.44 12.08 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 116.823 2.157 . . . . 0.0 116.823 177.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -96.11 133.49 25.08 Favored Pre-proline 0 CA--C 1.543 0.691 0 N-CA-C 118.717 2.858 . . . . 0.0 118.717 -177.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -71.14 -83.48 0.01 OUTLIER 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 124.287 3.324 . . . . 0.0 116.08 177.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.3 m -100.74 -11.24 20.08 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 118.407 2.744 . . . . 0.0 118.407 -177.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -69.46 -36.21 76.36 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 125.477 3.762 . . . . 0.0 111.529 -177.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.447 ' HA ' ' CG ' ' A' ' 44' ' ' LEU . 60.3 m -49.84 -27.1 4.64 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 112.244 -2.253 . . . . 0.0 113.969 -179.183 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.4 ' O ' ' HB3' ' A' ' 45' ' ' LEU . . . -60.98 -36.86 80.56 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 121.748 2.067 . . . . 0.0 112.364 177.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -65.9 -41.88 90.92 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 125.28 2.467 . . . . 0.0 106.739 177.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.447 ' CG ' ' HA ' ' A' ' 41' ' ' SER . 0.7 OUTLIER -66.21 -21.79 66.32 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 112.455 -2.157 . . . . 0.0 112.972 177.122 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.4 ' HB3' ' O ' ' A' ' 42' ' ' ALA . 14.8 tp -70.93 -49.25 47.71 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 104.597 -2.371 . . . . 0.0 104.597 177.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.79 -37.81 69.08 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 113.262 -1.79 . . . . 0.0 106.679 176.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -64.11 -49.96 70.15 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 118.416 -1.314 . . . . 0.0 112.447 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -52.68 -44.94 66.57 Favored 'General case' 0 C--O 1.236 0.378 0 O-C-N 120.293 -1.505 . . . . 0.0 111.454 177.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 25.6 tptp -61.11 -44.82 96.76 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 121.432 -0.793 . . . . 0.0 111.641 177.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 21.6 mmmt -66.56 -28.62 68.67 Favored 'General case' 0 CA--C 1.511 -0.553 0 O-C-N 121.072 -1.017 . . . . 0.0 110.609 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 37.1 mt -66.58 -46.81 74.75 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 122.539 1.161 . . . . 0.0 108.454 176.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.485 ' ND2' HD22 ' A' ' 21' ' ' ASN . 0.7 OUTLIER -49.3 -51.31 34.81 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 124.633 2.158 . . . . 0.0 108.067 177.427 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -60.63 -40.04 90.48 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 112.076 -2.329 . . . . 0.0 111.778 177.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.45 -44.35 89.18 Favored 'General case' 0 CA--C 1.517 -0.307 0 O-C-N 120.182 -1.574 . . . . 0.0 111.724 177.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.467 HE22 ' NE2' ' A' ' 26' ' ' GLN . 1.8 pm0 -74.48 -50.67 17.34 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 116.977 -1.889 . . . . 0.0 110.923 177.203 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.547 ' CB ' ' CD ' ' A' ' 57' ' ' PRO . . . -92.62 -111.34 0.0 OUTLIER Pre-proline 0 CA--C 1.553 1.062 0 N-CA-C 114.514 1.302 . . . . 0.0 114.514 177.614 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.547 ' CD ' ' CB ' ' A' ' 56' ' ' ALA . 8.6 Cg_endo -86.05 101.23 0.64 Allowed 'Trans proline' 0 C--N 1.359 1.082 0 CA-C-N 125.928 3.153 . . . . 0.0 112.739 178.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.574 ' C ' ' HZ2' ' A' ' 58' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.16 0 N-CA-C 116.76 2.133 . . . . 0.0 116.76 -177.354 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 5.4 m . . . . . 0 CA--C 1.53 0.185 0 CA-C-O 124.005 1.86 . . . . 0.0 111.6 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -39.49 -81.41 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 130.468 3.507 . . . . 0.0 117.279 177.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -160.42 -60.91 0.06 Allowed 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 124.176 1.941 . . . . 0.0 110.448 177.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -55.74 -45.23 78.07 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 112.432 -2.167 . . . . 0.0 110.421 177.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.479 ' CZ ' ' HA ' ' A' ' 35' ' ' LYS . 52.7 m-85 -85.6 95.09 9.22 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 122.608 1.194 . . . . 0.0 114.141 177.523 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -77.32 168.64 19.7 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.075 177.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.405 ' HD2' ' H ' ' A' ' 8' ' ' GLU . 0.4 OUTLIER -52.32 -46.05 65.86 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 119.344 3.09 . . . . 0.0 119.344 -177.223 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.424 ' CD ' ' H ' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -64.52 -50.38 67.62 Favored 'General case' 0 N--CA 1.461 0.096 0 O-C-N 118.67 -2.519 . . . . 0.0 108.559 179.222 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.414 ' CD ' ' HA ' ' A' ' 38' ' ' PRO 0.274 8.2 tt0 -43.38 -45.41 6.12 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 127.655 2.382 . . . . 0.0 110.778 177.372 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -73.21 -44.63 59.36 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 112.877 -1.965 . . . . 0.0 113.473 178.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 18.8 t30 -54.71 -47.19 74.04 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-O 123.857 1.789 . . . . 0.0 108.931 177.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.412 ' CB ' HD21 ' A' ' 45' ' ' LEU . . . -57.9 -48.05 81.01 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 111.678 -2.51 . . . . 0.0 111.307 177.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -55.29 -41.62 72.53 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 124.253 1.978 . . . . 0.0 111.949 177.445 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -62.71 -52.35 63.59 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 112.955 -1.929 . . . . 0.0 110.426 177.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -53.06 -42.88 66.23 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 122.178 0.989 . . . . 0.0 109.648 177.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.413 ' O ' ' HD2' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -54.29 -59.47 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.159 0 CA-C-N 114.563 -1.199 . . . . 0.0 109.636 177.496 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 35.0 mt -49.69 -49.4 47.74 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.902 0.858 . . . . 0.0 111.377 177.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -61.5 -10.84 8.66 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 113.608 -1.633 . . . . 0.0 115.347 178.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 75.7 mt -58.56 104.72 0.45 Allowed Pre-proline 0 CA--C 1.541 0.617 0 CA-C-N 122.307 2.322 . . . . 0.0 111.26 177.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -82.08 -4.17 11.82 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 124.191 3.261 . . . . 0.0 116.657 -177.025 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -140.64 44.15 1.84 Allowed 'General case' 0 N--CA 1.456 -0.157 0 CA-C-O 123.309 1.528 . . . . 0.0 112.485 177.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.7 tt -126.94 137.93 53.2 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 113.333 -1.758 . . . . 0.0 106.679 177.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -67.82 131.49 45.64 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 124.141 1.924 . . . . 0.0 113.698 -177.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -40.59 -45.48 2.32 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 112.983 -1.917 . . . . 0.0 114.778 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.473 ' CD ' ' H ' ' A' ' 25' ' ' GLU . 16.1 mp0 -55.79 -55.25 34.61 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 123.247 1.498 . . . . 0.0 111.2 177.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.401 ' NE2' ' HB3' ' A' ' 51' ' ' LEU . 35.0 tt0 -59.06 -38.97 80.68 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.305 177.18 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.413 ' HD2' ' O ' ' A' ' 16' ' ' ILE . 0.0 OUTLIER -56.62 -50.73 71.16 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 120.731 -1.231 . . . . 0.0 108.123 176.963 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 46.9 m-80 -57.99 -46.14 85.68 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 177.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.16 -47.51 78.11 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 122.117 0.961 . . . . 0.0 109.414 177.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -62.44 -50.67 70.54 Favored 'General case' 0 C--O 1.217 -0.61 0 O-C-N 121.447 -0.783 . . . . 0.0 110.111 177.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.7 mt -45.6 -49.82 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-O 123.359 1.552 . . . . 0.0 112.387 177.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.406 ' O ' ' HB3' ' A' ' 35' ' ' LYS 0.405 4.8 tp-100 -60.0 -56.23 24.26 Favored 'General case' 0 N--CA 1.424 -1.726 0 CA-C-N 113.522 -1.672 . . . . 0.0 109.169 179.265 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.9 t -61.62 -33.83 74.61 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 120.443 -1.41 . . . . 0.0 114.064 177.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 31.7 mt -65.95 -36.18 82.64 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 125.397 1.479 . . . . 0.0 109.668 177.322 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.479 ' HA ' ' CZ ' ' A' ' 5' ' ' PHE . 1.3 ttpm? -66.59 -41.08 89.04 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 114.48 -1.236 . . . . 0.0 109.779 176.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.472 ' CG ' ' HZ2' ' A' ' 35' ' ' LYS . 73.7 m-20 -71.83 -66.68 0.61 Allowed 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 115.802 1.779 . . . . 0.0 115.802 177.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -102.83 126.76 31.73 Favored Pre-proline 0 C--O 1.239 0.535 0 CA-C-N 120.656 1.571 . . . . 0.0 114.215 -177.809 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.414 ' HA ' ' CD ' ' A' ' 9' ' ' GLN . 39.8 Cg_endo -77.82 -50.09 0.09 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 123.091 2.528 . . . . 0.0 114.713 177.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 95.8 p -60.5 -43.51 96.95 Favored 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 -177.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.436 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 58.0 mt-30 -74.51 -21.23 59.65 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 117.766 -1.111 . . . . 0.0 112.929 -178.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.412 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 94.2 p -48.35 -37.73 17.43 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 121.238 1.836 . . . . 0.0 114.515 -177.318 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.33 -42.19 77.3 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 123.655 1.693 . . . . 0.0 109.739 177.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -70.75 -52.6 19.76 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 105.993 -1.854 . . . . 0.0 105.993 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 40' ' ' GLN . 1.1 mt -50.31 -30.46 12.07 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 115.636 1.717 . . . . 0.0 115.636 177.29 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.412 HD21 ' CB ' ' A' ' 12' ' ' ALA . 26.3 tp -75.75 -52.95 9.3 Favored 'General case' 0 CA--C 1.504 -0.795 0 N-CA-C 107.308 -1.368 . . . . 0.0 107.308 -177.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.51 -41.08 63.11 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 113.073 -1.876 . . . . 0.0 107.811 177.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -65.98 -51.85 54.75 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 119.174 -1.01 . . . . 0.0 112.397 -177.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.13 -38.77 73.97 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 120.503 -1.373 . . . . 0.0 112.208 177.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 9.1 tmtm? -65.4 -45.11 85.29 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.752 0.787 . . . . 0.0 109.552 177.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 46.8 mtpt -60.59 -41.22 94.24 Favored 'General case' 0 C--O 1.233 0.218 0 O-C-N 119.915 -1.741 . . . . 0.0 108.859 -178.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.517 ' C ' HE21 ' A' ' 55' ' ' GLN . 39.4 mt -65.64 -51.1 62.12 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 114.418 -1.265 . . . . 0.0 110.955 177.531 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -46.85 -49.68 19.75 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 123.856 1.789 . . . . 0.0 110.975 178.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -62.6 -46.89 86.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 111.684 -2.507 . . . . 0.0 111.263 177.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.3 -39.93 73.52 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 119.299 -2.126 . . . . 0.0 110.809 176.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.517 HE21 ' C ' ' A' ' 51' ' ' LEU . 39.8 mt-30 -75.41 -5.69 46.24 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.332 1.053 . . . . 0.0 112.902 177.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -64.56 155.47 81.23 Favored Pre-proline 0 C--O 1.235 0.308 0 O-C-N 120.092 -1.63 . . . . 0.0 113.555 -177.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -72.25 66.95 3.49 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 124.119 3.213 . . . . 0.0 114.254 177.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.452 0 CA-C-N 113.504 -1.68 . . . . 0.0 111.965 178.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 27.3 m . . . . . 0 CA--C 1.532 0.251 0 CA-C-O 118.62 -0.705 . . . . 0.0 112.366 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -78.54 176.85 9.04 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 117.821 2.526 . . . . 0.0 117.821 -177.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 41.6 m-20 -103.11 14.96 30.59 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 113.302 -1.772 . . . . 0.0 111.326 177.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.409 ' NZ ' ' CZ ' ' A' ' 5' ' ' PHE . 0.0 OUTLIER -82.12 -9.91 59.37 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 -177.376 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.409 ' CZ ' ' NZ ' ' A' ' 4' ' ' LYS . 48.2 m-85 -86.54 -122.75 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 O-C-N 120.331 -1.48 . . . . 0.0 113.33 -178.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.712 HD22 ' N ' ' A' ' 40' ' ' GLN . 0.7 OUTLIER -83.22 -170.32 2.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 123.251 1.5 . . . . 0.0 112.682 177.838 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.1 mtmm -78.32 -62.96 1.51 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 123.973 1.844 . . . . 0.0 112.033 -177.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -89.9 33.93 0.85 Allowed 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 128.698 2.799 . . . . 0.0 108.649 -178.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . 0.329 0.1 OUTLIER -44.63 -80.61 0.01 OUTLIER 'General case' 0 N--CA 1.426 -1.675 0 N-CA-C 117.197 2.295 . . . . 0.0 117.197 -176.989 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 -65.49 -25.61 67.55 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 111.448 -2.614 . . . . 0.0 112.297 -179.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.41 -49.78 62.33 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 120.531 1.514 . . . . 0.0 107.569 177.582 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.06 -45.51 86.95 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.061 177.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -53.2 -51.14 63.07 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 123.652 1.691 . . . . 0.0 111.266 177.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -54.45 -55.58 27.49 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 113.636 -1.62 . . . . 0.0 112.296 177.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -61.73 -33.36 73.91 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 121.708 0.766 . . . . 0.0 111.362 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 14.6 mt -60.48 -53.39 49.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 O-C-N 120.359 -1.463 . . . . 0.0 108.354 177.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 51.9 mt -51.22 -49.74 60.49 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 122.856 1.313 . . . . 0.0 110.297 177.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 26.8 t-80 -59.39 -16.53 23.67 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 112.661 -2.063 . . . . 0.0 116.208 179.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 71.7 mt -58.33 102.55 0.31 Allowed Pre-proline 0 CA--C 1.547 0.847 0 CA-C-N 122.926 2.603 . . . . 0.0 114.733 -177.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -80.52 -17.0 10.28 Favored 'Trans proline' 0 N--CA 1.463 -0.299 0 C-N-CA 123.47 2.78 . . . . 0.0 114.37 -177.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.722 HD21 ' HB3' ' A' ' 56' ' ' ALA . 1.5 p-10 -118.61 40.66 3.18 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 126.223 2.916 . . . . 0.0 111.204 177.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -141.19 141.55 34.07 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 109.725 -3.398 . . . . 0.0 106.68 177.435 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -87.55 158.68 18.85 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 122.36 1.076 . . . . 0.0 112.846 -177.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -50.25 -43.53 53.14 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.036 -0.984 . . . . 0.0 112.413 178.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -52.47 -54.93 25.83 Favored 'General case' 0 C--O 1.237 0.422 0 O-C-N 121.547 -0.72 . . . . 0.0 111.83 177.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.534 ' NE2' HE22 ' A' ' 55' ' ' GLN . 32.7 mt-30 -60.56 -43.91 96.73 Favored 'General case' 0 C--N 1.343 0.31 0 O-C-N 120.409 -1.432 . . . . 0.0 110.49 177.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 20.3 ttm-85 -50.83 -54.55 22.81 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 122.336 1.065 . . . . 0.0 110.931 178.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 62.1 m-80 -60.25 -44.12 95.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.577 177.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.29 -47.76 77.99 Favored 'General case' 0 CA--C 1.528 0.099 0 O-C-N 120.715 -1.24 . . . . 0.0 110.807 177.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -63.22 -45.04 93.52 Favored 'General case' 0 C--N 1.331 -0.208 0 O-C-N 121.389 -0.82 . . . . 0.0 110.287 177.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 34.1 mt -53.55 -47.73 59.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-O 122.822 1.296 . . . . 0.0 110.409 176.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.323 1.5 tp60 -55.4 -49.63 71.84 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 125.127 1.371 . . . . 0.0 110.703 177.166 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 34.2 t -63.58 -32.93 74.55 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.128 177.162 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.77 -37.92 88.55 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.546 1.539 . . . . 0.0 109.99 177.63 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.597 ' HZ2' ' CG ' ' A' ' 36' ' ' ASP . 0.0 OUTLIER -67.21 -49.1 65.82 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 113.056 -1.884 . . . . 0.0 110.041 177.106 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.597 ' CG ' ' HZ2' ' A' ' 35' ' ' LYS . 71.3 m-20 -72.26 -48.13 44.93 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 116.407 2.002 . . . . 0.0 116.407 177.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 29.1 t0 -79.47 118.72 73.95 Favored Pre-proline 0 CA--C 1.535 0.381 0 N-CA-C 116.488 2.033 . . . . 0.0 116.488 -177.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -95.64 -14.55 0.56 Allowed 'Trans proline' 0 CA--C 1.532 0.419 0 C-N-CA 125.096 3.864 . . . . 0.0 113.262 177.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 60.6 p -100.77 -39.97 7.56 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 119.046 2.98 . . . . 0.0 119.046 -177.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.712 ' N ' HD22 ' A' ' 6' ' ' ASN . 36.1 mt-30 -121.72 43.25 2.89 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 120.73 3.604 . . . . 0.0 120.73 -177.012 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.466 ' H ' ' CG ' ' A' ' 6' ' ' ASN . 58.2 m -54.64 -36.41 64.52 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 125.609 3.822 . . . . 0.0 111.62 179.068 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.97 -37.36 66.41 Favored 'General case' 0 C--O 1.223 -0.311 0 O-C-N 120.018 -1.676 . . . . 0.0 109.589 176.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -62.98 -50.12 72.02 Favored 'General case' 0 C--O 1.223 -0.314 0 O-C-N 120.227 -1.545 . . . . 0.0 107.245 177.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.466 ' HG ' ' HA ' ' A' ' 41' ' ' SER . 1.1 mt -54.83 -34.62 63.04 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 115.442 1.645 . . . . 0.0 115.442 177.285 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 29.0 tp -76.61 -50.18 14.46 Favored 'General case' 0 CA--C 1.509 -0.61 0 C-N-CA 124.887 1.275 . . . . 0.0 108.987 -177.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.72 -34.51 71.42 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 113.771 -1.559 . . . . 0.0 107.302 177.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.405 ' CD ' ' HZ3' ' A' ' 50' ' ' LYS . 35.4 mm-40 -64.79 -58.23 6.8 Favored 'General case' 0 CA--C 1.522 -0.13 0 CA-C-O 122.056 0.932 . . . . 0.0 113.057 178.365 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -53.52 -39.86 65.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.85 0.833 . . . . 0.0 112.756 177.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -67.81 -41.19 83.5 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.197 177.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.405 ' HZ3' ' CD ' ' A' ' 47' ' ' GLU . 8.3 mtpm? -60.65 -40.93 93.84 Favored 'General case' 0 CA--C 1.511 -0.525 0 O-C-N 120.725 -1.234 . . . . 0.0 109.448 178.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 19.9 mt -64.29 -53.41 49.38 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.024 -1.444 . . . . 0.0 109.247 177.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.41 ' HA ' ' NE2' ' A' ' 55' ' ' GLN . 2.4 t30 -49.06 -46.61 44.73 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 123.003 1.383 . . . . 0.0 112.13 -178.061 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -69.26 -50.22 48.96 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 113.533 -1.667 . . . . 0.0 111.478 177.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.68 -42.52 79.19 Favored 'General case' 0 N--CA 1.458 -0.058 0 O-C-N 120.402 -1.436 . . . . 0.0 113.424 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.534 HE22 ' NE2' ' A' ' 26' ' ' GLN . 1.2 pt20 -78.24 -0.58 29.14 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 121.217 -0.927 . . . . 0.0 112.944 179.563 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.722 ' HB3' HD21 ' A' ' 21' ' ' ASN . . . -90.15 -92.11 0.0 OUTLIER Pre-proline 0 CA--C 1.541 0.608 0 CA-C-O 116.125 -1.893 . . . . 0.0 115.291 -177.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.465 ' CD ' ' CB ' ' A' ' 56' ' ' ALA . 22.6 Cg_endo -72.48 69.34 3.44 Favored 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 124.958 3.772 . . . . 0.0 117.445 -177.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.44 0 CA-C-N 114.292 -1.322 . . . . 0.0 111.46 177.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 56.1 t . . . . . 0 CA--C 1.535 0.402 0 CA-C-O 120.77 0.319 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.468 ' CG ' ' HZ3' ' A' ' 4' ' ' LYS . 4.2 p-10 -67.59 -109.69 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 118.595 2.813 . . . . 0.0 118.595 -177.546 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -160.36 92.25 0.97 Allowed 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 116.43 2.011 . . . . 0.0 116.43 -176.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.468 ' HZ3' ' CG ' ' A' ' 2' ' ' ASP . 13.7 mptt -78.27 43.4 0.45 Allowed 'General case' 0 N--CA 1.478 0.951 0 O-C-N 118.801 -2.437 . . . . 0.0 117.417 -177.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -82.24 60.39 4.96 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 119.318 -2.114 . . . . 0.0 114.75 -177.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -128.93 -46.54 1.25 Allowed 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 115.858 1.799 . . . . 0.0 115.858 -177.773 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.7 mtpm? -90.24 -136.97 0.13 Allowed 'General case' 0 CA--C 1.543 0.703 0 O-C-N 118.761 -2.462 . . . . 0.0 115.82 -177.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -6.97 8.84 Favored 'General case' 0 N--CA 1.465 0.303 0 O-C-N 119.367 -2.083 . . . . 0.0 112.592 -178.045 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.403 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 1.5 tm0? -37.41 -55.47 1.05 Allowed 'General case' 0 N--CA 1.422 -1.873 0 C-N-CA 129.061 2.944 . . . . 0.0 114.952 177.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -72.13 -36.23 69.33 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 118.733 -1.187 . . . . 0.0 112.619 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -58.89 -49.05 79.24 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 121.194 1.815 . . . . 0.0 107.75 177.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.41 ' HA ' HD21 ' A' ' 45' ' ' LEU . . . -56.12 -44.37 79.06 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 113.203 -1.817 . . . . 0.0 110.376 177.228 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -52.57 -55.63 20.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 123.523 1.63 . . . . 0.0 111.3 177.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -56.98 -44.47 82.72 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.568 -1.196 . . . . 0.0 111.618 177.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.1 -46.12 89.11 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 123.017 1.389 . . . . 0.0 108.947 177.358 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.2 mt -56.1 -46.81 81.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 O-C-N 119.845 -1.784 . . . . 0.0 109.585 -178.025 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 72.0 mt -65.23 -38.08 89.28 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.95 0.881 . . . . 0.0 111.189 177.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -59.61 -38.9 82.55 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.555 1.142 . . . . 0.0 113.175 177.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 87.2 mt -54.25 104.85 0.46 Allowed Pre-proline 0 CA--C 1.539 0.534 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 -178.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . 0.507 ' C ' ' H ' ' A' ' 22' ' ' LEU . 33.4 Cg_endo -81.21 -50.72 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 123.525 2.816 . . . . 0.0 114.945 -177.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.573 HD22 ' CG ' ' A' ' 52' ' ' ASN . 2.5 p-10 -83.85 30.7 0.5 Allowed 'General case' 0 C--O 1.236 0.352 0 CA-C-O 125.579 2.609 . . . . 0.0 111.611 -177.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.507 ' H ' ' C ' ' A' ' 20' ' ' PRO . 6.8 tp -109.3 139.67 43.95 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 111.013 -2.812 . . . . 0.0 109.487 177.704 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 -70.52 129.94 40.54 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 123.245 1.497 . . . . 0.0 110.145 177.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.5 mp0 -55.56 -27.26 47.99 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 120.427 -1.421 . . . . 0.0 112.117 177.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.49 ' HA ' ' ND2' ' A' ' 28' ' ' ASN . 1.8 tm-20 -60.47 -68.19 0.32 Allowed 'General case' 0 C--O 1.236 0.371 0 O-C-N 121.253 -0.904 . . . . 0.0 108.952 177.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.48 ' NE2' HE22 ' A' ' 55' ' ' GLN . 10.6 pt20 -50.8 -46.3 59.68 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 120.722 -1.236 . . . . 0.0 110.224 177.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 18.6 ttm105 -48.82 -51.37 29.83 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.134 -1.604 . . . . 0.0 112.356 177.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.49 ' ND2' ' HA ' ' A' ' 25' ' ' GLU . 12.7 p30 -61.33 -46.17 91.36 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 115.395 -0.821 . . . . 0.0 112.565 177.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.82 -44.51 66.73 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 122.32 1.057 . . . . 0.0 110.587 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . 0.444 ' CE2' ' HA ' ' A' ' 48' ' ' ALA . 47.1 m-85 -62.47 -52.31 64.0 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 176.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 14.7 mt -50.17 -48.86 23.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 CA-C-O 122.338 1.066 . . . . 0.0 112.603 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.29 0.0 OUTLIER -60.51 -53.77 53.51 Favored 'General case' 0 N--CA 1.432 -1.367 0 C-N-CA 127.591 2.356 . . . . 0.0 111.639 -178.386 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 23.0 t -63.66 -41.99 98.15 Favored 'General case' 0 C--N 1.332 -0.187 0 O-C-N 120.694 -1.254 . . . . 0.0 110.941 177.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 21.1 tp -58.49 -41.33 85.09 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 121.029 -1.045 . . . . 0.0 112.557 177.536 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.561 ' HZ1' ' CG ' ' A' ' 36' ' ' ASP . 0.0 OUTLIER -69.78 -42.6 73.59 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.912 0.863 . . . . 0.0 111.15 177.26 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.561 ' CG ' ' HZ1' ' A' ' 35' ' ' LYS . 1.6 m-20 -73.51 -53.55 10.33 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 117.971 2.582 . . . . 0.0 117.971 -179.429 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.3 m-20 -143.7 -58.73 0.02 OUTLIER Pre-proline 0 C--O 1.237 0.41 0 N-CA-C 118.343 2.72 . . . . 0.0 118.343 -176.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 0.5 OUTLIER -43.65 127.69 6.24 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 124.36 3.373 . . . . 0.0 115.484 177.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.5 t -100.73 -28.67 12.7 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 111.268 -2.696 . . . . 0.0 112.058 -177.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -79.28 63.54 3.94 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 124.907 2.289 . . . . 0.0 110.386 177.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.403 ' CB ' ' HA ' ' A' ' 9' ' ' GLN . 66.8 p -55.21 -38.35 68.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 112.978 -1.919 . . . . 0.0 112.9 -178.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.89 -39.36 65.7 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.712 -0.617 . . . . 0.0 110.009 177.34 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -71.06 -55.5 8.11 Favored 'General case' 0 N--CA 1.454 -0.258 0 O-C-N 121.187 -0.946 . . . . 0.0 108.77 177.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.7 tp -57.25 -23.55 48.9 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-O 125.454 2.55 . . . . 0.0 111.751 -177.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.41 HD21 ' HA ' ' A' ' 12' ' ' ALA . 35.8 tp -77.42 -53.18 7.96 Favored 'General case' 0 CA--C 1.503 -0.865 0 CA-C-N 112.585 -2.098 . . . . 0.0 106.83 -177.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.44 -33.9 46.23 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 177.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -64.01 -59.26 4.71 Favored 'General case' 0 C--N 1.345 0.412 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.89 177.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.444 ' HA ' ' CE2' ' A' ' 30' ' ' PHE . . . -50.88 -43.09 59.51 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 122.944 1.354 . . . . 0.0 112.475 177.461 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.73 -40.29 96.74 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 121.39 -0.819 . . . . 0.0 110.096 177.65 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.87 -41.65 92.0 Favored 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 52.8 mt -63.36 -50.37 70.22 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 119.32 -0.952 . . . . 0.0 109.465 177.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.573 ' CG ' HD22 ' A' ' 21' ' ' ASN . 3.2 t-20 -49.9 -41.73 46.48 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 119.908 -1.745 . . . . 0.0 110.706 177.2 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . 0.488 ' HA ' ' CG ' ' A' ' 57' ' ' PRO . 72.9 m-20 -60.52 -50.29 74.13 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 114.222 -1.353 . . . . 0.0 112.093 177.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.97 -43.13 77.28 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 122.105 0.955 . . . . 0.0 111.723 177.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.48 HE22 ' NE2' ' A' ' 26' ' ' GLN . 0.0 OUTLIER -69.96 -54.29 13.96 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 115.423 1.638 . . . . 0.0 115.423 177.356 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.432 ' HB1' ' CD ' ' A' ' 57' ' ' PRO . . . -91.14 -76.05 0.04 OUTLIER Pre-proline 0 C--N 1.323 -0.572 0 N-CA-C 117.247 2.314 . . . . 0.0 117.247 -177.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.488 ' CG ' ' HA ' ' A' ' 53' ' ' ASP . 19.1 Cg_endo -76.36 61.84 6.79 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 124.401 3.4 . . . . 0.0 114.779 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.527 ' C ' ' HZ1' ' A' ' 58' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.437 -1.113 0 CA-C-N 112.843 -1.98 . . . . 0.0 115.018 177.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 91.7 t . . . . . 0 N--CA 1.466 0.335 0 CA-C-O 124.815 2.245 . . . . 0.0 108.966 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -68.73 -157.23 0.02 OUTLIER 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 109.461 -3.518 . . . . 0.0 111.595 177.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -118.9 7.04 11.42 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 123.282 1.515 . . . . 0.0 109.107 177.405 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.02 117.95 28.4 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 120.932 -1.105 . . . . 0.0 111.165 -177.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -98.26 107.54 20.03 Favored 'General case' 0 C--O 1.239 0.507 0 O-C-N 120.115 -1.616 . . . . 0.0 111.901 177.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.42 HD22 ' CB ' ' A' ' 38' ' ' PRO . 0.3 OUTLIER -81.8 174.57 11.2 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 114.43 -1.259 . . . . 0.0 112.079 178.08 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.409 ' HZ1' ' CD ' ' A' ' 8' ' ' GLU . 3.6 pptp? -39.25 -56.73 1.47 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 119.226 3.047 . . . . 0.0 119.226 -176.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.432 ' HG2' ' H ' ' A' ' 9' ' ' GLN . 1.7 pm0 -65.25 -44.72 87.22 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 124.521 2.105 . . . . 0.0 112.182 -177.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.432 ' H ' ' HG2' ' A' ' 8' ' ' GLU 0.309 10.4 tt0 -53.53 -45.33 69.76 Favored 'General case' 0 N--CA 1.428 -1.527 0 C-N-CA 127.358 2.263 . . . . 0.0 110.051 177.798 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 33.5 mm-40 -70.04 -49.89 46.75 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.097 -0.956 . . . . 0.0 112.528 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -51.71 -45.8 63.68 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.029 1.286 . . . . 0.0 109.526 178.091 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.26 -42.44 99.34 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 114.582 -1.19 . . . . 0.0 112.242 177.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -57.76 -51.68 68.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 122.825 1.298 . . . . 0.0 112.826 177.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -57.14 -52.06 66.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.173 -0.921 . . . . 0.0 112.566 177.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -59.31 -38.07 79.32 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.164 -0.96 . . . . 0.0 109.651 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -56.01 -51.83 56.91 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 O-C-N 121.078 -1.014 . . . . 0.0 108.831 177.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 81.3 mt -52.65 -45.18 66.59 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 122.664 1.221 . . . . 0.0 109.632 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -66.41 -12.64 58.12 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 117.152 2.279 . . . . 0.0 117.152 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.452 ' CD1' HD11 ' A' ' 22' ' ' LEU . 57.3 mt -60.99 104.11 0.43 Allowed Pre-proline 0 CA--C 1.551 0.994 0 CA-C-N 123.778 2.99 . . . . 0.0 117.104 -177.391 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -63.05 -60.21 0.19 Allowed 'Trans proline' 0 CA--C 1.534 0.479 0 C-N-CA 123.77 2.98 . . . . 0.0 119.752 -177.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.506 HD21 ' HB3' ' A' ' 56' ' ' ALA . 1.3 p-10 -88.51 27.47 1.27 Allowed 'General case' 0 CA--C 1.523 -0.08 0 O-C-N 118.434 -2.666 . . . . 0.0 113.121 -177.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.452 HD11 ' CD1' ' A' ' 19' ' ' LEU . 6.8 tt -102.51 137.47 40.7 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 113.44 -1.709 . . . . 0.0 114.128 177.801 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 12.7 p30 -87.1 151.02 23.58 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 122.515 1.15 . . . . 0.0 112.832 177.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -62.82 -29.23 70.57 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 115.77 1.767 . . . . 0.0 115.77 -177.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -58.86 -51.21 71.01 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 124.186 1.946 . . . . 0.0 109.49 177.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.423 HE22 ' CD1' ' A' ' 22' ' ' LEU . 0.8 OUTLIER -62.64 -47.99 81.32 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 113.398 -1.728 . . . . 0.0 108.467 177.47 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 12.2 tpp180 -47.84 -52.44 19.01 Favored 'General case' 0 C--O 1.22 -0.486 0 O-C-N 121.196 -0.94 . . . . 0.0 111.112 177.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 37.8 t-20 -57.78 -52.05 67.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 113.462 -1.699 . . . . 0.0 111.879 177.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -51.41 -48.27 62.7 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 123.354 1.549 . . . . 0.0 110.425 177.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -64.96 -47.27 78.21 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.999 177.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 28.6 mt -51.01 -39.08 18.88 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-N 120.913 1.688 . . . . 0.0 110.369 176.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.306 5.0 tp60 -67.02 -54.21 23.91 Favored 'General case' 0 N--CA 1.435 -1.177 0 O-C-N 120.668 -1.27 . . . . 0.0 111.546 177.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.2 t -59.63 -35.15 73.82 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 119.986 -1.696 . . . . 0.0 111.67 177.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -60.12 -46.73 88.63 Favored 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 125.605 1.562 . . . . 0.0 107.914 176.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.583 ' HZ2' ' CG ' ' A' ' 36' ' ' ASP . 0.1 OUTLIER -60.81 -39.86 90.56 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 120.986 -1.071 . . . . 0.0 109.748 176.991 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.583 ' CG ' ' HZ2' ' A' ' 35' ' ' LYS . 55.3 m-20 -72.76 -51.3 19.69 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 115.856 1.799 . . . . 0.0 115.856 177.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -105.66 125.68 32.69 Favored Pre-proline 0 CA--C 1.539 0.523 0 O-C-N 117.972 -2.955 . . . . 0.0 114.883 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.42 ' CB ' HD22 ' A' ' 6' ' ' ASN . 77.8 Cg_endo -76.28 -72.93 0.01 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.754 2.303 . . . . 0.0 114.421 177.726 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.428 ' HA ' ' HG3' ' A' ' 8' ' ' GLU . 72.0 m -62.63 -29.47 70.64 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 118.451 -2.655 . . . . 0.0 114.897 -177.391 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.421 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 2.6 mp0 -70.14 -11.27 60.77 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 120.646 -1.284 . . . . 0.0 112.137 177.704 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 25.7 t -43.59 -39.6 3.59 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.945 1.298 . . . . 0.0 113.149 177.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.71 -38.22 72.02 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 120.842 -1.162 . . . . 0.0 111.926 177.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -71.62 -48.67 46.44 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 40' ' ' GLN . 0.7 OUTLIER -54.98 -30.58 59.53 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 123.966 1.841 . . . . 0.0 114.975 177.419 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 13.0 tp -77.24 -54.22 6.76 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-N 113.724 -1.58 . . . . 0.0 108.244 -177.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.88 -35.25 66.3 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 113.684 -1.598 . . . . 0.0 109.027 177.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -67.12 -59.91 3.06 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 114.833 -1.076 . . . . 0.0 112.453 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -51.05 -41.58 59.96 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 121.222 -0.924 . . . . 0.0 112.343 177.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.51 -40.65 96.04 Favored 'General case' 0 C--O 1.241 0.636 0 CA-C-O 122.017 0.913 . . . . 0.0 112.323 177.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.04 -38.44 90.86 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-O 122.595 1.188 . . . . 0.0 108.364 177.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.433 ' C ' HE21 ' A' ' 55' ' ' GLN . 40.9 mt -65.94 -40.84 91.72 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 121.291 -0.88 . . . . 0.0 109.223 177.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -50.34 -52.19 39.12 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 122.468 1.127 . . . . 0.0 108.162 177.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -55.21 -58.68 6.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 112.504 -2.134 . . . . 0.0 110.622 178.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -54.98 -31.23 60.7 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 114.914 1.449 . . . . 0.0 114.914 -177.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.444 HE22 ' HG ' ' A' ' 22' ' ' LEU . 41.8 mt-30 -69.2 -20.56 63.98 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 115.119 1.526 . . . . 0.0 115.119 178.159 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.506 ' HB3' HD21 ' A' ' 21' ' ' ASN . . . -82.9 -53.95 0.58 Allowed Pre-proline 0 C--N 1.326 -0.444 0 N-CA-C 114.546 1.313 . . . . 0.0 114.546 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_endo -79.96 50.94 3.7 Favored 'Trans proline' 0 CA--C 1.535 0.527 1 C-N-CA 125.35 4.033 . . . . 0.0 115.652 -177.8 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.549 ' C ' ' HZ2' ' A' ' 58' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.642 0 CA-C-N 112.358 -2.201 . . . . 0.0 111.278 177.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 75.7 t . . . . . 0 N--CA 1.466 0.347 0 CA-C-O 125.27 2.462 . . . . 0.0 107.983 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.406 ' CG ' ' HZ2' ' A' ' 4' ' ' LYS . 10.4 p-10 -84.74 -138.19 0.06 Allowed 'General case' 0 N--CA 1.442 -0.852 1 CA-C-N 108.205 -4.089 . . . . 0.0 106.205 177.129 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -71.09 -13.96 62.14 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.009 -1.057 . . . . 0.0 110.76 177.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.406 ' HZ2' ' CG ' ' A' ' 2' ' ' ASP . 32.3 mtmm -86.84 144.38 27.05 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 123.557 1.646 . . . . 0.0 112.245 177.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -80.58 107.99 13.84 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 112.977 -1.92 . . . . 0.0 115.576 -177.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -139.09 -53.84 0.57 Allowed 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 177.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 16.5 pttp -71.94 -141.62 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 115.316 1.599 . . . . 0.0 115.316 -177.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.52 -26.24 30.51 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 119.072 -2.267 . . . . 0.0 112.155 -177.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . 0.333 12.5 tt0 -38.67 -49.26 1.55 Allowed 'General case' 0 N--CA 1.432 -1.361 1 C-N-CA 133.004 4.522 . . . . 0.0 109.212 176.797 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -73.53 -46.8 45.53 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 120.833 -1.167 . . . . 0.0 111.989 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -52.1 -47.54 65.19 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 120.064 -1.647 . . . . 0.0 109.691 177.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.406 ' CB ' ' OG ' ' A' ' 41' ' ' SER . . . -59.29 -44.01 92.53 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 113.369 -1.742 . . . . 0.0 111.104 177.22 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -56.68 -53.53 56.63 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 122.95 1.357 . . . . 0.0 112.023 177.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -55.4 -47.9 75.18 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.767 177.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -63.31 -36.69 84.51 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 120.757 -1.214 . . . . 0.0 111.415 177.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -56.8 -44.57 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 125.454 1.502 . . . . 0.0 108.575 177.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 70.6 mt -64.71 -47.66 77.52 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 122.762 1.268 . . . . 0.0 109.591 176.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -58.82 -32.01 69.0 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 116.797 2.147 . . . . 0.0 116.797 -177.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 84.4 mt -53.1 96.35 0.1 OUTLIER Pre-proline 0 CA--C 1.548 0.868 0 N-CA-C 115.891 1.812 . . . . 0.0 115.891 -177.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 0.3 OUTLIER -80.29 3.02 8.01 Favored 'Trans proline' 0 N--CA 1.462 -0.377 0 C-N-CA 123.922 3.081 . . . . 0.0 113.575 -177.523 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.642 HD22 ' HB3' ' A' ' 56' ' ' ALA . 14.3 t30 -132.59 26.66 4.39 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 124.268 1.985 . . . . 0.0 113.377 -177.891 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.4 tt -121.33 146.58 46.7 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 113.39 -1.732 . . . . 0.0 107.805 177.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 23.1 p-10 -71.82 -155.57 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.746 0 O-C-N 119.403 -2.06 . . . . 0.0 115.536 179.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.538 ' H ' ' CD ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -90.58 -66.6 0.91 Allowed 'General case' 0 N--CA 1.443 -0.793 0 O-C-N 120.022 -1.674 . . . . 0.0 114.544 177.374 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -60.5 -37.28 80.6 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 114.501 1.297 . . . . 0.0 114.501 -177.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -64.66 -37.93 89.27 Favored 'General case' 0 C--N 1.347 0.484 0 CA-C-N 123.391 2.814 . . . . 0.0 108.13 177.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.5 ttm-85 -57.7 -49.69 75.67 Favored 'General case' 0 C--O 1.224 -0.268 0 O-C-N 121.703 -0.623 . . . . 0.0 109.907 177.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -54.8 -52.17 63.49 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 114.39 -1.277 . . . . 0.0 112.257 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.88 -50.65 68.19 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 122.652 1.215 . . . . 0.0 110.74 178.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 47.5 m-85 -61.09 -47.86 84.35 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-O 117.798 -1.096 . . . . 0.0 110.446 177.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 34.3 mt -49.07 -50.84 14.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-N 121.222 1.828 . . . . 0.0 110.558 176.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.08 -55.17 25.92 Favored 'General case' 0 N--CA 1.424 -1.763 0 CA-C-O 122.564 1.174 . . . . 0.0 109.919 177.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.9 t -58.56 -31.86 68.38 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 178.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.4 mt -69.01 -43.46 74.77 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 120.574 -1.328 . . . . 0.0 108.27 177.189 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.543 ' HZ2' ' CG ' ' A' ' 36' ' ' ASP . 0.9 OUTLIER -58.22 -37.71 75.38 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.256 177.783 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.543 ' CG ' ' HZ2' ' A' ' 35' ' ' LYS . 12.0 m-20 -84.3 0.15 50.19 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 120.074 -1.642 . . . . 0.0 114.313 176.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -78.9 115.59 53.43 Favored Pre-proline 0 CA--C 1.54 0.593 0 N-CA-C 120.041 3.349 . . . . 0.0 120.041 -177.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_exo -88.86 -21.31 1.34 Allowed 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 124.135 3.223 . . . . 0.0 111.618 177.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 80.1 p -100.24 -88.67 0.35 Allowed 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 115.468 1.655 . . . . 0.0 115.468 -176.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.429 ' O ' HD11 ' A' ' 44' ' ' LEU . 28.5 mm-40 -142.17 91.19 2.31 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 119.311 3.078 . . . . 0.0 119.311 -176.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.406 ' OG ' ' CB ' ' A' ' 12' ' ' ALA . 13.6 t -50.52 -16.8 0.4 Allowed 'General case' 0 N--CA 1.468 0.443 0 O-C-N 120.396 -1.44 . . . . 0.0 109.025 176.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -50.24 -40.35 47.51 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 120.816 1.644 . . . . 0.0 111.581 177.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 17.1 m-80 -67.2 -47.09 71.91 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 123.077 1.418 . . . . 0.0 107.408 -179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.506 ' CD1' ' H ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -60.18 -25.21 65.39 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 116.373 1.99 . . . . 0.0 116.373 177.221 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.3 tp -80.57 -48.73 12.28 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 106.089 -1.819 . . . . 0.0 106.089 -179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.1 -37.87 75.37 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 177.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.44 ' CD ' ' HZ2' ' A' ' 50' ' ' LYS . 74.3 mm-40 -65.29 -52.51 53.67 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 119.326 -0.949 . . . . 0.0 112.076 179.042 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -55.43 -41.77 73.25 Favored 'General case' 0 C--N 1.334 -0.068 0 O-C-N 121.804 -0.56 . . . . 0.0 112.013 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -61.31 -45.97 92.25 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 121.0 0.428 . . . . 0.0 110.149 177.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.44 ' HZ2' ' CD ' ' A' ' 47' ' ' GLU . 50.5 mtpt -57.14 -40.67 77.62 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 123.154 1.454 . . . . 0.0 108.415 -179.108 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.448 ' C ' HE21 ' A' ' 55' ' ' GLN . 73.7 mt -67.3 -47.15 71.43 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 113.775 -1.557 . . . . 0.0 111.698 177.542 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -47.0 -50.7 18.76 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 119.84 -1.788 . . . . 0.0 109.419 177.294 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -58.86 -58.35 9.0 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 111.509 -2.587 . . . . 0.0 109.694 -179.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.34 -26.67 53.39 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.448 HE21 ' C ' ' A' ' 51' ' ' LEU . 41.4 mt-30 -69.05 -24.45 64.17 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.642 ' HB3' HD22 ' A' ' 21' ' ' ASN . . . -81.4 -54.62 0.68 Allowed Pre-proline 0 C--N 1.327 -0.39 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -178.049 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -78.97 51.49 3.87 Favored 'Trans proline' 0 CA--C 1.533 0.465 0 C-N-CA 125.105 3.87 . . . . 0.0 115.959 -177.67 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.545 ' C ' ' HZ2' ' A' ' 58' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.579 0 CA-C-N 112.824 -1.989 . . . . 0.0 111.667 177.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.532 0.262 0 CA-C-O 117.865 -1.064 . . . . 0.0 112.781 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -85.5 -155.85 0.25 Allowed 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 119.129 3.011 . . . . 0.0 119.129 -177.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.455 HD21 ' H ' ' A' ' 3' ' ' ASN . 0.5 OUTLIER -69.19 -24.22 64.02 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 -177.465 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.0 mttp -58.55 -28.26 65.33 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 124.0 1.857 . . . . 0.0 109.359 177.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -99.87 106.8 18.67 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 111.558 -2.565 . . . . 0.0 112.181 -178.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -93.96 -155.01 0.43 Allowed 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.634 -0.666 . . . . 0.0 112.223 177.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.524 ' CG ' ' H ' ' A' ' 8' ' ' GLU . 2.1 pttm -39.01 -89.54 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 119.457 3.132 . . . . 0.0 119.457 -177.064 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.524 ' H ' ' CG ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -57.31 -45.52 84.12 Favored 'General case' 0 C--O 1.225 -0.22 0 O-C-N 118.727 -2.483 . . . . 0.0 110.202 -177.898 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.4 ' O ' HD12 ' A' ' 34' ' ' LEU . 8.4 tt0 -39.88 -49.6 2.42 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 126.904 2.082 . . . . 0.0 110.753 177.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -69.2 -47.79 63.88 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 119.151 -2.218 . . . . 0.0 113.579 177.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -51.91 -44.42 63.82 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 123.854 1.788 . . . . 0.0 109.743 178.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.83 -49.6 76.84 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 112.222 -2.263 . . . . 0.0 111.738 177.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -55.21 -51.36 66.81 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 123.126 1.441 . . . . 0.0 111.804 177.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -57.24 -51.62 68.63 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 114.422 1.268 . . . . 0.0 114.422 177.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -61.51 -37.16 82.67 Favored 'General case' 0 N--CA 1.455 -0.209 0 O-C-N 121.166 -0.958 . . . . 0.0 110.694 178.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 13.1 mt -57.7 -52.97 50.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 O-C-N 121.135 -0.978 . . . . 0.0 108.995 177.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 90.4 mt -50.99 -49.48 60.24 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-O 122.527 1.156 . . . . 0.0 109.602 177.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 -63.87 -14.09 50.43 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 117.06 2.245 . . . . 0.0 117.06 177.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 93.3 mt -54.61 100.8 0.23 Allowed Pre-proline 0 CA--C 1.547 0.835 0 CA-C-N 123.959 3.072 . . . . 0.0 117.005 -177.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -56.76 -41.1 79.19 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 125.038 3.825 . . . . 0.0 116.108 -177.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 66.0 m-80 -104.98 23.63 13.27 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 122.955 1.36 . . . . 0.0 113.666 -177.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.6 tt -115.59 129.3 56.47 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-O 123.125 1.44 . . . . 0.0 110.527 179.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -78.69 145.42 34.56 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 112.888 -1.96 . . . . 0.0 112.695 178.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -48.9 -33.7 11.26 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.125 -1.398 . . . . 0.0 114.649 -177.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -60.56 -49.52 77.21 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 119.606 -1.934 . . . . 0.0 109.966 177.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -63.16 -43.83 97.17 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 177.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 12.7 tpp180 -47.93 -53.23 16.59 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.06 177.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -60.22 -48.32 82.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.938 -1.028 . . . . 0.0 112.15 177.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.89 -50.88 62.99 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 124.342 2.02 . . . . 0.0 111.389 177.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 59.1 m-85 -60.49 -47.72 84.89 Favored 'General case' 0 C--O 1.215 -0.725 0 CA-C-N 112.471 -2.15 . . . . 0.0 109.308 177.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 41.6 mt -56.05 -40.44 63.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 121.679 2.036 . . . . 0.0 111.667 177.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.31 1.7 tp60 -59.13 -55.89 29.25 Favored 'General case' 0 C--O 1.247 0.942 0 O-C-N 119.904 -1.747 . . . . 0.0 111.346 177.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.3 t -66.77 -29.59 69.59 Favored 'General case' 0 C--O 1.215 -0.751 0 C-N-CA 118.912 -1.115 . . . . 0.0 108.98 177.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.448 HD23 HD21 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -57.64 -48.36 79.67 Favored 'General case' 0 N--CA 1.464 0.26 0 O-C-N 118.373 -2.704 . . . . 0.0 111.183 177.65 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.445 ' HZ2' ' CG ' ' A' ' 36' ' ' ASP . 12.6 pttp -68.27 -45.41 73.2 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.405 177.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.445 ' CG ' ' HZ2' ' A' ' 35' ' ' LYS . 97.2 m-20 -74.79 -34.99 62.5 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 117.423 2.379 . . . . 0.0 117.423 -177.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.589 ' HB3' ' CG ' ' A' ' 40' ' ' GLN . 45.2 m-20 -104.72 106.7 55.88 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 126.408 1.883 . . . . 0.0 115.685 -177.678 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 87.7 Cg_endo -69.02 -96.68 0.01 OUTLIER 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.196 2.598 . . . . 0.0 118.225 -177.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.7 m -59.89 -27.12 66.44 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 117.983 -2.948 . . . . 0.0 115.82 -177.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.589 ' CG ' ' HB3' ' A' ' 37' ' ' ASP . 12.1 pm0 -69.89 -12.25 61.48 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.574 -0.704 . . . . 0.0 111.998 177.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 79.8 p -56.6 -22.85 36.77 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 120.124 -1.61 . . . . 0.0 111.17 177.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.91 -41.43 82.65 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 120.112 -1.617 . . . . 0.0 110.145 177.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -68.23 -46.89 69.31 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.448 HD21 HD23 ' A' ' 34' ' ' LEU . 27.7 tp -56.9 -28.63 62.15 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.978 1.37 . . . . 0.0 112.881 177.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.5 tp -78.9 -51.48 9.62 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 -178.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.73 -34.55 62.64 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 114.344 -1.298 . . . . 0.0 107.966 177.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.41 ' CD ' ' HZ1' ' A' ' 50' ' ' LYS . 30.9 mm-40 -65.4 -60.73 2.66 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 115.183 -0.917 . . . . 0.0 112.825 177.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -51.46 -41.81 61.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 122.026 0.917 . . . . 0.0 112.627 178.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -62.87 -47.38 83.6 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.013 177.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.41 ' HZ1' ' CD ' ' A' ' 47' ' ' GLU . 0.1 OUTLIER -63.7 -35.26 79.99 Favored 'General case' 0 C--N 1.342 0.255 0 O-C-N 120.73 -1.231 . . . . 0.0 109.133 -177.606 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.0 mt -65.63 -51.73 57.37 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 119.818 -0.753 . . . . 0.0 109.048 177.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -46.71 -48.62 20.22 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 123.609 1.671 . . . . 0.0 110.583 179.219 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -60.51 -46.61 89.51 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 112.571 -2.104 . . . . 0.0 110.87 177.716 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.14 -44.74 75.37 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 120.954 -1.091 . . . . 0.0 110.333 177.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.08 -23.05 63.0 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 115.769 1.766 . . . . 0.0 115.769 177.696 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -62.45 167.46 5.39 Favored Pre-proline 0 CA--C 1.541 0.603 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -79.31 148.44 21.13 Favored 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 123.122 2.548 . . . . 0.0 113.64 177.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.299 0 O-C-N 120.674 -1.266 . . . . 0.0 113.133 177.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.502 HG12 HD22 ' A' ' 6' ' ' ASN . 5.5 m . . . . . 0 C--O 1.235 0.3 0 CA-C-O 121.127 0.489 . . . . 0.0 111.442 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -65.52 -92.82 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.579 1.152 . . . . 0.0 109.539 177.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -126.56 -22.37 3.96 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 125.3 1.44 . . . . 0.0 110.781 177.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.61 122.97 41.3 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 177.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -69.78 161.75 29.2 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 114.883 1.438 . . . . 0.0 114.883 178.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.502 HD22 HG12 ' A' ' 1' ' ' VAL . 5.5 m-80 -94.3 173.3 7.7 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.774 0.797 . . . . 0.0 111.791 177.583 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.524 ' HG2' ' H ' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -53.56 -84.28 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 115.109 1.522 . . . . 0.0 115.109 -177.888 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.524 ' H ' ' HG2' ' A' ' 7' ' ' LYS . 0.9 OUTLIER -44.77 -43.55 8.65 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 123.288 1.518 . . . . 0.0 111.838 178.053 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.44 ' CD ' HD21 ' A' ' 6' ' ' ASN . 9.8 tt0 -43.27 -49.16 6.76 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 113.143 -1.844 . . . . 0.0 112.736 177.461 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 35.1 mm-40 -66.88 -38.45 86.31 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 120.729 -0.388 . . . . 0.0 111.924 177.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -58.8 -47.45 84.73 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.152 -1.593 . . . . 0.0 109.045 177.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.5 -39.32 83.43 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 113.907 -1.497 . . . . 0.0 110.11 177.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -56.48 -53.52 56.56 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 123.284 1.516 . . . . 0.0 109.725 177.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 39.2 m-85 -56.24 -43.53 78.73 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.143 -1.389 . . . . 0.0 110.647 176.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -60.27 -40.09 89.14 Favored 'General case' 0 C--N 1.332 -0.16 0 O-C-N 121.118 -0.989 . . . . 0.0 111.805 177.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.1 mt -58.33 -51.92 65.47 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-O 122.374 1.083 . . . . 0.0 108.489 177.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.42 ' HA ' ' NH1' ' A' ' 27' ' ' ARG . 59.2 mt -59.87 -36.44 76.92 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 122.465 1.126 . . . . 0.0 112.645 177.423 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 22.6 t-160 -69.97 -11.66 61.04 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.624 1.57 . . . . 0.0 112.734 177.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 99.7 mt -62.36 124.85 84.2 Favored Pre-proline 0 CA--C 1.543 0.678 0 O-C-N 119.657 -1.902 . . . . 0.0 114.086 -178.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -70.02 -38.32 7.38 Favored 'Trans proline' 0 CA--C 1.531 0.375 0 C-N-CA 123.732 2.955 . . . . 0.0 117.611 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -103.45 -15.16 15.97 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 126.102 2.858 . . . . 0.0 115.551 -177.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 4.6 tt -90.92 123.37 34.38 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 110.103 -3.226 . . . . 0.0 107.019 177.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.7 p30 -151.5 -34.34 0.14 Allowed 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 118.088 2.625 . . . . 0.0 118.088 -176.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.651 ' H ' ' CD ' ' A' ' 24' ' ' GLU 0.254 0.0 OUTLIER -75.0 -132.66 0.01 OUTLIER 'General case' 0 N--CA 1.432 -1.342 0 CA-C-O 127.384 3.469 . . . . 0.0 116.162 -177.214 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.459 ' H ' ' CG ' ' A' ' 24' ' ' GLU . 13.1 mm-40 -68.0 -26.33 65.85 Favored 'General case' 0 C--N 1.315 -0.902 1 CA-C-N 107.879 -4.237 . . . . 0.0 112.728 -177.377 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.449 HE22 ' CD ' ' A' ' 55' ' ' GLN . 22.0 mt-30 -69.51 -50.15 47.86 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 104.803 -2.295 . . . . 0.0 104.803 177.672 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.42 ' NH1' ' HA ' ' A' ' 17' ' ' LEU . 3.0 tpp85 -48.24 -51.72 24.27 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 114.521 -1.218 . . . . 0.0 110.805 177.513 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -59.81 -51.43 69.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 113.618 -1.628 . . . . 0.0 112.788 177.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.44 -44.11 76.04 Favored 'General case' 0 CA--C 1.528 0.113 0 O-C-N 121.136 -0.978 . . . . 0.0 110.861 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -67.28 -48.88 66.36 Favored 'General case' 0 N--CA 1.452 -0.369 0 O-C-N 121.457 -0.777 . . . . 0.0 110.226 176.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 11.2 mt -52.07 -46.92 43.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 O-C-N 119.516 -1.99 . . . . 0.0 112.547 177.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.305 0.0 OUTLIER -63.98 -49.0 74.2 Favored 'General case' 0 N--CA 1.436 -1.133 0 C-N-CA 124.914 1.285 . . . . 0.0 110.196 177.796 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.6 t -58.28 -37.07 74.27 Favored 'General case' 0 C--O 1.217 -0.616 0 O-C-N 120.978 -1.076 . . . . 0.0 109.842 177.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.8 mp -65.74 -41.18 92.48 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 121.199 1.818 . . . . 0.0 107.92 176.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.77 -42.15 71.36 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 120.203 -1.561 . . . . 0.0 110.345 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -84.0 -27.77 28.17 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 116.998 2.222 . . . . 0.0 116.998 177.486 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -79.45 160.12 70.77 Favored Pre-proline 0 C--O 1.239 0.518 0 N-CA-C 116.992 2.219 . . . . 0.0 116.992 -178.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -102.38 -92.66 0.0 OUTLIER 'Trans proline' 0 CA--C 1.544 1.004 0 C-N-CA 123.199 2.599 . . . . 0.0 110.937 176.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.0 t -102.08 -11.11 19.11 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 119.499 -2.001 . . . . 0.0 115.337 177.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.2 mp0 -68.53 -8.93 45.74 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 118.12 -2.863 . . . . 0.0 114.946 -177.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.424 ' HA ' ' CG ' ' A' ' 44' ' ' LEU . 61.8 m -42.95 -35.02 1.08 Allowed 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 125.26 1.424 . . . . 0.0 112.384 177.05 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -51.57 -39.96 58.85 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 123.544 1.64 . . . . 0.0 112.962 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -72.13 -46.63 55.81 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 122.677 1.227 . . . . 0.0 107.76 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.424 ' CG ' ' HA ' ' A' ' 41' ' ' SER . 0.8 OUTLIER -56.73 -29.33 62.4 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 124.609 2.147 . . . . 0.0 113.588 177.234 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 52.2 tp -77.11 -51.11 11.58 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 112.766 -2.015 . . . . 0.0 106.474 -178.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.7 -33.19 60.57 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 122.672 1.225 . . . . 0.0 108.31 176.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -64.55 -61.6 2.11 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 114.783 -1.099 . . . . 0.0 111.935 177.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -51.58 -38.05 52.66 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.963 0.887 . . . . 0.0 112.014 177.64 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -65.25 -43.89 89.89 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 121.675 0.75 . . . . 0.0 110.054 177.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.77 -39.95 95.78 Favored 'General case' 0 C--O 1.233 0.216 0 O-C-N 120.452 -1.405 . . . . 0.0 108.606 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 64.3 mt -62.88 -54.94 30.98 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 121.74 0.781 . . . . 0.0 109.707 177.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -44.82 -44.86 9.78 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 124.029 1.871 . . . . 0.0 111.466 -178.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -67.08 -46.66 73.61 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 111.702 -2.499 . . . . 0.0 111.751 177.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.61 -46.45 77.36 Favored 'General case' 0 C--O 1.233 0.204 0 O-C-N 120.942 -1.099 . . . . 0.0 111.444 177.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.449 ' CD ' HE22 ' A' ' 26' ' ' GLN . 5.7 pm0 -84.98 14.13 5.26 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 177.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.54 158.02 74.11 Favored Pre-proline 0 CA--C 1.534 0.359 0 O-C-N 119.83 -1.794 . . . . 0.0 111.234 177.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -70.33 69.74 1.94 Allowed 'Trans proline' 0 CA--C 1.537 0.675 0 C-N-CA 124.404 3.403 . . . . 0.0 115.894 -178.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.536 0.411 0 C-N-CA 124.938 1.295 . . . . 0.0 112.822 177.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 33.5 m . . . . . 0 CA--C 1.529 0.154 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.464 ' CG ' ' H ' ' A' ' 3' ' ' ASN . 5.9 p-10 -77.68 -91.27 0.04 OUTLIER 'General case' 0 N--CA 1.445 -0.724 0 O-C-N 119.574 -1.954 . . . . 0.0 109.29 177.392 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.464 ' H ' ' CG ' ' A' ' 2' ' ' ASP . 24.3 m120 -132.63 5.81 4.01 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 177.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -52.58 -55.72 20.28 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 122.829 2.559 . . . . 0.0 114.121 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.501 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 14.3 m-85 -76.7 -178.78 4.96 Favored 'General case' 0 C--O 1.238 0.458 0 O-C-N 121.386 -0.821 . . . . 0.0 110.681 177.571 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -67.69 175.81 2.76 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 118.824 2.898 . . . . 0.0 118.824 -176.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.548 ' H ' ' HD3' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -55.27 -77.77 0.02 OUTLIER 'General case' 0 C--O 1.238 0.488 0 C-N-CA 126.999 2.12 . . . . 0.0 115.35 -177.485 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.65 -46.6 58.49 Favored 'General case' 0 C--O 1.22 -0.456 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 177.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.514 HE21 ' CG ' ' A' ' 37' ' ' ASP 0.266 1.4 tm0? -39.42 -61.06 0.84 Allowed 'General case' 0 N--CA 1.432 -1.343 0 C-N-CA 127.261 2.224 . . . . 0.0 113.024 176.802 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -59.79 -37.15 78.32 Favored 'General case' 0 C--O 1.233 0.199 0 O-C-N 120.227 -1.545 . . . . 0.0 111.409 177.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.26 -46.62 88.03 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.97 0.89 . . . . 0.0 109.194 177.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.62 -37.03 85.78 Favored 'General case' 0 C--O 1.211 -0.932 0 C-N-CA 124.097 0.959 . . . . 0.0 109.142 177.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -54.23 -55.5 27.51 Favored 'General case' 0 C--O 1.237 0.416 0 O-C-N 119.708 -1.87 . . . . 0.0 108.723 177.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -58.21 -45.97 86.67 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 113.165 -1.834 . . . . 0.0 112.202 176.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.24 -43.42 74.55 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 123.039 1.4 . . . . 0.0 111.597 177.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -58.65 -52.91 54.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 C-N-CA 126.537 1.935 . . . . 0.0 109.94 178.063 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 49.5 mt -62.62 -36.17 81.91 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 122.098 0.952 . . . . 0.0 113.043 177.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 6.3 t-80 -62.6 -21.51 65.69 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 127.487 2.315 . . . . 0.0 116.14 177.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.442 HD11 ' HB2' ' A' ' 52' ' ' ASN . 21.6 mt -63.08 105.63 0.7 Allowed Pre-proline 0 C--N 1.328 -0.34 0 N-CA-C 118.315 2.709 . . . . 0.0 118.315 -176.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -72.81 -1.95 11.19 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 123.024 2.483 . . . . 0.0 112.64 178.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 36.2 p-10 -132.94 27.41 4.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 122.794 1.283 . . . . 0.0 114.3 178.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.43 HD23 HD13 ' A' ' 19' ' ' LEU . 7.2 tt -160.02 111.82 2.01 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 122.947 1.356 . . . . 0.0 109.203 177.267 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -154.82 2.94 0.21 Allowed 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 117.249 2.315 . . . . 0.0 117.249 -177.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.697 ' H ' ' CD ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -87.16 -132.88 0.07 Allowed 'General case' 0 N--CA 1.418 -2.05 0 CA-C-O 125.485 2.564 . . . . 0.0 112.796 -177.59 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.417 ' H ' ' CG ' ' A' ' 24' ' ' GLU . 0.4 OUTLIER -76.3 -22.07 55.47 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 109.49 -3.504 . . . . 0.0 114.086 -177.227 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.424 ' NE2' ' NE2' ' A' ' 55' ' ' GLN . 27.2 mt-30 -73.86 -48.99 27.19 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 105.251 -2.129 . . . . 0.0 105.251 177.392 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.444 ' HB3' ' CZ ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -56.4 -48.36 77.09 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-N 114.698 -1.137 . . . . 0.0 110.543 177.413 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 73.0 m-20 -59.97 -47.74 84.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 113.724 -1.58 . . . . 0.0 111.809 177.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.57 -48.09 78.13 Favored 'General case' 0 C--N 1.333 -0.13 0 O-C-N 121.089 -1.007 . . . . 0.0 110.087 178.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -61.99 -47.46 84.69 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 121.633 -0.667 . . . . 0.0 110.679 177.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 1.6 mt -52.42 -44.81 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 O-C-N 119.111 -2.243 . . . . 0.0 110.405 177.098 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.271 5.1 tp60 -60.92 -48.2 82.89 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 123.867 0.867 . . . . 0.0 110.383 177.456 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.6 t -65.13 -28.29 69.32 Favored 'General case' 0 C--O 1.225 -0.208 0 O-C-N 121.337 -0.852 . . . . 0.0 111.714 177.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.7 mp -78.67 -24.61 45.03 Favored 'General case' 0 N--CA 1.445 -0.69 0 O-C-N 119.857 -1.777 . . . . 0.0 108.432 176.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.501 ' HA ' ' CE2' ' A' ' 5' ' ' PHE . 1.1 pttm -69.09 -54.09 16.84 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 102.375 -3.194 . . . . 0.0 102.375 176.067 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.454 ' CG ' ' HZ2' ' A' ' 35' ' ' LYS . 70.3 m-20 -91.31 70.13 6.06 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-O 124.086 1.898 . . . . 0.0 108.581 177.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.514 ' CG ' HE21 ' A' ' 9' ' ' GLN . 24.4 t0 -75.28 115.65 47.13 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 111.482 -2.599 . . . . 0.0 115.068 -177.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 0.2 OUTLIER -97.19 -121.02 0.0 OUTLIER 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 125.246 3.964 . . . . 0.0 114.532 177.916 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.5 p -102.5 -59.72 1.66 Allowed 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 117.63 2.456 . . . . 0.0 117.63 179.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.1 pm0 -69.95 32.51 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 119.269 3.063 . . . . 0.0 119.269 -176.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.495 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 18.9 m -52.4 -39.39 60.84 Favored 'General case' 0 N--CA 1.475 0.775 0 O-C-N 119.279 -2.138 . . . . 0.0 113.62 178.609 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.8 -38.6 72.79 Favored 'General case' 0 CA--C 1.538 0.488 0 O-C-N 120.297 -1.502 . . . . 0.0 109.092 176.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -64.94 -55.21 20.54 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 104.339 -2.467 . . . . 0.0 104.339 177.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.495 ' HG ' ' HA ' ' A' ' 41' ' ' SER . 2.1 mt -48.37 -28.36 3.14 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 177.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 13.4 tp -74.89 -54.45 7.23 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 -178.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.17 -35.48 69.61 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 113.506 -1.679 . . . . 0.0 110.598 177.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -64.47 -62.01 1.86 Allowed 'General case' 0 C--O 1.237 0.435 0 CA-C-O 122.685 1.231 . . . . 0.0 111.125 -178.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -51.96 -43.13 63.4 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 123.457 1.599 . . . . 0.0 111.02 177.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 35.7 tptt -58.94 -41.9 88.52 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.197 -1.365 . . . . 0.0 110.947 177.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.34 -38.45 91.18 Favored 'General case' 0 N--CA 1.457 -0.077 0 O-C-N 120.399 -1.438 . . . . 0.0 108.591 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 71.5 mt -59.6 -49.65 76.95 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 122.904 1.335 . . . . 0.0 110.418 177.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.563 HD21 ' C ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -50.68 -49.75 56.55 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-O 124.156 1.932 . . . . 0.0 112.51 177.366 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -62.39 -49.12 76.77 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 111.643 -2.526 . . . . 0.0 111.379 177.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.9 -44.77 86.98 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 121.25 -0.906 . . . . 0.0 113.01 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.424 ' NE2' ' NE2' ' A' ' 26' ' ' GLN . 29.8 pt20 -80.09 8.87 6.31 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 177.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -75.29 -177.69 0.73 Allowed Pre-proline 0 CA--C 1.546 0.817 0 O-C-N 119.945 -1.722 . . . . 0.0 113.201 177.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -72.27 58.92 3.03 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 124.434 3.423 . . . . 0.0 115.157 177.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.555 ' C ' ' HZ2' ' A' ' 58' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.515 0 C-N-CA 125.383 1.473 . . . . 0.0 112.28 -179.419 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' VAL . . . . . 0.46 ' N ' ' OD1' ' A' ' 6' ' ' ASN . 6.8 t . . . . . 0 CA--C 1.532 0.261 0 CA-C-O 117.1 -1.428 . . . . 0.0 110.633 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.36 -160.79 0.16 Allowed 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 123.619 2.918 . . . . 0.0 113.629 -177.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -69.68 -26.51 64.41 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 119.091 -2.255 . . . . 0.0 112.943 177.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -85.9 -60.49 2.0 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 113.912 -1.495 . . . . 0.0 112.564 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.444 ' CZ ' ' HA ' ' A' ' 35' ' ' LYS . 5.9 m-30 -70.53 62.29 0.25 Allowed 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 117.008 2.225 . . . . 0.0 117.008 -177.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.46 ' OD1' ' N ' ' A' ' 1' ' ' VAL . 77.3 m-20 -150.26 -40.96 0.13 Allowed 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 125.822 1.649 . . . . 0.0 111.787 177.45 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.416 ' HZ1' ' CD ' ' A' ' 8' ' ' GLU . 20.3 pttp -88.26 -150.44 0.18 Allowed 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 117.032 2.234 . . . . 0.0 117.032 -177.432 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.416 ' CD ' ' HZ1' ' A' ' 7' ' ' LYS . 0.4 OUTLIER -52.85 -29.63 29.06 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 120.478 -1.389 . . . . 0.0 113.469 -177.166 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.418 ' NE2' ' O ' ' A' ' 34' ' ' LEU 0.314 3.0 tm0? -38.06 -52.32 1.4 Allowed 'General case' 0 N--CA 1.425 -1.687 0 C-N-CA 128.537 2.735 . . . . 0.0 111.815 177.655 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 48.0 mm-40 -72.82 -31.37 64.75 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.06 -0.973 . . . . 0.0 112.073 -178.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -64.81 -45.36 86.58 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 177.425 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.7 -42.46 98.97 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-O 121.153 0.502 . . . . 0.0 110.566 177.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -55.45 -50.83 68.81 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 123.672 1.701 . . . . 0.0 111.716 177.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -60.5 -46.89 88.47 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 113.876 -1.511 . . . . 0.0 111.007 177.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.402 ' CD ' ' HZ3' ' A' ' 49' ' ' LYS . 0.7 OUTLIER -55.62 -41.84 74.06 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 122.753 1.264 . . . . 0.0 108.886 177.648 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -57.14 -56.65 13.66 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 177.079 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 69.6 mt -55.79 -28.9 58.48 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 122.883 1.325 . . . . 0.0 113.521 177.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -72.26 -13.2 61.45 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.544 1.538 . . . . 0.0 113.522 177.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 80.8 mt -55.13 119.76 25.15 Favored Pre-proline 0 CA--C 1.544 0.741 0 O-C-N 119.985 -1.697 . . . . 0.0 112.093 177.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -73.86 -11.17 23.65 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 125.129 3.886 . . . . 0.0 118.795 -177.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.474 HD22 ' HB1' ' A' ' 56' ' ' ALA . 4.4 p-10 -155.45 58.93 0.63 Allowed 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 124.27 1.986 . . . . 0.0 112.737 177.971 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.6 tt -160.28 123.0 3.36 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 112.139 -2.3 . . . . 0.0 108.269 177.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -154.33 -13.29 0.13 Allowed 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 117.061 2.245 . . . . 0.0 117.061 -177.753 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.669 ' H ' ' CD ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -75.89 -132.3 0.01 OUTLIER 'General case' 0 N--CA 1.425 -1.701 0 CA-C-O 125.911 2.767 . . . . 0.0 113.283 -177.478 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.414 ' H ' ' CG ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -66.07 -27.32 67.99 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 109.69 -3.414 . . . . 0.0 115.159 -177.072 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.582 HE22 ' NE2' ' A' ' 55' ' ' GLN . 16.1 mt-30 -74.1 -52.97 10.96 Favored 'General case' 0 N--CA 1.441 -0.896 0 N-CA-C 105.653 -1.98 . . . . 0.0 105.653 177.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -48.93 -49.11 41.77 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 124.355 2.026 . . . . 0.0 111.665 177.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -55.73 -58.49 7.63 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 109.59 -3.459 . . . . 0.0 111.719 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.6 -46.57 88.55 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 121.599 -0.688 . . . . 0.0 111.324 -178.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -61.5 -46.33 90.43 Favored 'General case' 0 C--O 1.219 -0.502 0 O-C-N 121.188 -0.945 . . . . 0.0 109.859 177.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 29.4 mt -54.62 -51.66 48.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-N 121.425 1.92 . . . . 0.0 110.775 177.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.37 -56.6 9.06 Favored 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 125.88 1.672 . . . . 0.0 111.501 177.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.0 t -63.3 -30.78 71.86 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 112.205 -2.271 . . . . 0.0 111.506 178.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.418 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 1.4 mm? -65.5 -45.0 85.28 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 105.875 -1.898 . . . . 0.0 105.875 177.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . 0.581 ' HZ2' ' CG ' ' A' ' 36' ' ' ASP . 0.0 OUTLIER -60.17 -42.21 94.5 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 119.958 -1.714 . . . . 0.0 110.709 177.419 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.581 ' CG ' ' HZ2' ' A' ' 35' ' ' LYS . 45.4 m-20 -70.97 -46.27 62.62 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 117.503 2.408 . . . . 0.0 117.503 177.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -79.64 142.3 57.18 Favored Pre-proline 0 CA--C 1.531 0.232 0 N-CA-C 119.575 3.176 . . . . 0.0 119.575 -178.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.432 ' HG2' ' H ' ' A' ' 39' ' ' SER . 89.1 Cg_endo -86.51 -74.35 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.098 1.865 . . . . 0.0 110.323 176.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.432 ' H ' ' HG2' ' A' ' 38' ' ' PRO . 61.0 m -102.25 -18.34 15.52 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 120.689 3.589 . . . . 0.0 120.689 -177.738 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -70.79 -9.71 58.0 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 125.866 3.939 . . . . 0.0 114.296 -177.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 74.9 m -43.87 -29.13 0.51 Allowed 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 125.664 1.586 . . . . 0.0 114.214 177.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.19 -44.43 97.3 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 124.195 1.95 . . . . 0.0 109.572 177.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -71.37 -52.73 17.07 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 105.15 -2.167 . . . . 0.0 105.15 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.1 mt -51.45 -29.51 16.4 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 123.834 1.778 . . . . 0.0 114.69 177.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 63.0 tp -74.46 -50.67 17.4 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 -177.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.8 -37.98 71.9 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 113.821 -1.536 . . . . 0.0 107.497 177.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -63.63 -52.52 60.46 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 119.498 -0.881 . . . . 0.0 110.992 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -54.42 -40.73 68.56 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 122.428 1.108 . . . . 0.0 111.417 177.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.402 ' HZ3' ' CD ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -63.96 -41.49 97.55 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 121.115 -0.991 . . . . 0.0 110.509 177.288 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -61.89 -39.07 90.68 Favored 'General case' 0 CA--C 1.519 -0.241 0 O-C-N 121.105 -0.997 . . . . 0.0 108.7 177.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 53.4 mt -62.3 -45.58 92.61 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 122.141 0.972 . . . . 0.0 110.454 177.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -59.21 -49.61 77.17 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 119.498 -2.001 . . . . 0.0 110.668 177.552 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -52.91 -42.75 65.66 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 124.999 1.319 . . . . 0.0 111.31 177.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.01 -30.47 70.32 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.527 -0.733 . . . . 0.0 111.74 177.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.582 ' NE2' HE22 ' A' ' 26' ' ' GLN . 40.0 mt-30 -82.53 -34.31 27.92 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 123.025 1.393 . . . . 0.0 111.994 177.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.474 ' HB1' HD22 ' A' ' 21' ' ' ASN . . . -67.89 138.37 92.8 Favored Pre-proline 0 CA--C 1.542 0.645 0 CA-C-N 114.784 -1.098 . . . . 0.0 113.378 177.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -45.29 166.98 0.05 OUTLIER 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 125.251 3.967 . . . . 0.0 118.261 179.127 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm . . . . . 0 CA--C 1.534 0.331 0 CA-C-N 114.164 -1.38 . . . . 0.0 110.279 -177.823 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.452 -0.329 0 CA-C-O 121.958 0.885 . . . . 0.0 110.962 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . 0.266 7.6 tt0 -45.95 -55.56 6.63 Favored 'General case' 0 N--CA 1.425 -1.702 0 C-N-CA 127.609 2.364 . . . . 0.0 110.925 177.76 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.1 mm100 -70.04 -45.3 67.44 Favored 'General case' 0 CA--C 1.512 -0.486 0 O-C-N 118.743 -2.473 . . . . 0.0 112.894 177.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -50.57 -49.05 57.24 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 123.788 1.756 . . . . 0.0 111.39 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.543 ' HA ' HD22 ' A' ' 45' ' ' LEU . . . -61.17 -43.53 98.74 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 111.166 -2.743 . . . . 0.0 110.801 177.47 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -54.79 -51.37 65.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 123.36 1.552 . . . . 0.0 111.556 177.547 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -58.59 -55.84 29.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 113.16 -1.836 . . . . 0.0 111.033 177.368 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -53.52 -37.87 63.2 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 123.64 1.686 . . . . 0.0 110.1 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.457 ' O ' ' NH1' ' A' ' 27' ' ' ARG . 1.6 mt -61.24 -60.69 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 177.161 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 96.2 mt -53.12 -35.81 60.08 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 121.294 1.861 . . . . 0.0 113.318 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -61.8 -19.64 62.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 112.9 -1.954 . . . . 0.0 114.072 177.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.489 ' HB2' HH11 ' A' ' 27' ' ' ARG . 70.5 mt -59.45 115.28 11.83 Favored Pre-proline 0 CA--C 1.537 0.445 0 O-C-N 120.661 -1.274 . . . . 0.0 111.196 177.83 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -80.57 -13.79 11.86 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 123.61 2.873 . . . . 0.0 115.592 -177.658 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.552 HD22 HD21 ' A' ' 52' ' ' ASN . 11.7 p30 -139.38 40.35 2.07 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 125.612 2.625 . . . . 0.0 113.536 -178.569 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.458 HD11 ' HB2' ' A' ' 26' ' ' GLN . 7.8 tt -149.7 121.84 8.32 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 103.849 -2.649 . . . . 0.0 103.849 177.28 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.454 ' HA ' ' HE ' ' A' ' 27' ' ' ARG . 6.4 t30 -153.35 -19.32 0.15 Allowed 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 -177.261 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.647 ' H ' ' CD ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -73.36 -133.04 0.01 OUTLIER 'General case' 0 N--CA 1.424 -1.774 0 CA-C-O 126.052 2.834 . . . . 0.0 113.128 -177.54 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.34 -30.8 70.74 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 109.028 -3.715 . . . . 0.0 114.637 -177.017 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.458 ' HB2' HD11 ' A' ' 22' ' ' LEU . 29.5 mt-30 -69.68 -50.71 41.25 Favored 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 177.607 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.489 HH11 ' HB2' ' A' ' 19' ' ' LEU . 2.1 tpp180 -50.77 -48.43 59.29 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 122.277 1.037 . . . . 0.0 110.898 177.61 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 28.0 m120 -57.19 -54.0 51.72 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 114.005 -1.452 . . . . 0.0 111.672 177.524 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.41 -47.42 75.94 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-O 121.654 0.74 . . . . 0.0 110.595 -178.728 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.424 ' CD2' ' HB2' ' A' ' 48' ' ' ALA . 50.0 m-85 -61.9 -47.89 82.94 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 118.139 -0.934 . . . . 0.0 110.566 177.41 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 84.2 mt -54.44 -46.05 70.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-N 121.877 2.126 . . . . 0.0 110.247 177.101 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.31 5.7 tp60 -56.61 -50.64 71.39 Favored 'General case' 0 N--CA 1.44 -0.952 0 C-N-CA 124.798 1.239 . . . . 0.0 112.146 178.328 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 20.2 t -63.09 -42.01 99.51 Favored 'General case' 0 C--O 1.217 -0.611 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -58.56 -38.43 77.85 Favored 'General case' 0 CA--C 1.529 0.172 0 O-C-N 120.106 -1.621 . . . . 0.0 111.92 177.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.9 ttpm? -68.15 -43.88 77.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 113.624 -1.626 . . . . 0.0 113.574 177.589 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -88.53 -42.44 12.08 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 116.823 2.157 . . . . 0.0 116.823 177.868 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -96.11 133.49 25.08 Favored Pre-proline 0 CA--C 1.543 0.691 0 N-CA-C 118.717 2.858 . . . . 0.0 118.717 -177.431 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -71.14 -83.48 0.01 OUTLIER 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 124.287 3.324 . . . . 0.0 116.08 177.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.3 m -100.74 -11.24 20.08 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 118.407 2.744 . . . . 0.0 118.407 -177.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -69.46 -36.21 76.36 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 125.477 3.762 . . . . 0.0 111.529 -177.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.507 ' HA ' ' CG ' ' A' ' 44' ' ' LEU . 60.3 m -49.84 -27.1 4.64 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 112.244 -2.253 . . . . 0.0 113.969 -179.183 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.431 ' O ' ' HB3' ' A' ' 45' ' ' LEU . . . -60.98 -36.86 80.56 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 121.748 2.067 . . . . 0.0 112.364 177.652 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -65.9 -41.88 90.92 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 125.28 2.467 . . . . 0.0 106.739 177.479 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.507 ' CG ' ' HA ' ' A' ' 41' ' ' SER . 0.7 OUTLIER -66.21 -21.79 66.32 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 112.455 -2.157 . . . . 0.0 112.972 177.122 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.543 HD22 ' HA ' ' A' ' 12' ' ' ALA . 14.8 tp -70.93 -49.25 47.71 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 104.597 -2.371 . . . . 0.0 104.597 177.272 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.79 -37.81 69.08 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 113.262 -1.79 . . . . 0.0 106.679 176.682 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -64.11 -49.96 70.15 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 118.416 -1.314 . . . . 0.0 112.447 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.424 ' HB2' ' CD2' ' A' ' 30' ' ' PHE . . . -52.68 -44.94 66.57 Favored 'General case' 0 C--O 1.236 0.378 0 O-C-N 120.293 -1.505 . . . . 0.0 111.454 177.395 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 25.6 tptp -61.11 -44.82 96.76 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 121.432 -0.793 . . . . 0.0 111.641 177.6 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 21.6 mmmt -66.56 -28.62 68.67 Favored 'General case' 0 CA--C 1.511 -0.553 0 O-C-N 121.072 -1.017 . . . . 0.0 110.609 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.436 ' HA ' HD23 ' A' ' 51' ' ' LEU . 37.1 mt -66.58 -46.81 74.75 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 122.539 1.161 . . . . 0.0 108.454 176.667 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.552 HD21 HD22 ' A' ' 21' ' ' ASN . 0.7 OUTLIER -49.3 -51.31 34.81 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 124.633 2.158 . . . . 0.0 108.067 177.427 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -60.63 -40.04 90.48 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 112.076 -2.329 . . . . 0.0 111.778 177.698 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.45 -44.35 89.18 Favored 'General case' 0 CA--C 1.517 -0.307 0 O-C-N 120.182 -1.574 . . . . 0.0 111.724 177.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.404 ' NE2' ' HA ' ' A' ' 52' ' ' ASN . 1.8 pm0 -74.48 -50.67 17.34 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 116.977 -1.889 . . . . 0.0 110.923 177.203 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.437 ' HB3' ' OD1' ' A' ' 21' ' ' ASN . . . . . . . . 0 CA--C 1.553 1.062 0 N-CA-C 114.514 1.302 . . . . 0.0 114.514 177.614 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.461 0.096 0 CA-C-O 123.458 1.599 . . . . 0.0 108.559 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . 0.274 8.2 tt0 -43.38 -45.41 6.12 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 127.655 2.382 . . . . 0.0 110.778 177.372 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -73.21 -44.63 59.36 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 112.877 -1.965 . . . . 0.0 113.473 178.046 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 18.8 t30 -54.71 -47.19 74.04 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-O 123.857 1.789 . . . . 0.0 108.931 177.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.424 ' CB ' HD22 ' A' ' 45' ' ' LEU . . . -57.9 -48.05 81.01 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 111.678 -2.51 . . . . 0.0 111.307 177.741 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -55.29 -41.62 72.53 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 124.253 1.978 . . . . 0.0 111.949 177.445 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -62.71 -52.35 63.59 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 112.955 -1.929 . . . . 0.0 110.426 177.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -53.06 -42.88 66.23 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 122.178 0.989 . . . . 0.0 109.648 177.221 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.435 ' O ' ' HD2' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -54.29 -59.47 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.159 0 CA-C-N 114.563 -1.199 . . . . 0.0 109.636 177.496 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 35.0 mt -49.69 -49.4 47.74 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.902 0.858 . . . . 0.0 111.377 177.683 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -61.5 -10.84 8.66 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 113.608 -1.633 . . . . 0.0 115.347 178.609 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 75.7 mt -58.56 104.72 0.45 Allowed Pre-proline 0 CA--C 1.541 0.617 0 CA-C-N 122.307 2.322 . . . . 0.0 111.26 177.865 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -82.08 -4.17 11.82 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 124.191 3.261 . . . . 0.0 116.657 -177.025 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -140.64 44.15 1.84 Allowed 'General case' 0 N--CA 1.456 -0.157 0 CA-C-O 123.309 1.528 . . . . 0.0 112.485 177.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.405 ' HB2' ' HB2' ' A' ' 52' ' ' ASN . 1.7 tt -126.94 137.93 53.2 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 113.333 -1.758 . . . . 0.0 106.679 177.319 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -67.82 131.49 45.64 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 124.141 1.924 . . . . 0.0 113.698 -177.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -40.59 -45.48 2.32 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 112.983 -1.917 . . . . 0.0 114.778 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.533 ' CD ' ' H ' ' A' ' 25' ' ' GLU . 16.1 mp0 -55.79 -55.25 34.61 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 123.247 1.498 . . . . 0.0 111.2 177.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.431 ' NE2' ' HB3' ' A' ' 51' ' ' LEU . 35.0 tt0 -59.06 -38.97 80.68 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.305 177.18 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.435 ' HD2' ' O ' ' A' ' 16' ' ' ILE . 0.0 OUTLIER -56.62 -50.73 71.16 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 120.731 -1.231 . . . . 0.0 108.123 176.963 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 46.9 m-80 -57.99 -46.14 85.68 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 177.388 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.16 -47.51 78.11 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 122.117 0.961 . . . . 0.0 109.414 177.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -62.44 -50.67 70.54 Favored 'General case' 0 C--O 1.217 -0.61 0 O-C-N 121.447 -0.783 . . . . 0.0 110.111 177.118 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.7 mt -45.6 -49.82 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-O 123.359 1.552 . . . . 0.0 112.387 177.817 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.429 ' O ' ' HB3' ' A' ' 35' ' ' LYS 0.405 4.8 tp-100 -60.0 -56.23 24.26 Favored 'General case' 0 N--CA 1.424 -1.726 0 CA-C-N 113.522 -1.672 . . . . 0.0 109.169 179.265 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.9 t -61.62 -33.83 74.61 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 120.443 -1.41 . . . . 0.0 114.064 177.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 31.7 mt -65.95 -36.18 82.64 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 125.397 1.479 . . . . 0.0 109.668 177.322 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.429 ' HB3' ' O ' ' A' ' 32' ' ' GLN . 1.3 ttpm? -66.59 -41.08 89.04 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 114.48 -1.236 . . . . 0.0 109.779 176.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -71.83 -66.68 0.61 Allowed 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 115.802 1.779 . . . . 0.0 115.802 177.464 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -102.83 126.76 31.73 Favored Pre-proline 0 C--O 1.239 0.535 0 CA-C-N 120.656 1.571 . . . . 0.0 114.215 -177.809 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -77.82 -50.09 0.09 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 123.091 2.528 . . . . 0.0 114.713 177.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 95.8 p -60.5 -43.51 96.95 Favored 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 -177.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.461 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 58.0 mt-30 -74.51 -21.23 59.65 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 117.766 -1.111 . . . . 0.0 112.929 -178.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.491 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 94.2 p -48.35 -37.73 17.43 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 121.238 1.836 . . . . 0.0 114.515 -177.318 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.33 -42.19 77.3 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 123.655 1.693 . . . . 0.0 109.739 177.386 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -70.75 -52.6 19.76 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 105.993 -1.854 . . . . 0.0 105.993 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.491 ' HG ' ' HA ' ' A' ' 41' ' ' SER . 1.1 mt -50.31 -30.46 12.07 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 115.636 1.717 . . . . 0.0 115.636 177.29 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.424 HD22 ' CB ' ' A' ' 12' ' ' ALA . 26.3 tp -75.75 -52.95 9.3 Favored 'General case' 0 CA--C 1.504 -0.795 0 N-CA-C 107.308 -1.368 . . . . 0.0 107.308 -177.768 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.51 -41.08 63.11 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 113.073 -1.876 . . . . 0.0 107.811 177.615 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -65.98 -51.85 54.75 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 119.174 -1.01 . . . . 0.0 112.397 -177.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.13 -38.77 73.97 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 120.503 -1.373 . . . . 0.0 112.208 177.61 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 9.1 tmtm? -65.4 -45.11 85.29 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.752 0.787 . . . . 0.0 109.552 177.284 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 46.8 mtpt -60.59 -41.22 94.24 Favored 'General case' 0 C--O 1.233 0.218 0 O-C-N 119.915 -1.741 . . . . 0.0 108.859 -178.338 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.537 ' C ' HE21 ' A' ' 55' ' ' GLN . 39.4 mt -65.64 -51.1 62.12 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 114.418 -1.265 . . . . 0.0 110.955 177.531 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.405 ' HB2' ' HB2' ' A' ' 22' ' ' LEU . 2.1 t30 -46.85 -49.68 19.75 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 123.856 1.789 . . . . 0.0 110.975 178.507 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -62.6 -46.89 86.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 111.684 -2.507 . . . . 0.0 111.263 177.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.3 -39.93 73.52 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 119.299 -2.126 . . . . 0.0 110.809 176.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.537 HE21 ' C ' ' A' ' 51' ' ' LEU . 39.8 mt-30 -75.41 -5.69 46.24 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.332 1.053 . . . . 0.0 112.902 177.343 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.308 0 O-C-N 120.092 -1.63 . . . . 0.0 113.555 -177.67 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.447 -0.602 0 CA-C-O 123.417 1.579 . . . . 0.0 108.649 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.48 ' HA ' HD11 ' A' ' 34' ' ' LEU 0.329 0.1 OUTLIER -44.63 -80.61 0.01 OUTLIER 'General case' 0 N--CA 1.426 -1.675 0 N-CA-C 117.197 2.295 . . . . 0.0 117.197 -176.989 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -65.49 -25.61 67.55 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 111.448 -2.614 . . . . 0.0 112.297 -179.364 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 -67.41 -49.78 62.33 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 120.531 1.514 . . . . 0.0 107.569 177.582 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.556 ' HA ' HD22 ' A' ' 45' ' ' LEU . . . -58.06 -45.51 86.95 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.061 177.289 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -53.2 -51.14 63.07 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 123.652 1.691 . . . . 0.0 111.266 177.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -54.45 -55.58 27.49 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 113.636 -1.62 . . . . 0.0 112.296 177.545 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -61.73 -33.36 73.91 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 121.708 0.766 . . . . 0.0 111.362 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 14.6 mt -60.48 -53.39 49.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 O-C-N 120.359 -1.463 . . . . 0.0 108.354 177.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.438 ' HA ' ' HD3' ' A' ' 27' ' ' ARG . 51.9 mt -51.22 -49.74 60.49 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 122.856 1.313 . . . . 0.0 110.297 177.237 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 26.8 t-80 -59.39 -16.53 23.67 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 112.661 -2.063 . . . . 0.0 116.208 179.153 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.401 HD13 HD13 ' A' ' 22' ' ' LEU . 71.7 mt -58.33 102.55 0.31 Allowed Pre-proline 0 CA--C 1.547 0.847 0 CA-C-N 122.926 2.603 . . . . 0.0 114.733 -177.571 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -80.52 -17.0 10.28 Favored 'Trans proline' 0 N--CA 1.463 -0.299 0 C-N-CA 123.47 2.78 . . . . 0.0 114.37 -177.391 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.811 HD22 ' HB2' ' A' ' 56' ' ' ALA . 1.5 p-10 -118.61 40.66 3.18 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 126.223 2.916 . . . . 0.0 111.204 177.838 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.401 HD13 HD13 ' A' ' 19' ' ' LEU . 1.0 OUTLIER -141.19 141.55 34.07 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 109.725 -3.398 . . . . 0.0 106.68 177.435 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -87.55 158.68 18.85 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 122.36 1.076 . . . . 0.0 112.846 -177.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -50.25 -43.53 53.14 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.036 -0.984 . . . . 0.0 112.413 178.082 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -52.47 -54.93 25.83 Favored 'General case' 0 C--O 1.237 0.422 0 O-C-N 121.547 -0.72 . . . . 0.0 111.83 177.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -60.56 -43.91 96.73 Favored 'General case' 0 C--N 1.343 0.31 0 O-C-N 120.409 -1.432 . . . . 0.0 110.49 177.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.438 ' HD3' ' HA ' ' A' ' 17' ' ' LEU . 20.3 ttm-85 -50.83 -54.55 22.81 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 122.336 1.065 . . . . 0.0 110.931 178.837 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 62.1 m-80 -60.25 -44.12 95.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.577 177.569 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.29 -47.76 77.99 Favored 'General case' 0 CA--C 1.528 0.099 0 O-C-N 120.715 -1.24 . . . . 0.0 110.807 177.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -63.22 -45.04 93.52 Favored 'General case' 0 C--N 1.331 -0.208 0 O-C-N 121.389 -0.82 . . . . 0.0 110.287 177.333 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 34.1 mt -53.55 -47.73 59.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-O 122.822 1.296 . . . . 0.0 110.409 176.758 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.323 1.5 tp60 -55.4 -49.63 71.84 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 125.127 1.371 . . . . 0.0 110.703 177.166 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 34.2 t -63.58 -32.93 74.55 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.128 177.162 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.48 HD11 ' HA ' ' A' ' 9' ' ' GLN . 0.1 OUTLIER -62.77 -37.92 88.55 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.546 1.539 . . . . 0.0 109.99 177.63 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.21 -49.1 65.82 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 113.056 -1.884 . . . . 0.0 110.041 177.106 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -72.26 -48.13 44.93 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 116.407 2.002 . . . . 0.0 116.407 177.827 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.457 ' HB3' HD11 ' A' ' 44' ' ' LEU . 29.1 t0 -79.47 118.72 73.95 Favored Pre-proline 0 CA--C 1.535 0.381 0 N-CA-C 116.488 2.033 . . . . 0.0 116.488 -177.632 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 37' ' ' ASP . 8.2 Cg_exo -95.64 -14.55 0.56 Allowed 'Trans proline' 0 CA--C 1.532 0.419 0 C-N-CA 125.096 3.864 . . . . 0.0 113.262 177.21 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 60.6 p -100.77 -39.97 7.56 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 119.046 2.98 . . . . 0.0 119.046 -177.427 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.42 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 36.1 mt-30 -121.72 43.25 2.89 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 120.73 3.604 . . . . 0.0 120.73 -177.012 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.531 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 58.2 m -54.64 -36.41 64.52 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 125.609 3.822 . . . . 0.0 111.62 179.068 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.97 -37.36 66.41 Favored 'General case' 0 C--O 1.223 -0.311 0 O-C-N 120.018 -1.676 . . . . 0.0 109.589 176.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.418 ' CG ' ' HB3' ' A' ' 40' ' ' GLN . 1.8 m-20 -62.98 -50.12 72.02 Favored 'General case' 0 C--O 1.223 -0.314 0 O-C-N 120.227 -1.545 . . . . 0.0 107.245 177.649 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.531 ' HG ' ' HA ' ' A' ' 41' ' ' SER . 1.1 mt -54.83 -34.62 63.04 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 115.442 1.645 . . . . 0.0 115.442 177.285 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.556 HD22 ' HA ' ' A' ' 12' ' ' ALA . 29.0 tp -76.61 -50.18 14.46 Favored 'General case' 0 CA--C 1.509 -0.61 0 C-N-CA 124.887 1.275 . . . . 0.0 108.987 -177.312 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.72 -34.51 71.42 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 113.771 -1.559 . . . . 0.0 107.302 177.248 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -64.79 -58.23 6.8 Favored 'General case' 0 CA--C 1.522 -0.13 0 CA-C-O 122.056 0.932 . . . . 0.0 113.057 178.365 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -53.52 -39.86 65.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.85 0.833 . . . . 0.0 112.756 177.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -67.81 -41.19 83.5 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.197 177.48 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.3 mtpm? -60.65 -40.93 93.84 Favored 'General case' 0 CA--C 1.511 -0.525 0 O-C-N 120.725 -1.234 . . . . 0.0 109.448 178.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 19.9 mt -64.29 -53.41 49.38 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.024 -1.444 . . . . 0.0 109.247 177.695 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.401 ' HA ' ' NE2' ' A' ' 55' ' ' GLN . 2.4 t30 -49.06 -46.61 44.73 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 123.003 1.383 . . . . 0.0 112.13 -178.061 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -69.26 -50.22 48.96 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 113.533 -1.667 . . . . 0.0 111.478 177.749 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.68 -42.52 79.19 Favored 'General case' 0 N--CA 1.458 -0.058 0 O-C-N 120.402 -1.436 . . . . 0.0 113.424 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.401 ' NE2' ' HA ' ' A' ' 52' ' ' ASN . 1.2 pt20 -78.24 -0.58 29.14 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 121.217 -0.927 . . . . 0.0 112.944 179.563 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.811 ' HB2' HD22 ' A' ' 21' ' ' ASN . . . . . . . . 0 CA--C 1.541 0.608 0 CA-C-O 116.125 -1.893 . . . . 0.0 115.291 -177.745 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.303 0 CA-C-O 122.293 1.044 . . . . 0.0 112.592 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.408 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 1.5 tm0? -37.41 -55.47 1.05 Allowed 'General case' 0 N--CA 1.422 -1.873 0 C-N-CA 129.061 2.944 . . . . 0.0 114.952 177.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -72.13 -36.23 69.33 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 118.733 -1.187 . . . . 0.0 112.619 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -58.89 -49.05 79.24 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 121.194 1.815 . . . . 0.0 107.75 177.448 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.624 ' HA ' HD22 ' A' ' 45' ' ' LEU . . . -56.12 -44.37 79.06 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 113.203 -1.817 . . . . 0.0 110.376 177.228 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -52.57 -55.63 20.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 123.523 1.63 . . . . 0.0 111.3 177.359 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -56.98 -44.47 82.72 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.568 -1.196 . . . . 0.0 111.618 177.073 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.449 ' HB3' HD11 ' A' ' 45' ' ' LEU . 0.0 OUTLIER -59.1 -46.12 89.11 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 123.017 1.389 . . . . 0.0 108.947 177.358 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.2 mt -56.1 -46.81 81.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 O-C-N 119.845 -1.784 . . . . 0.0 109.585 -178.025 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 72.0 mt -65.23 -38.08 89.28 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.95 0.881 . . . . 0.0 111.189 177.007 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -59.61 -38.9 82.55 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.555 1.142 . . . . 0.0 113.175 177.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 87.2 mt -54.25 104.85 0.46 Allowed Pre-proline 0 CA--C 1.539 0.534 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 -178.41 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.454 ' C ' ' H ' ' A' ' 22' ' ' LEU . 33.4 Cg_endo -81.21 -50.72 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 123.525 2.816 . . . . 0.0 114.945 -177.77 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.436 HD22 HD21 ' A' ' 52' ' ' ASN . 8.7 p30 -83.85 30.7 0.5 Allowed 'General case' 0 C--O 1.236 0.352 0 CA-C-O 125.579 2.609 . . . . 0.0 111.611 -177.766 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.454 ' H ' ' C ' ' A' ' 20' ' ' PRO . 6.8 tp -109.3 139.67 43.95 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 111.013 -2.812 . . . . 0.0 109.487 177.704 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 -70.52 129.94 40.54 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 123.245 1.497 . . . . 0.0 110.145 177.31 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.5 mp0 -55.56 -27.26 47.99 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 120.427 -1.421 . . . . 0.0 112.117 177.637 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.529 ' HA ' ' ND2' ' A' ' 28' ' ' ASN . 1.8 tm-20 -60.47 -68.19 0.32 Allowed 'General case' 0 C--O 1.236 0.371 0 O-C-N 121.253 -0.904 . . . . 0.0 108.952 177.221 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.409 ' N ' ' CD ' ' A' ' 25' ' ' GLU . 2.5 pt20 -50.8 -46.3 59.68 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 120.722 -1.236 . . . . 0.0 110.224 177.185 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 18.6 ttm105 -48.82 -51.37 29.83 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.134 -1.604 . . . . 0.0 112.356 177.299 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.529 ' ND2' ' HA ' ' A' ' 25' ' ' GLU . 12.7 p30 -61.33 -46.17 91.36 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 115.395 -0.821 . . . . 0.0 112.565 177.785 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.82 -44.51 66.73 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 122.32 1.057 . . . . 0.0 110.587 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.457 ' CE2' ' HA ' ' A' ' 48' ' ' ALA . 47.1 m-85 -62.47 -52.31 64.0 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 176.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 14.7 mt -50.17 -48.86 23.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 CA-C-O 122.338 1.066 . . . . 0.0 112.603 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.29 0.7 OUTLIER -60.51 -53.77 53.51 Favored 'General case' 0 N--CA 1.432 -1.367 0 C-N-CA 127.591 2.356 . . . . 0.0 111.639 -178.386 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 23.0 t -63.66 -41.99 98.15 Favored 'General case' 0 C--N 1.332 -0.187 0 O-C-N 120.694 -1.254 . . . . 0.0 110.941 177.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.421 HD13 HD23 ' A' ' 44' ' ' LEU . 21.1 tp -58.49 -41.33 85.09 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 121.029 -1.045 . . . . 0.0 112.557 177.536 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.78 -42.6 73.59 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.912 0.863 . . . . 0.0 111.15 177.26 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -73.51 -53.55 10.33 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 117.971 2.582 . . . . 0.0 117.971 -179.429 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.408 ' HB2' ' HD3' ' A' ' 38' ' ' PRO . 31.3 m-20 -143.7 -58.73 0.02 OUTLIER Pre-proline 0 C--O 1.237 0.41 0 N-CA-C 118.343 2.72 . . . . 0.0 118.343 -176.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.408 ' HD3' ' HB2' ' A' ' 37' ' ' ASP . 0.5 OUTLIER -43.65 127.69 6.24 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 124.36 3.373 . . . . 0.0 115.484 177.79 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.5 t -100.73 -28.67 12.7 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 111.268 -2.696 . . . . 0.0 112.058 -177.493 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.438 ' H ' ' CD ' ' A' ' 40' ' ' GLN . 0.4 OUTLIER -79.28 63.54 3.94 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 124.907 2.289 . . . . 0.0 110.386 177.759 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.408 ' CB ' ' HA ' ' A' ' 9' ' ' GLN . 66.8 p -55.21 -38.35 68.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 112.978 -1.919 . . . . 0.0 112.9 -178.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.89 -39.36 65.7 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.712 -0.617 . . . . 0.0 110.009 177.34 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -71.06 -55.5 8.11 Favored 'General case' 0 N--CA 1.454 -0.258 0 O-C-N 121.187 -0.946 . . . . 0.0 108.77 177.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.421 HD23 HD13 ' A' ' 34' ' ' LEU . 15.7 tp -57.25 -23.55 48.9 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-O 125.454 2.55 . . . . 0.0 111.751 -177.861 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.624 HD22 ' HA ' ' A' ' 12' ' ' ALA . 35.8 tp -77.42 -53.18 7.96 Favored 'General case' 0 CA--C 1.503 -0.865 0 CA-C-N 112.585 -2.098 . . . . 0.0 106.83 -177.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.44 -33.9 46.23 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 177.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -64.01 -59.26 4.71 Favored 'General case' 0 C--N 1.345 0.412 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.89 177.38 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.457 ' HA ' ' CE2' ' A' ' 30' ' ' PHE . . . -50.88 -43.09 59.51 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 122.944 1.354 . . . . 0.0 112.475 177.461 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.73 -40.29 96.74 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 121.39 -0.819 . . . . 0.0 110.096 177.65 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.87 -41.65 92.0 Favored 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.484 ' HB3' HE22 ' A' ' 55' ' ' GLN . 52.8 mt -63.36 -50.37 70.22 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 119.32 -0.952 . . . . 0.0 109.465 177.245 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.436 HD21 HD22 ' A' ' 21' ' ' ASN . 3.2 t-20 -49.9 -41.73 46.48 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 119.908 -1.745 . . . . 0.0 110.706 177.2 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -60.52 -50.29 74.13 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 114.222 -1.353 . . . . 0.0 112.093 177.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.97 -43.13 77.28 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 122.105 0.955 . . . . 0.0 111.723 177.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.484 HE22 ' HB3' ' A' ' 51' ' ' LEU . 4.1 mp0 -69.96 -54.29 13.96 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 115.423 1.638 . . . . 0.0 115.423 177.356 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.572 0 N-CA-C 117.247 2.314 . . . . 0.0 117.247 -177.959 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.506 ' HG3' ' HA ' ' A' ' 39' ' ' SER . 1.7 pm0 . . . . . 0 C--O 1.236 0.385 0 CA-C-O 124.521 2.105 . . . . 0.0 112.182 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.493 ' H ' ' HG2' ' A' ' 8' ' ' GLU 0.309 10.4 tt0 -53.53 -45.33 69.76 Favored 'General case' 0 N--CA 1.428 -1.527 0 C-N-CA 127.358 2.263 . . . . 0.0 110.051 177.798 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 33.5 mm-40 -70.04 -49.89 46.75 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.097 -0.956 . . . . 0.0 112.528 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -51.71 -45.8 63.68 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.029 1.286 . . . . 0.0 109.526 178.091 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.513 ' HA ' HD22 ' A' ' 45' ' ' LEU . . . -62.26 -42.44 99.34 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 114.582 -1.19 . . . . 0.0 112.242 177.337 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -57.76 -51.68 68.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 122.825 1.298 . . . . 0.0 112.826 177.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -57.14 -52.06 66.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.173 -0.921 . . . . 0.0 112.566 177.602 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -59.31 -38.07 79.32 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.164 -0.96 . . . . 0.0 109.651 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -56.01 -51.83 56.91 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 O-C-N 121.078 -1.014 . . . . 0.0 108.831 177.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 81.3 mt -52.65 -45.18 66.59 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 122.664 1.221 . . . . 0.0 109.632 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -66.41 -12.64 58.12 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 117.152 2.279 . . . . 0.0 117.152 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.777 HD13 HD13 ' A' ' 22' ' ' LEU . 57.3 mt -60.99 104.11 0.43 Allowed Pre-proline 0 CA--C 1.551 0.994 0 CA-C-N 123.778 2.99 . . . . 0.0 117.104 -177.391 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 19' ' ' LEU . 93.1 Cg_endo -63.05 -60.21 0.19 Allowed 'Trans proline' 0 CA--C 1.534 0.479 0 C-N-CA 123.77 2.98 . . . . 0.0 119.752 -177.157 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.644 HD22 ' HB2' ' A' ' 56' ' ' ALA . 1.3 p-10 -88.51 27.47 1.27 Allowed 'General case' 0 CA--C 1.523 -0.08 0 O-C-N 118.434 -2.666 . . . . 0.0 113.121 -177.378 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.777 HD13 HD13 ' A' ' 19' ' ' LEU . 6.8 tt -102.51 137.47 40.7 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 113.44 -1.709 . . . . 0.0 114.128 177.801 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 12.7 p30 -87.1 151.02 23.58 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 122.515 1.15 . . . . 0.0 112.832 177.537 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -62.82 -29.23 70.57 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 115.77 1.767 . . . . 0.0 115.77 -177.515 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.416 ' CD ' ' H ' ' A' ' 25' ' ' GLU . 1.7 mp0 -58.86 -51.21 71.01 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 124.186 1.946 . . . . 0.0 109.49 177.267 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.47 ' NE2' ' CD1' ' A' ' 30' ' ' PHE . 0.7 OUTLIER -62.64 -47.99 81.32 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 113.398 -1.728 . . . . 0.0 108.467 177.47 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.4 ' NH1' ' HB2' ' A' ' 19' ' ' LEU . 12.2 tpp180 -47.84 -52.44 19.01 Favored 'General case' 0 C--O 1.22 -0.486 0 O-C-N 121.196 -0.94 . . . . 0.0 111.112 177.122 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 37.8 t-20 -57.78 -52.05 67.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 113.462 -1.699 . . . . 0.0 111.879 177.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -51.41 -48.27 62.7 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 123.354 1.549 . . . . 0.0 110.425 177.782 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.47 ' CD1' ' NE2' ' A' ' 26' ' ' GLN . 40.6 m-85 -64.96 -47.27 78.21 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.999 177.256 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 28.6 mt -51.01 -39.08 18.88 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-N 120.913 1.688 . . . . 0.0 110.369 176.621 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.306 5.0 tp60 -67.02 -54.21 23.91 Favored 'General case' 0 N--CA 1.435 -1.177 0 O-C-N 120.668 -1.27 . . . . 0.0 111.546 177.354 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.2 t -59.63 -35.15 73.82 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 119.986 -1.696 . . . . 0.0 111.67 177.61 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.438 HD11 ' CB ' ' A' ' 12' ' ' ALA . 2.5 mm? -60.12 -46.73 88.63 Favored 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 125.605 1.562 . . . . 0.0 107.914 176.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.81 -39.86 90.56 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 120.986 -1.071 . . . . 0.0 109.748 176.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 -72.76 -51.3 19.69 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 115.856 1.799 . . . . 0.0 115.856 177.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -105.66 125.68 32.69 Favored Pre-proline 0 CA--C 1.539 0.523 0 O-C-N 117.972 -2.955 . . . . 0.0 114.883 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -76.28 -72.93 0.01 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.754 2.303 . . . . 0.0 114.421 177.726 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.506 ' HA ' ' HG3' ' A' ' 8' ' ' GLU . 72.0 m -62.63 -29.47 70.64 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 118.451 -2.655 . . . . 0.0 114.897 -177.391 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.444 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 2.6 mp0 -70.14 -11.27 60.77 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 120.646 -1.284 . . . . 0.0 112.137 177.704 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 25.7 t -43.59 -39.6 3.59 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.945 1.298 . . . . 0.0 113.149 177.801 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.71 -38.22 72.02 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 120.842 -1.162 . . . . 0.0 111.926 177.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -71.62 -48.67 46.44 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 40' ' ' GLN . 0.7 OUTLIER -54.98 -30.58 59.53 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 123.966 1.841 . . . . 0.0 114.975 177.419 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.513 HD22 ' HA ' ' A' ' 12' ' ' ALA . 13.0 tp -77.24 -54.22 6.76 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-N 113.724 -1.58 . . . . 0.0 108.244 -177.62 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.88 -35.25 66.3 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 113.684 -1.598 . . . . 0.0 109.027 177.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -67.12 -59.91 3.06 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 114.833 -1.076 . . . . 0.0 112.453 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -51.05 -41.58 59.96 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 121.222 -0.924 . . . . 0.0 112.343 177.45 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.427 ' O ' ' HB3' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -64.51 -40.65 96.04 Favored 'General case' 0 C--O 1.241 0.636 0 CA-C-O 122.017 0.913 . . . . 0.0 112.323 177.811 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.437 ' HD3' ' N ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -65.04 -38.44 90.86 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-O 122.595 1.188 . . . . 0.0 108.364 177.66 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.449 ' C ' HE21 ' A' ' 55' ' ' GLN . 40.9 mt -65.94 -40.84 91.72 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 121.291 -0.88 . . . . 0.0 109.223 177.369 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.427 ' HB3' ' O ' ' A' ' 49' ' ' LYS . 1.0 OUTLIER -50.34 -52.19 39.12 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 122.468 1.127 . . . . 0.0 108.162 177.086 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -55.21 -58.68 6.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 112.504 -2.134 . . . . 0.0 110.622 178.064 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -54.98 -31.23 60.7 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 114.914 1.449 . . . . 0.0 114.914 -177.612 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.449 HE21 ' C ' ' A' ' 51' ' ' LEU . 41.8 mt-30 -69.2 -20.56 63.98 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 115.119 1.526 . . . . 0.0 115.119 178.159 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.644 ' HB2' HD22 ' A' ' 21' ' ' ASN . . . . . . . . 0 C--N 1.326 -0.444 0 N-CA-C 114.546 1.313 . . . . 0.0 114.546 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.473 0.682 0 CA-C-O 124.176 1.941 . . . . 0.0 112.155 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . 0.333 12.5 tt0 -38.67 -49.26 1.55 Allowed 'General case' 0 N--CA 1.432 -1.361 1 C-N-CA 133.004 4.522 . . . . 0.0 109.212 176.797 . . . . . . . . 3 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -73.53 -46.8 45.53 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 120.833 -1.167 . . . . 0.0 111.989 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 21.8 m120 -52.1 -47.54 65.19 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 120.064 -1.647 . . . . 0.0 109.691 177.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.573 ' HA ' HD22 ' A' ' 45' ' ' LEU . . . -59.29 -44.01 92.53 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 113.369 -1.742 . . . . 0.0 111.104 177.22 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -56.68 -53.53 56.63 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 122.95 1.357 . . . . 0.0 112.023 177.48 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -55.4 -47.9 75.18 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.767 177.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -63.31 -36.69 84.51 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 120.757 -1.214 . . . . 0.0 111.415 177.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -56.8 -44.57 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 125.454 1.502 . . . . 0.0 108.575 177.648 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 70.6 mt -64.71 -47.66 77.52 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 122.762 1.268 . . . . 0.0 109.591 176.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -58.82 -32.01 69.0 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 116.797 2.147 . . . . 0.0 116.797 -177.484 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.404 HD13 ' HB2' ' A' ' 52' ' ' ASN . 84.4 mt -53.1 96.35 0.1 OUTLIER Pre-proline 0 CA--C 1.548 0.868 0 N-CA-C 115.891 1.812 . . . . 0.0 115.891 -177.584 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 0.3 OUTLIER -80.29 3.02 8.01 Favored 'Trans proline' 0 N--CA 1.462 -0.377 0 C-N-CA 123.922 3.081 . . . . 0.0 113.575 -177.523 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.543 HD22 ' HB2' ' A' ' 56' ' ' ALA . 23.9 t-20 -132.59 26.66 4.39 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 124.268 1.985 . . . . 0.0 113.377 -177.891 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.4 tt -121.33 146.58 46.7 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 113.39 -1.732 . . . . 0.0 107.805 177.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.777 ' H ' HE22 ' A' ' 55' ' ' GLN . 23.1 p-10 -71.82 -155.57 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.746 0 O-C-N 119.403 -2.06 . . . . 0.0 115.536 179.215 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.583 ' H ' ' CD ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -90.58 -66.6 0.91 Allowed 'General case' 0 N--CA 1.443 -0.793 0 O-C-N 120.022 -1.674 . . . . 0.0 114.544 177.374 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -60.5 -37.28 80.6 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 114.501 1.297 . . . . 0.0 114.501 -177.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -64.66 -37.93 89.27 Favored 'General case' 0 C--N 1.347 0.484 0 CA-C-N 123.391 2.814 . . . . 0.0 108.13 177.475 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.5 ttm-85 -57.7 -49.69 75.67 Favored 'General case' 0 C--O 1.224 -0.268 0 O-C-N 121.703 -0.623 . . . . 0.0 109.907 177.576 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -54.8 -52.17 63.49 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 114.39 -1.277 . . . . 0.0 112.257 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.88 -50.65 68.19 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 122.652 1.215 . . . . 0.0 110.74 178.403 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.469 ' CE2' HD12 ' A' ' 51' ' ' LEU . 47.5 m-85 -61.09 -47.86 84.35 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-O 117.798 -1.096 . . . . 0.0 110.446 177.329 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 34.3 mt -49.07 -50.84 14.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-N 121.222 1.828 . . . . 0.0 110.558 176.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.08 -55.17 25.92 Favored 'General case' 0 N--CA 1.424 -1.763 0 CA-C-O 122.564 1.174 . . . . 0.0 109.919 177.681 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.9 t -58.56 -31.86 68.38 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 178.239 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.4 mt -69.01 -43.46 74.77 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 120.574 -1.328 . . . . 0.0 108.27 177.189 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.481 ' HZ1' ' CG ' ' A' ' 36' ' ' ASP . 0.9 OUTLIER -58.22 -37.71 75.38 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.256 177.783 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.481 ' CG ' ' HZ1' ' A' ' 35' ' ' LYS . 12.0 m-20 -84.3 0.15 50.19 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 120.074 -1.642 . . . . 0.0 114.313 176.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.551 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 31.9 t70 -78.9 115.59 53.43 Favored Pre-proline 0 CA--C 1.54 0.593 0 N-CA-C 120.041 3.349 . . . . 0.0 120.041 -177.536 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.551 ' HD3' ' HA ' ' A' ' 37' ' ' ASP . 12.4 Cg_exo -88.86 -21.31 1.34 Allowed 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 124.135 3.223 . . . . 0.0 111.618 177.238 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 80.1 p -100.24 -88.67 0.35 Allowed 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 115.468 1.655 . . . . 0.0 115.468 -176.725 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.433 ' O ' HD13 ' A' ' 44' ' ' LEU . 28.5 mm-40 -142.17 91.19 2.31 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 119.311 3.078 . . . . 0.0 119.311 -176.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.438 ' HA ' HD13 ' A' ' 44' ' ' LEU . 13.6 t -50.52 -16.8 0.4 Allowed 'General case' 0 N--CA 1.468 0.443 0 O-C-N 120.396 -1.44 . . . . 0.0 109.025 176.683 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -50.24 -40.35 47.51 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 120.816 1.644 . . . . 0.0 111.581 177.164 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.456 ' HB2' HD12 ' A' ' 44' ' ' LEU . 17.1 m-80 -67.2 -47.09 71.91 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 123.077 1.418 . . . . 0.0 107.408 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.605 ' CD1' ' H ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -60.18 -25.21 65.39 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 116.373 1.99 . . . . 0.0 116.373 177.221 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.573 HD22 ' HA ' ' A' ' 12' ' ' ALA . 33.3 tp -80.57 -48.73 12.28 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 106.089 -1.819 . . . . 0.0 106.089 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.1 -37.87 75.37 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 177.181 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -65.29 -52.51 53.67 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 119.326 -0.949 . . . . 0.0 112.076 179.042 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -55.43 -41.77 73.25 Favored 'General case' 0 C--N 1.334 -0.068 0 O-C-N 121.804 -0.56 . . . . 0.0 112.013 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -61.31 -45.97 92.25 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 121.0 0.428 . . . . 0.0 110.149 177.173 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -57.14 -40.67 77.62 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 123.154 1.454 . . . . 0.0 108.415 -179.108 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.469 HD12 ' CE2' ' A' ' 30' ' ' PHE . 73.7 mt -67.3 -47.15 71.43 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 113.775 -1.557 . . . . 0.0 111.698 177.542 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.404 ' HB2' HD13 ' A' ' 19' ' ' LEU . 1.0 OUTLIER -47.0 -50.7 18.76 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 119.84 -1.788 . . . . 0.0 109.419 177.294 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -58.86 -58.35 9.0 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 111.509 -2.587 . . . . 0.0 109.694 -179.454 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.34 -26.67 53.39 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.777 HE22 ' H ' ' A' ' 23' ' ' ASN . 42.6 mt-30 -69.05 -24.45 64.17 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.543 ' HB2' HD22 ' A' ' 21' ' ' ASN . . . . . . . . 0 C--N 1.327 -0.39 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -178.049 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.225 -0.22 0 CA-C-O 120.939 0.4 . . . . 0.0 110.202 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.49 ' O ' HD11 ' A' ' 34' ' ' LEU . 8.4 tt0 -39.88 -49.6 2.42 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 126.904 2.082 . . . . 0.0 110.753 177.472 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -69.2 -47.79 63.88 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 119.151 -2.218 . . . . 0.0 113.579 177.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -51.91 -44.42 63.82 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 123.854 1.788 . . . . 0.0 109.743 178.353 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.651 ' HA ' HD22 ' A' ' 45' ' ' LEU . . . -60.83 -49.6 76.84 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 112.222 -2.263 . . . . 0.0 111.738 177.604 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -55.21 -51.36 66.81 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 123.126 1.441 . . . . 0.0 111.804 177.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -57.24 -51.62 68.63 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 114.422 1.268 . . . . 0.0 114.422 177.832 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -61.51 -37.16 82.67 Favored 'General case' 0 N--CA 1.455 -0.209 0 O-C-N 121.166 -0.958 . . . . 0.0 110.694 178.015 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 13.1 mt -57.7 -52.97 50.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 O-C-N 121.135 -0.978 . . . . 0.0 108.995 177.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 90.4 mt -50.99 -49.48 60.24 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-O 122.527 1.156 . . . . 0.0 109.602 177.423 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 -63.87 -14.09 50.43 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 117.06 2.245 . . . . 0.0 117.06 177.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.659 HD13 HD13 ' A' ' 22' ' ' LEU . 93.3 mt -54.61 100.8 0.23 Allowed Pre-proline 0 CA--C 1.547 0.835 0 CA-C-N 123.959 3.072 . . . . 0.0 117.005 -177.378 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 19' ' ' LEU . 50.4 Cg_exo -56.76 -41.1 79.19 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 125.038 3.825 . . . . 0.0 116.108 -177.512 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 66.0 m-80 -104.98 23.63 13.27 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 122.955 1.36 . . . . 0.0 113.666 -177.417 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.659 HD13 HD13 ' A' ' 19' ' ' LEU . 1.6 tt -115.59 129.3 56.47 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-O 123.125 1.44 . . . . 0.0 110.527 179.047 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -78.69 145.42 34.56 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 112.888 -1.96 . . . . 0.0 112.695 178.062 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -48.9 -33.7 11.26 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.125 -1.398 . . . . 0.0 114.649 -177.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -60.56 -49.52 77.21 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 119.606 -1.934 . . . . 0.0 109.966 177.236 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -63.16 -43.83 97.17 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 177.611 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.447 ' N ' HD21 ' A' ' 22' ' ' LEU . 12.7 tpp180 -47.93 -53.23 16.59 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.06 177.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -60.22 -48.32 82.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.938 -1.028 . . . . 0.0 112.15 177.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.89 -50.88 62.99 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 124.342 2.02 . . . . 0.0 111.389 177.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PHE . . . . . 0.44 ' CG ' ' HB2' ' A' ' 48' ' ' ALA . 59.1 m-85 -60.49 -47.72 84.89 Favored 'General case' 0 C--O 1.215 -0.725 0 CA-C-N 112.471 -2.15 . . . . 0.0 109.308 177.666 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 41.6 mt -56.05 -40.44 63.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 121.679 2.036 . . . . 0.0 111.667 177.034 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.31 1.7 tp60 -59.13 -55.89 29.25 Favored 'General case' 0 C--O 1.247 0.942 0 O-C-N 119.904 -1.747 . . . . 0.0 111.346 177.324 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.3 t -66.77 -29.59 69.59 Favored 'General case' 0 C--O 1.215 -0.751 0 C-N-CA 118.912 -1.115 . . . . 0.0 108.98 177.221 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.686 HD22 HD23 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -57.64 -48.36 79.67 Favored 'General case' 0 N--CA 1.464 0.26 0 O-C-N 118.373 -2.704 . . . . 0.0 111.183 177.65 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.444 ' HG3' ' N ' ' A' ' 36' ' ' ASP . 12.6 pttp -68.27 -45.41 73.2 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.405 177.398 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.444 ' N ' ' HG3' ' A' ' 35' ' ' LYS . 97.2 m-20 -74.79 -34.99 62.5 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 117.423 2.379 . . . . 0.0 117.423 -177.771 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.64 ' HB3' ' CG ' ' A' ' 40' ' ' GLN . 45.2 m-20 -104.72 106.7 55.88 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 126.408 1.883 . . . . 0.0 115.685 -177.678 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 37' ' ' ASP . 87.7 Cg_endo -69.02 -96.68 0.01 OUTLIER 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.196 2.598 . . . . 0.0 118.225 -177.878 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.7 m -59.89 -27.12 66.44 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 117.983 -2.948 . . . . 0.0 115.82 -177.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.64 ' CG ' ' HB3' ' A' ' 37' ' ' ASP . 12.1 pm0 -69.89 -12.25 61.48 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.574 -0.704 . . . . 0.0 111.998 177.609 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 79.8 p -56.6 -22.85 36.77 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 120.124 -1.61 . . . . 0.0 111.17 177.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.91 -41.43 82.65 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 120.112 -1.617 . . . . 0.0 110.145 177.26 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -68.23 -46.89 69.31 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.167 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.686 HD23 HD22 ' A' ' 34' ' ' LEU . 27.7 tp -56.9 -28.63 62.15 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.978 1.37 . . . . 0.0 112.881 177.767 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.651 HD22 ' HA ' ' A' ' 12' ' ' ALA . 30.5 tp -78.9 -51.48 9.62 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 -178.098 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.73 -34.55 62.64 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 114.344 -1.298 . . . . 0.0 107.966 177.272 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -65.4 -60.73 2.66 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 115.183 -0.917 . . . . 0.0 112.825 177.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.44 ' HB2' ' CG ' ' A' ' 30' ' ' PHE . . . -51.46 -41.81 61.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 122.026 0.917 . . . . 0.0 112.627 178.067 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -62.87 -47.38 83.6 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.013 177.647 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.7 -35.26 79.99 Favored 'General case' 0 C--N 1.342 0.255 0 O-C-N 120.73 -1.231 . . . . 0.0 109.133 -177.606 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.0 mt -65.63 -51.73 57.37 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 119.818 -0.753 . . . . 0.0 109.048 177.157 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -46.71 -48.62 20.22 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 123.609 1.671 . . . . 0.0 110.583 179.219 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -60.51 -46.61 89.51 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 112.571 -2.104 . . . . 0.0 110.87 177.716 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.14 -44.74 75.37 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 120.954 -1.091 . . . . 0.0 110.333 177.069 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.08 -23.05 63.0 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 115.769 1.766 . . . . 0.0 115.769 177.696 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.603 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 179.618 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.234 0.256 0 CA-C-O 123.288 1.518 . . . . 0.0 111.838 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -43.27 -49.16 6.76 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 113.143 -1.844 . . . . 0.0 112.736 177.461 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.403 ' O ' ' HB3' ' A' ' 13' ' ' PHE . 35.1 mm-40 -66.88 -38.45 86.31 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 120.729 -0.388 . . . . 0.0 111.924 177.879 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -58.8 -47.45 84.73 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.152 -1.593 . . . . 0.0 109.045 177.376 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.5 -39.32 83.43 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 113.907 -1.497 . . . . 0.0 110.11 177.396 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.403 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 50.4 t80 -56.48 -53.52 56.56 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 123.284 1.516 . . . . 0.0 109.725 177.349 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 39.2 m-85 -56.24 -43.53 78.73 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.143 -1.389 . . . . 0.0 110.647 176.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -60.27 -40.09 89.14 Favored 'General case' 0 C--N 1.332 -0.16 0 O-C-N 121.118 -0.989 . . . . 0.0 111.805 177.595 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.1 mt -58.33 -51.92 65.47 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-O 122.374 1.083 . . . . 0.0 108.489 177.648 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.461 ' HA ' ' NH1' ' A' ' 27' ' ' ARG . 59.2 mt -59.87 -36.44 76.92 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 122.465 1.126 . . . . 0.0 112.645 177.423 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 22.6 t-160 -69.97 -11.66 61.04 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.624 1.57 . . . . 0.0 112.734 177.306 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 99.7 mt -62.36 124.85 84.2 Favored Pre-proline 0 CA--C 1.543 0.678 0 O-C-N 119.657 -1.902 . . . . 0.0 114.086 -178.199 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -70.02 -38.32 7.38 Favored 'Trans proline' 0 CA--C 1.531 0.375 0 C-N-CA 123.732 2.955 . . . . 0.0 117.611 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -103.45 -15.16 15.97 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 126.102 2.858 . . . . 0.0 115.551 -177.773 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.46 HD21 ' N ' ' A' ' 27' ' ' ARG . 4.6 tt -90.92 123.37 34.38 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 110.103 -3.226 . . . . 0.0 107.019 177.636 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.507 ' HA ' ' HE ' ' A' ' 27' ' ' ARG . 1.7 p30 -151.5 -34.34 0.14 Allowed 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 118.088 2.625 . . . . 0.0 118.088 -176.322 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.654 ' H ' ' CD ' ' A' ' 24' ' ' GLU 0.254 0.0 OUTLIER -75.0 -132.66 0.01 OUTLIER 'General case' 0 N--CA 1.432 -1.342 0 CA-C-O 127.384 3.469 . . . . 0.0 116.162 -177.214 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.446 ' H ' ' HG2' ' A' ' 24' ' ' GLU . 13.1 mm-40 -68.0 -26.33 65.85 Favored 'General case' 0 C--N 1.315 -0.902 1 CA-C-N 107.879 -4.237 . . . . 0.0 112.728 -177.377 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -69.51 -50.15 47.86 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 104.803 -2.295 . . . . 0.0 104.803 177.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.507 ' HE ' ' HA ' ' A' ' 23' ' ' ASN . 3.0 tpp85 -48.24 -51.72 24.27 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 114.521 -1.218 . . . . 0.0 110.805 177.513 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -59.81 -51.43 69.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 113.618 -1.628 . . . . 0.0 112.788 177.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.44 -44.11 76.04 Favored 'General case' 0 CA--C 1.528 0.113 0 O-C-N 121.136 -0.978 . . . . 0.0 110.861 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -67.28 -48.88 66.36 Favored 'General case' 0 N--CA 1.452 -0.369 0 O-C-N 121.457 -0.777 . . . . 0.0 110.226 176.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 11.2 mt -52.07 -46.92 43.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 O-C-N 119.516 -1.99 . . . . 0.0 112.547 177.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.305 0.6 OUTLIER -63.98 -49.0 74.2 Favored 'General case' 0 N--CA 1.436 -1.133 0 C-N-CA 124.914 1.285 . . . . 0.0 110.196 177.796 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.6 t -58.28 -37.07 74.27 Favored 'General case' 0 C--O 1.217 -0.616 0 O-C-N 120.978 -1.076 . . . . 0.0 109.842 177.612 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.8 mp -65.74 -41.18 92.48 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 121.199 1.818 . . . . 0.0 107.92 176.739 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.77 -42.15 71.36 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 120.203 -1.561 . . . . 0.0 110.345 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -84.0 -27.77 28.17 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 116.998 2.222 . . . . 0.0 116.998 177.486 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -79.45 160.12 70.77 Favored Pre-proline 0 C--O 1.239 0.518 0 N-CA-C 116.992 2.219 . . . . 0.0 116.992 -178.508 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -102.38 -92.66 0.0 OUTLIER 'Trans proline' 0 CA--C 1.544 1.004 0 C-N-CA 123.199 2.599 . . . . 0.0 110.937 176.502 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.0 t -102.08 -11.11 19.11 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 119.499 -2.001 . . . . 0.0 115.337 177.695 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.2 mp0 -68.53 -8.93 45.74 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 118.12 -2.863 . . . . 0.0 114.946 -177.132 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.466 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 61.8 m -42.95 -35.02 1.08 Allowed 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 125.26 1.424 . . . . 0.0 112.384 177.05 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -51.57 -39.96 58.85 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 123.544 1.64 . . . . 0.0 112.962 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -72.13 -46.63 55.81 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 122.677 1.227 . . . . 0.0 107.76 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.466 ' HG ' ' HA ' ' A' ' 41' ' ' SER . 0.8 OUTLIER -56.73 -29.33 62.4 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 124.609 2.147 . . . . 0.0 113.588 177.234 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 52.2 tp -77.11 -51.11 11.58 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 112.766 -2.015 . . . . 0.0 106.474 -178.213 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.7 -33.19 60.57 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 122.672 1.225 . . . . 0.0 108.31 176.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -64.55 -61.6 2.11 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 114.783 -1.099 . . . . 0.0 111.935 177.653 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -51.58 -38.05 52.66 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.963 0.887 . . . . 0.0 112.014 177.64 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -65.25 -43.89 89.89 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 121.675 0.75 . . . . 0.0 110.054 177.322 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.77 -39.95 95.78 Favored 'General case' 0 C--O 1.233 0.216 0 O-C-N 120.452 -1.405 . . . . 0.0 108.606 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.402 ' HB3' HE22 ' A' ' 55' ' ' GLN . 64.3 mt -62.88 -54.94 30.98 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 121.74 0.781 . . . . 0.0 109.707 177.346 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -44.82 -44.86 9.78 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 124.029 1.871 . . . . 0.0 111.466 -178.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -67.08 -46.66 73.61 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 111.702 -2.499 . . . . 0.0 111.751 177.541 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.61 -46.45 77.36 Favored 'General case' 0 C--O 1.233 0.204 0 O-C-N 120.942 -1.099 . . . . 0.0 111.444 177.804 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.402 HE22 ' HB3' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -84.98 14.13 5.26 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 177.676 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.359 0 O-C-N 119.83 -1.794 . . . . 0.0 111.234 177.534 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.456 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.505 HE21 ' CG ' ' A' ' 37' ' ' ASP 0.266 1.4 tm0? -39.42 -61.06 0.84 Allowed 'General case' 0 N--CA 1.432 -1.343 0 C-N-CA 127.261 2.224 . . . . 0.0 113.024 176.802 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -59.79 -37.15 78.32 Favored 'General case' 0 C--O 1.233 0.199 0 O-C-N 120.227 -1.545 . . . . 0.0 111.409 177.935 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 39.5 t-20 -59.26 -46.62 88.03 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.97 0.89 . . . . 0.0 109.194 177.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.448 ' O ' HD13 ' A' ' 16' ' ' ILE . . . -63.62 -37.03 85.78 Favored 'General case' 0 C--O 1.211 -0.932 0 C-N-CA 124.097 0.959 . . . . 0.0 109.142 177.369 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -54.23 -55.5 27.51 Favored 'General case' 0 C--O 1.237 0.416 0 O-C-N 119.708 -1.87 . . . . 0.0 108.723 177.535 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -58.21 -45.97 86.67 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 113.165 -1.834 . . . . 0.0 112.202 176.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.24 -43.42 74.55 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 123.039 1.4 . . . . 0.0 111.597 177.755 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.448 HD13 ' O ' ' A' ' 12' ' ' ALA . 0.7 OUTLIER -58.65 -52.91 54.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 C-N-CA 126.537 1.935 . . . . 0.0 109.94 178.063 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 49.5 mt -62.62 -36.17 81.91 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 122.098 0.952 . . . . 0.0 113.043 177.215 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 6.3 t-80 -62.6 -21.51 65.69 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 127.487 2.315 . . . . 0.0 116.14 177.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.507 HD12 HD22 ' A' ' 22' ' ' LEU . 21.6 mt -63.08 105.63 0.7 Allowed Pre-proline 0 C--N 1.328 -0.34 0 N-CA-C 118.315 2.709 . . . . 0.0 118.315 -176.658 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -72.81 -1.95 11.19 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 123.024 2.483 . . . . 0.0 112.64 178.334 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.481 HD21 ' ND2' ' A' ' 52' ' ' ASN . 36.2 p-10 -132.94 27.41 4.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 122.794 1.283 . . . . 0.0 114.3 178.068 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.507 HD22 HD12 ' A' ' 19' ' ' LEU . 7.2 tt -160.02 111.82 2.01 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 122.947 1.356 . . . . 0.0 109.203 177.267 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -154.82 2.94 0.21 Allowed 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 117.249 2.315 . . . . 0.0 117.249 -177.801 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.702 ' H ' ' CD ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -87.16 -132.88 0.07 Allowed 'General case' 0 N--CA 1.418 -2.05 0 CA-C-O 125.485 2.564 . . . . 0.0 112.796 -177.59 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.412 ' HA ' ' HB2' ' A' ' 28' ' ' ASN . 0.4 OUTLIER -76.3 -22.07 55.47 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 109.49 -3.504 . . . . 0.0 114.086 -177.227 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -73.86 -48.99 27.19 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 105.251 -2.129 . . . . 0.0 105.251 177.392 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.465 ' HB3' ' CZ ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -56.4 -48.36 77.09 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-N 114.698 -1.137 . . . . 0.0 110.543 177.413 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.412 ' HB2' ' HA ' ' A' ' 25' ' ' GLU . 73.0 m-20 -59.97 -47.74 84.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 113.724 -1.58 . . . . 0.0 111.809 177.431 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.57 -48.09 78.13 Favored 'General case' 0 C--N 1.333 -0.13 0 O-C-N 121.089 -1.007 . . . . 0.0 110.087 178.074 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -61.99 -47.46 84.69 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 121.633 -0.667 . . . . 0.0 110.679 177.435 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ILE . . . . . 0.457 HD12 ' NH1' ' A' ' 27' ' ' ARG . 1.6 mt -52.42 -44.81 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 O-C-N 119.111 -2.243 . . . . 0.0 110.405 177.098 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.271 5.1 tp60 -60.92 -48.2 82.89 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 123.867 0.867 . . . . 0.0 110.383 177.456 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.6 t -65.13 -28.29 69.32 Favored 'General case' 0 C--O 1.225 -0.208 0 O-C-N 121.337 -0.852 . . . . 0.0 111.714 177.478 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.7 mp -78.67 -24.61 45.03 Favored 'General case' 0 N--CA 1.445 -0.69 0 O-C-N 119.857 -1.777 . . . . 0.0 108.432 176.701 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.431 ' HZ3' ' CG ' ' A' ' 36' ' ' ASP . 1.1 pttm -69.09 -54.09 16.84 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 102.375 -3.194 . . . . 0.0 102.375 176.067 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.431 ' CG ' ' HZ3' ' A' ' 35' ' ' LYS . 70.3 m-20 -91.31 70.13 6.06 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-O 124.086 1.898 . . . . 0.0 108.581 177.013 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.505 ' CG ' HE21 ' A' ' 9' ' ' GLN . 24.4 t0 -75.28 115.65 47.13 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 111.482 -2.599 . . . . 0.0 115.068 -177.415 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 0.2 OUTLIER -97.19 -121.02 0.0 OUTLIER 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 125.246 3.964 . . . . 0.0 114.532 177.916 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.5 p -102.5 -59.72 1.66 Allowed 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 117.63 2.456 . . . . 0.0 117.63 179.463 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.446 ' CD ' ' H ' ' A' ' 40' ' ' GLN . 1.1 pm0 -69.95 32.51 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 119.269 3.063 . . . . 0.0 119.269 -176.872 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.59 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 18.9 m -52.4 -39.39 60.84 Favored 'General case' 0 N--CA 1.475 0.775 0 O-C-N 119.279 -2.138 . . . . 0.0 113.62 178.609 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.8 -38.6 72.79 Favored 'General case' 0 CA--C 1.538 0.488 0 O-C-N 120.297 -1.502 . . . . 0.0 109.092 176.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -64.94 -55.21 20.54 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 104.339 -2.467 . . . . 0.0 104.339 177.521 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.59 ' HG ' ' HA ' ' A' ' 41' ' ' SER . 2.1 mt -48.37 -28.36 3.14 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 177.22 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 13.4 tp -74.89 -54.45 7.23 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 -178.815 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.17 -35.48 69.61 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 113.506 -1.679 . . . . 0.0 110.598 177.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -64.47 -62.01 1.86 Allowed 'General case' 0 C--O 1.237 0.435 0 CA-C-O 122.685 1.231 . . . . 0.0 111.125 -178.28 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -51.96 -43.13 63.4 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 123.457 1.599 . . . . 0.0 111.02 177.701 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 35.7 tptt -58.94 -41.9 88.52 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.197 -1.365 . . . . 0.0 110.947 177.788 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.403 ' HZ2' ' N ' ' A' ' 50' ' ' LYS . 0.2 OUTLIER -63.34 -38.45 91.18 Favored 'General case' 0 N--CA 1.457 -0.077 0 O-C-N 120.399 -1.438 . . . . 0.0 108.591 -179.695 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 71.5 mt -59.6 -49.65 76.95 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 122.904 1.335 . . . . 0.0 110.418 177.188 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.667 HD22 ' C ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -50.68 -49.75 56.55 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-O 124.156 1.932 . . . . 0.0 112.51 177.366 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -62.39 -49.12 76.77 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 111.643 -2.526 . . . . 0.0 111.379 177.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.9 -44.77 86.98 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 121.25 -0.906 . . . . 0.0 113.01 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -80.09 8.87 6.31 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 177.837 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.817 0 O-C-N 119.945 -1.722 . . . . 0.0 113.201 177.957 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.471 0.598 0 CA-C-O 122.54 1.162 . . . . 0.0 113.469 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.418 ' NE2' ' O ' ' A' ' 34' ' ' LEU 0.314 3.0 tm0? -38.06 -52.32 1.4 Allowed 'General case' 0 N--CA 1.425 -1.687 0 C-N-CA 128.537 2.735 . . . . 0.0 111.815 177.655 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 48.0 mm-40 -72.82 -31.37 64.75 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.06 -0.973 . . . . 0.0 112.073 -178.014 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 40.2 t-20 -64.81 -45.36 86.58 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 177.425 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.7 -42.46 98.97 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-O 121.153 0.502 . . . . 0.0 110.566 177.473 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -55.45 -50.83 68.81 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 123.672 1.701 . . . . 0.0 111.716 177.37 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -60.5 -46.89 88.47 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 113.876 -1.511 . . . . 0.0 111.007 177.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.62 -41.84 74.06 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 122.753 1.264 . . . . 0.0 108.886 177.648 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -57.14 -56.65 13.66 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 177.079 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 69.6 mt -55.79 -28.9 58.48 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 122.883 1.325 . . . . 0.0 113.521 177.451 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -72.26 -13.2 61.45 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.544 1.538 . . . . 0.0 113.522 177.383 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 80.8 mt -55.13 119.76 25.15 Favored Pre-proline 0 CA--C 1.544 0.741 0 O-C-N 119.985 -1.697 . . . . 0.0 112.093 177.906 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -73.86 -11.17 23.65 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 125.129 3.886 . . . . 0.0 118.795 -177.224 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASN . . . . . 0.497 HD21 ' HB2' ' A' ' 56' ' ' ALA . 4.4 p-10 -155.45 58.93 0.63 Allowed 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 124.27 1.986 . . . . 0.0 112.737 177.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.6 tt -160.28 123.0 3.36 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 112.139 -2.3 . . . . 0.0 108.269 177.409 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -154.33 -13.29 0.13 Allowed 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 117.061 2.245 . . . . 0.0 117.061 -177.753 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.657 ' H ' ' CD ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -75.89 -132.3 0.01 OUTLIER 'General case' 0 N--CA 1.425 -1.701 0 CA-C-O 125.911 2.767 . . . . 0.0 113.283 -177.478 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.408 ' HA ' ' HB3' ' A' ' 28' ' ' ASN . 0.0 OUTLIER -66.07 -27.32 67.99 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 109.69 -3.414 . . . . 0.0 115.159 -177.072 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -74.1 -52.97 10.96 Favored 'General case' 0 N--CA 1.441 -0.896 0 N-CA-C 105.653 -1.98 . . . . 0.0 105.653 177.531 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -48.93 -49.11 41.77 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 124.355 2.026 . . . . 0.0 111.665 177.625 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.408 ' HB3' ' HA ' ' A' ' 25' ' ' GLU . 47.9 t-20 -55.73 -58.49 7.63 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 109.59 -3.459 . . . . 0.0 111.719 178.008 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.6 -46.57 88.55 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 121.599 -0.688 . . . . 0.0 111.324 -178.163 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -61.5 -46.33 90.43 Favored 'General case' 0 C--O 1.219 -0.502 0 O-C-N 121.188 -0.945 . . . . 0.0 109.859 177.511 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 29.4 mt -54.62 -51.66 48.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-N 121.425 1.92 . . . . 0.0 110.775 177.077 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.37 -56.6 9.06 Favored 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 125.88 1.672 . . . . 0.0 111.501 177.613 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.0 t -63.3 -30.78 71.86 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 112.205 -2.271 . . . . 0.0 111.506 178.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.418 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 1.4 mm? -65.5 -45.0 85.28 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 105.875 -1.898 . . . . 0.0 105.875 177.167 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . 0.479 ' HZ3' ' CG ' ' A' ' 36' ' ' ASP . 0.0 OUTLIER -60.17 -42.21 94.5 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 119.958 -1.714 . . . . 0.0 110.709 177.419 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.479 ' CG ' ' HZ3' ' A' ' 35' ' ' LYS . 45.4 m-20 -70.97 -46.27 62.62 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 117.503 2.408 . . . . 0.0 117.503 177.545 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -79.64 142.3 57.18 Favored Pre-proline 0 CA--C 1.531 0.232 0 N-CA-C 119.575 3.176 . . . . 0.0 119.575 -178.273 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.46 ' HG2' ' H ' ' A' ' 39' ' ' SER . 89.1 Cg_endo -86.51 -74.35 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.098 1.865 . . . . 0.0 110.323 176.286 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.46 ' H ' ' HG2' ' A' ' 38' ' ' PRO . 61.0 m -102.25 -18.34 15.52 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 120.689 3.589 . . . . 0.0 120.689 -177.738 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -70.79 -9.71 58.0 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 125.866 3.939 . . . . 0.0 114.296 -177.067 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.402 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 74.9 m -43.87 -29.13 0.51 Allowed 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 125.664 1.586 . . . . 0.0 114.214 177.795 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.19 -44.43 97.3 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 124.195 1.95 . . . . 0.0 109.572 177.245 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 61.4 t-20 -71.37 -52.73 17.07 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 105.15 -2.167 . . . . 0.0 105.15 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.402 ' HG ' ' HA ' ' A' ' 41' ' ' SER . 1.1 mt -51.45 -29.51 16.4 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 123.834 1.778 . . . . 0.0 114.69 177.561 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 63.0 tp -74.46 -50.67 17.4 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 -177.622 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.8 -37.98 71.9 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 113.821 -1.536 . . . . 0.0 107.497 177.043 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -63.63 -52.52 60.46 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 119.498 -0.881 . . . . 0.0 110.992 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -54.42 -40.73 68.56 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 122.428 1.108 . . . . 0.0 111.417 177.312 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.508 ' HZ2' ' HB2' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -63.96 -41.49 97.55 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 121.115 -0.991 . . . . 0.0 110.509 177.288 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -61.89 -39.07 90.68 Favored 'General case' 0 CA--C 1.519 -0.241 0 O-C-N 121.105 -0.997 . . . . 0.0 108.7 177.767 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 53.4 mt -62.3 -45.58 92.61 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 122.141 0.972 . . . . 0.0 110.454 177.438 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -59.21 -49.61 77.17 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 119.498 -2.001 . . . . 0.0 110.668 177.552 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -52.91 -42.75 65.66 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 124.999 1.319 . . . . 0.0 111.31 177.786 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.01 -30.47 70.32 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.527 -0.733 . . . . 0.0 111.74 177.135 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -82.53 -34.31 27.92 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 123.025 1.393 . . . . 0.0 111.994 177.601 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.497 ' HB2' HD21 ' A' ' 21' ' ' ASN . . . . . . . . 0 CA--C 1.542 0.645 0 CA-C-N 114.784 -1.098 . . . . 0.0 113.378 177.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.459 HG12 ' N ' ' A' ' 2' ' ' ASP . 84.5 t . . . . . 0 N--CA 1.468 0.466 0 CA-C-O 117.937 -1.03 . . . . 0.0 111.125 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.459 ' N ' HG12 ' A' ' 1' ' ' VAL . 21.8 p30 -71.92 -169.25 0.45 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 121.732 2.06 . . . . 0.0 113.665 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.8 p-10 -69.27 -5.97 26.39 Favored 'General case' 0 CA--C 1.528 0.1 0 O-C-N 120.952 -1.093 . . . . 0.0 113.576 -177.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.5 ttpp -100.75 -52.96 3.19 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.032 0.933 . . . . 0.0 111.389 177.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.444 ' HA ' ' OE1' ' A' ' 9' ' ' GLN . 40.3 m-85 -67.68 82.39 0.18 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-O 123.622 1.677 . . . . 0.0 112.919 -177.117 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.629 HD22 ' H ' ' A' ' 6' ' ' ASN . 0.1 OUTLIER -109.89 -130.24 0.3 Allowed 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 110.085 -3.234 . . . . 0.0 116.309 -177.528 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.418 ' H ' ' CG ' ' A' ' 6' ' ' ASN . 7.7 mtmp? -39.58 -106.55 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 119.318 3.081 . . . . 0.0 119.318 -177.376 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.405 ' CD ' ' H ' ' A' ' 8' ' ' GLU . 0.1 OUTLIER -53.69 -46.52 70.72 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 120.694 -1.254 . . . . 0.0 110.962 -178.061 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.444 ' OE1' ' HA ' ' A' ' 5' ' ' PHE 0.266 7.6 tt0 -45.95 -55.56 6.63 Favored 'General case' 0 N--CA 1.425 -1.702 0 C-N-CA 127.609 2.364 . . . . 0.0 110.925 177.76 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.42 ' HB2' ' O ' ' A' ' 6' ' ' ASN . 10.2 mm-40 -70.04 -45.3 67.44 Favored 'General case' 0 CA--C 1.512 -0.486 0 O-C-N 118.743 -2.473 . . . . 0.0 112.894 177.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -50.57 -49.05 57.24 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 123.788 1.756 . . . . 0.0 111.39 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.543 ' HA ' HD22 ' A' ' 45' ' ' LEU . . . -61.17 -43.53 98.74 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 111.166 -2.743 . . . . 0.0 110.801 177.47 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -54.79 -51.37 65.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 123.36 1.552 . . . . 0.0 111.556 177.547 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -58.59 -55.84 29.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 113.16 -1.836 . . . . 0.0 111.033 177.368 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -53.52 -37.87 63.2 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 123.64 1.686 . . . . 0.0 110.1 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.457 ' O ' ' NH1' ' A' ' 27' ' ' ARG . 1.6 mt -61.24 -60.69 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 177.161 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 96.2 mt -53.12 -35.81 60.08 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 121.294 1.861 . . . . 0.0 113.318 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -61.8 -19.64 62.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 112.9 -1.954 . . . . 0.0 114.072 177.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.489 ' HB2' HH11 ' A' ' 27' ' ' ARG . 70.5 mt -59.45 115.28 11.83 Favored Pre-proline 0 CA--C 1.537 0.445 0 O-C-N 120.661 -1.274 . . . . 0.0 111.196 177.83 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -80.57 -13.79 11.86 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 123.61 2.873 . . . . 0.0 115.592 -177.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.552 HD22 HD21 ' A' ' 52' ' ' ASN . 11.7 p30 -139.38 40.35 2.07 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 125.612 2.625 . . . . 0.0 113.536 -178.569 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.458 HD11 ' HB2' ' A' ' 26' ' ' GLN . 7.8 tt -149.7 121.84 8.32 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 103.849 -2.649 . . . . 0.0 103.849 177.28 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.454 ' HA ' ' HE ' ' A' ' 27' ' ' ARG . 6.4 t30 -153.35 -19.32 0.15 Allowed 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 -177.261 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.647 ' H ' ' CD ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -73.36 -133.04 0.01 OUTLIER 'General case' 0 N--CA 1.424 -1.774 0 CA-C-O 126.052 2.834 . . . . 0.0 113.128 -177.54 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.34 -30.8 70.74 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 109.028 -3.715 . . . . 0.0 114.637 -177.017 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.458 ' HB2' HD11 ' A' ' 22' ' ' LEU . 29.5 mt-30 -69.68 -50.71 41.25 Favored 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 177.607 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.489 HH11 ' HB2' ' A' ' 19' ' ' LEU . 2.1 tpp180 -50.77 -48.43 59.29 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 122.277 1.037 . . . . 0.0 110.898 177.61 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 28.0 m120 -57.19 -54.0 51.72 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 114.005 -1.452 . . . . 0.0 111.672 177.524 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.41 -47.42 75.94 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-O 121.654 0.74 . . . . 0.0 110.595 -178.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.424 ' CD2' ' HB2' ' A' ' 48' ' ' ALA . 50.0 m-85 -61.9 -47.89 82.94 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 118.139 -0.934 . . . . 0.0 110.566 177.41 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 84.2 mt -54.44 -46.05 70.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-N 121.877 2.126 . . . . 0.0 110.247 177.101 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.31 5.7 tp60 -56.61 -50.64 71.39 Favored 'General case' 0 N--CA 1.44 -0.952 0 C-N-CA 124.798 1.239 . . . . 0.0 112.146 178.328 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 20.2 t -63.09 -42.01 99.51 Favored 'General case' 0 C--O 1.217 -0.611 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -58.56 -38.43 77.85 Favored 'General case' 0 CA--C 1.529 0.172 0 O-C-N 120.106 -1.621 . . . . 0.0 111.92 177.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.9 ttpm? -68.15 -43.88 77.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 113.624 -1.626 . . . . 0.0 113.574 177.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -88.53 -42.44 12.08 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 116.823 2.157 . . . . 0.0 116.823 177.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -96.11 133.49 25.08 Favored Pre-proline 0 CA--C 1.543 0.691 0 N-CA-C 118.717 2.858 . . . . 0.0 118.717 -177.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -71.14 -83.48 0.01 OUTLIER 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 124.287 3.324 . . . . 0.0 116.08 177.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.3 m -100.74 -11.24 20.08 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 118.407 2.744 . . . . 0.0 118.407 -177.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -69.46 -36.21 76.36 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 125.477 3.762 . . . . 0.0 111.529 -177.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.507 ' HA ' ' CG ' ' A' ' 44' ' ' LEU . 60.3 m -49.84 -27.1 4.64 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 112.244 -2.253 . . . . 0.0 113.969 -179.183 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.431 ' O ' ' HB3' ' A' ' 45' ' ' LEU . . . -60.98 -36.86 80.56 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 121.748 2.067 . . . . 0.0 112.364 177.652 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -65.9 -41.88 90.92 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 125.28 2.467 . . . . 0.0 106.739 177.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.507 ' CG ' ' HA ' ' A' ' 41' ' ' SER . 0.7 OUTLIER -66.21 -21.79 66.32 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 112.455 -2.157 . . . . 0.0 112.972 177.122 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.543 HD22 ' HA ' ' A' ' 12' ' ' ALA . 14.8 tp -70.93 -49.25 47.71 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 104.597 -2.371 . . . . 0.0 104.597 177.272 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.79 -37.81 69.08 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 113.262 -1.79 . . . . 0.0 106.679 176.682 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -64.11 -49.96 70.15 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 118.416 -1.314 . . . . 0.0 112.447 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.424 ' HB2' ' CD2' ' A' ' 30' ' ' PHE . . . -52.68 -44.94 66.57 Favored 'General case' 0 C--O 1.236 0.378 0 O-C-N 120.293 -1.505 . . . . 0.0 111.454 177.395 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 25.6 tptp -61.11 -44.82 96.76 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 121.432 -0.793 . . . . 0.0 111.641 177.6 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 21.6 mmmt -66.56 -28.62 68.67 Favored 'General case' 0 CA--C 1.511 -0.553 0 O-C-N 121.072 -1.017 . . . . 0.0 110.609 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.436 ' HA ' HD23 ' A' ' 51' ' ' LEU . 37.1 mt -66.58 -46.81 74.75 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 122.539 1.161 . . . . 0.0 108.454 176.667 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.552 HD21 HD22 ' A' ' 21' ' ' ASN . 0.7 OUTLIER -49.3 -51.31 34.81 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 124.633 2.158 . . . . 0.0 108.067 177.427 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.443 ' HB3' ' HA ' ' A' ' 58' ' ' LYS . 38.3 m-20 -60.63 -40.04 90.48 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 112.076 -2.329 . . . . 0.0 111.778 177.698 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.45 -44.35 89.18 Favored 'General case' 0 CA--C 1.517 -0.307 0 O-C-N 120.182 -1.574 . . . . 0.0 111.724 177.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.404 ' NE2' ' HA ' ' A' ' 52' ' ' ASN . 1.8 pm0 -74.48 -50.67 17.34 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 116.977 -1.889 . . . . 0.0 110.923 177.203 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.547 ' CB ' ' CD ' ' A' ' 57' ' ' PRO . . . -92.62 -111.34 0.0 OUTLIER Pre-proline 0 CA--C 1.553 1.062 0 N-CA-C 114.514 1.302 . . . . 0.0 114.514 177.614 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.547 ' CD ' ' CB ' ' A' ' 56' ' ' ALA . 8.6 Cg_endo -86.05 101.23 0.64 Allowed 'Trans proline' 0 C--N 1.359 1.082 0 CA-C-N 125.928 3.153 . . . . 0.0 112.739 178.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.443 ' HA ' ' HB3' ' A' ' 53' ' ' ASP . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.16 0 N-CA-C 116.76 2.133 . . . . 0.0 116.76 -177.354 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 5.4 m . . . . . 0 CA--C 1.53 0.185 0 CA-C-O 124.005 1.86 . . . . 0.0 111.6 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -39.49 -81.41 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 130.468 3.507 . . . . 0.0 117.279 177.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -160.42 -60.91 0.06 Allowed 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 124.176 1.941 . . . . 0.0 110.448 177.787 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -55.74 -45.23 78.07 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 112.432 -2.167 . . . . 0.0 110.421 177.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.442 ' CZ ' ' HA ' ' A' ' 35' ' ' LYS . 52.7 m-85 -85.6 95.09 9.22 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 122.608 1.194 . . . . 0.0 114.141 177.523 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.422 HD21 ' NZ ' ' A' ' 7' ' ' LYS . 46.2 t30 -77.32 168.64 19.7 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.075 177.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.472 ' HD2' ' H ' ' A' ' 8' ' ' GLU . 0.4 OUTLIER -52.32 -46.05 65.86 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 119.344 3.09 . . . . 0.0 119.344 -177.223 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.472 ' H ' ' HD2' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -64.52 -50.38 67.62 Favored 'General case' 0 N--CA 1.461 0.096 0 O-C-N 118.67 -2.519 . . . . 0.0 108.559 179.222 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . 0.274 8.2 tt0 -43.38 -45.41 6.12 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 127.655 2.382 . . . . 0.0 110.778 177.372 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -73.21 -44.63 59.36 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 112.877 -1.965 . . . . 0.0 113.473 178.046 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 18.8 t30 -54.71 -47.19 74.04 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-O 123.857 1.789 . . . . 0.0 108.931 177.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.424 ' CB ' HD22 ' A' ' 45' ' ' LEU . . . -57.9 -48.05 81.01 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 111.678 -2.51 . . . . 0.0 111.307 177.741 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -55.29 -41.62 72.53 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 124.253 1.978 . . . . 0.0 111.949 177.445 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -62.71 -52.35 63.59 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 112.955 -1.929 . . . . 0.0 110.426 177.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -53.06 -42.88 66.23 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 122.178 0.989 . . . . 0.0 109.648 177.221 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.435 ' O ' ' HD2' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -54.29 -59.47 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.159 0 CA-C-N 114.563 -1.199 . . . . 0.0 109.636 177.496 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 35.0 mt -49.69 -49.4 47.74 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.902 0.858 . . . . 0.0 111.377 177.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -61.5 -10.84 8.66 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 113.608 -1.633 . . . . 0.0 115.347 178.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 75.7 mt -58.56 104.72 0.45 Allowed Pre-proline 0 CA--C 1.541 0.617 0 CA-C-N 122.307 2.322 . . . . 0.0 111.26 177.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -82.08 -4.17 11.82 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 124.191 3.261 . . . . 0.0 116.657 -177.025 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -140.64 44.15 1.84 Allowed 'General case' 0 N--CA 1.456 -0.157 0 CA-C-O 123.309 1.528 . . . . 0.0 112.485 177.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.405 ' HB2' ' HB2' ' A' ' 52' ' ' ASN . 1.7 tt -126.94 137.93 53.2 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 113.333 -1.758 . . . . 0.0 106.679 177.319 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -67.82 131.49 45.64 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 124.141 1.924 . . . . 0.0 113.698 -177.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -40.59 -45.48 2.32 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 112.983 -1.917 . . . . 0.0 114.778 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.533 ' CD ' ' H ' ' A' ' 25' ' ' GLU . 16.1 mp0 -55.79 -55.25 34.61 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 123.247 1.498 . . . . 0.0 111.2 177.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.431 ' NE2' ' HB3' ' A' ' 51' ' ' LEU . 35.0 tt0 -59.06 -38.97 80.68 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.305 177.18 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.435 ' HD2' ' O ' ' A' ' 16' ' ' ILE . 0.0 OUTLIER -56.62 -50.73 71.16 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 120.731 -1.231 . . . . 0.0 108.123 176.963 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 46.9 m-80 -57.99 -46.14 85.68 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 177.388 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.16 -47.51 78.11 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 122.117 0.961 . . . . 0.0 109.414 177.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -62.44 -50.67 70.54 Favored 'General case' 0 C--O 1.217 -0.61 0 O-C-N 121.447 -0.783 . . . . 0.0 110.111 177.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.7 mt -45.6 -49.82 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-O 123.359 1.552 . . . . 0.0 112.387 177.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.429 ' O ' ' HB3' ' A' ' 35' ' ' LYS 0.405 4.8 tp-100 -60.0 -56.23 24.26 Favored 'General case' 0 N--CA 1.424 -1.726 0 CA-C-N 113.522 -1.672 . . . . 0.0 109.169 179.265 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.9 t -61.62 -33.83 74.61 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 120.443 -1.41 . . . . 0.0 114.064 177.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 31.7 mt -65.95 -36.18 82.64 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 125.397 1.479 . . . . 0.0 109.668 177.322 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.442 ' HA ' ' CZ ' ' A' ' 5' ' ' PHE . 1.3 ttpm? -66.59 -41.08 89.04 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 114.48 -1.236 . . . . 0.0 109.779 176.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -71.83 -66.68 0.61 Allowed 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 115.802 1.779 . . . . 0.0 115.802 177.464 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -102.83 126.76 31.73 Favored Pre-proline 0 C--O 1.239 0.535 0 CA-C-N 120.656 1.571 . . . . 0.0 114.215 -177.809 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -77.82 -50.09 0.09 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 123.091 2.528 . . . . 0.0 114.713 177.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 95.8 p -60.5 -43.51 96.95 Favored 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 -177.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.461 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 58.0 mt-30 -74.51 -21.23 59.65 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 117.766 -1.111 . . . . 0.0 112.929 -178.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.491 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 94.2 p -48.35 -37.73 17.43 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 121.238 1.836 . . . . 0.0 114.515 -177.318 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.33 -42.19 77.3 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 123.655 1.693 . . . . 0.0 109.739 177.386 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 63.9 t30 -70.75 -52.6 19.76 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 105.993 -1.854 . . . . 0.0 105.993 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.491 ' HG ' ' HA ' ' A' ' 41' ' ' SER . 1.1 mt -50.31 -30.46 12.07 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 115.636 1.717 . . . . 0.0 115.636 177.29 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.424 HD22 ' CB ' ' A' ' 12' ' ' ALA . 26.3 tp -75.75 -52.95 9.3 Favored 'General case' 0 CA--C 1.504 -0.795 0 N-CA-C 107.308 -1.368 . . . . 0.0 107.308 -177.768 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.51 -41.08 63.11 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 113.073 -1.876 . . . . 0.0 107.811 177.615 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -65.98 -51.85 54.75 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 119.174 -1.01 . . . . 0.0 112.397 -177.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.13 -38.77 73.97 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 120.503 -1.373 . . . . 0.0 112.208 177.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 9.1 tmtm? -65.4 -45.11 85.29 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.752 0.787 . . . . 0.0 109.552 177.284 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 46.8 mtpt -60.59 -41.22 94.24 Favored 'General case' 0 C--O 1.233 0.218 0 O-C-N 119.915 -1.741 . . . . 0.0 108.859 -178.338 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.537 ' C ' HE21 ' A' ' 55' ' ' GLN . 39.4 mt -65.64 -51.1 62.12 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 114.418 -1.265 . . . . 0.0 110.955 177.531 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.405 ' HB2' ' HB2' ' A' ' 22' ' ' LEU . 2.1 t30 -46.85 -49.68 19.75 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 123.856 1.789 . . . . 0.0 110.975 178.507 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -62.6 -46.89 86.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 111.684 -2.507 . . . . 0.0 111.263 177.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.3 -39.93 73.52 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 119.299 -2.126 . . . . 0.0 110.809 176.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.537 HE21 ' C ' ' A' ' 51' ' ' LEU . 39.8 mt-30 -75.41 -5.69 46.24 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.332 1.053 . . . . 0.0 112.902 177.343 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -64.56 155.47 81.23 Favored Pre-proline 0 C--O 1.235 0.308 0 O-C-N 120.092 -1.63 . . . . 0.0 113.555 -177.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -72.25 66.95 3.49 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 124.119 3.213 . . . . 0.0 114.254 177.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.452 0 CA-C-N 113.504 -1.68 . . . . 0.0 111.965 178.037 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 27.3 m . . . . . 0 CA--C 1.532 0.251 0 CA-C-O 118.62 -0.705 . . . . 0.0 112.366 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -78.54 176.85 9.04 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 117.821 2.526 . . . . 0.0 117.821 -177.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 41.6 m-20 -103.11 14.96 30.59 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 113.302 -1.772 . . . . 0.0 111.326 177.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.486 ' HZ2' ' HB3' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -82.12 -9.91 59.37 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 -177.376 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.415 ' CZ ' ' NZ ' ' A' ' 4' ' ' LYS . 48.2 m-85 -86.54 -122.75 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 O-C-N 120.331 -1.48 . . . . 0.0 113.33 -178.787 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.729 HD21 ' N ' ' A' ' 40' ' ' GLN . 0.7 OUTLIER -83.22 -170.32 2.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 123.251 1.5 . . . . 0.0 112.682 177.838 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.1 mtmm -78.32 -62.96 1.51 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 123.973 1.844 . . . . 0.0 112.033 -177.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -89.9 33.93 0.85 Allowed 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 128.698 2.799 . . . . 0.0 108.649 -178.771 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.48 ' HA ' HD11 ' A' ' 34' ' ' LEU 0.329 0.1 OUTLIER -44.63 -80.61 0.01 OUTLIER 'General case' 0 N--CA 1.426 -1.675 0 N-CA-C 117.197 2.295 . . . . 0.0 117.197 -176.989 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 -65.49 -25.61 67.55 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 111.448 -2.614 . . . . 0.0 112.297 -179.364 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 -67.41 -49.78 62.33 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 120.531 1.514 . . . . 0.0 107.569 177.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.556 ' HA ' HD22 ' A' ' 45' ' ' LEU . . . -58.06 -45.51 86.95 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.061 177.289 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -53.2 -51.14 63.07 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 123.652 1.691 . . . . 0.0 111.266 177.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -54.45 -55.58 27.49 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 113.636 -1.62 . . . . 0.0 112.296 177.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -61.73 -33.36 73.91 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 121.708 0.766 . . . . 0.0 111.362 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 14.6 mt -60.48 -53.39 49.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 O-C-N 120.359 -1.463 . . . . 0.0 108.354 177.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.438 ' HA ' ' HD3' ' A' ' 27' ' ' ARG . 51.9 mt -51.22 -49.74 60.49 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 122.856 1.313 . . . . 0.0 110.297 177.237 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 26.8 t-80 -59.39 -16.53 23.67 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 112.661 -2.063 . . . . 0.0 116.208 179.153 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.401 HD13 HD13 ' A' ' 22' ' ' LEU . 71.7 mt -58.33 102.55 0.31 Allowed Pre-proline 0 CA--C 1.547 0.847 0 CA-C-N 122.926 2.603 . . . . 0.0 114.733 -177.571 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -80.52 -17.0 10.28 Favored 'Trans proline' 0 N--CA 1.463 -0.299 0 C-N-CA 123.47 2.78 . . . . 0.0 114.37 -177.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.811 HD22 ' HB2' ' A' ' 56' ' ' ALA . 1.5 p-10 -118.61 40.66 3.18 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 126.223 2.916 . . . . 0.0 111.204 177.838 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.401 HD13 HD13 ' A' ' 19' ' ' LEU . 1.0 OUTLIER -141.19 141.55 34.07 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 109.725 -3.398 . . . . 0.0 106.68 177.435 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -87.55 158.68 18.85 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 122.36 1.076 . . . . 0.0 112.846 -177.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -50.25 -43.53 53.14 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.036 -0.984 . . . . 0.0 112.413 178.082 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -52.47 -54.93 25.83 Favored 'General case' 0 C--O 1.237 0.422 0 O-C-N 121.547 -0.72 . . . . 0.0 111.83 177.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 -60.56 -43.91 96.73 Favored 'General case' 0 C--N 1.343 0.31 0 O-C-N 120.409 -1.432 . . . . 0.0 110.49 177.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.438 ' HD3' ' HA ' ' A' ' 17' ' ' LEU . 20.3 ttm-85 -50.83 -54.55 22.81 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 122.336 1.065 . . . . 0.0 110.931 178.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 62.1 m-80 -60.25 -44.12 95.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.577 177.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.29 -47.76 77.99 Favored 'General case' 0 CA--C 1.528 0.099 0 O-C-N 120.715 -1.24 . . . . 0.0 110.807 177.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -63.22 -45.04 93.52 Favored 'General case' 0 C--N 1.331 -0.208 0 O-C-N 121.389 -0.82 . . . . 0.0 110.287 177.333 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 34.1 mt -53.55 -47.73 59.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-O 122.822 1.296 . . . . 0.0 110.409 176.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.323 1.5 tp60 -55.4 -49.63 71.84 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 125.127 1.371 . . . . 0.0 110.703 177.166 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 34.2 t -63.58 -32.93 74.55 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.128 177.162 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.48 HD11 ' HA ' ' A' ' 9' ' ' GLN . 0.1 OUTLIER -62.77 -37.92 88.55 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.546 1.539 . . . . 0.0 109.99 177.63 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.21 -49.1 65.82 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 113.056 -1.884 . . . . 0.0 110.041 177.106 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -72.26 -48.13 44.93 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 116.407 2.002 . . . . 0.0 116.407 177.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.457 ' HB3' HD11 ' A' ' 44' ' ' LEU . 29.1 t0 -79.47 118.72 73.95 Favored Pre-proline 0 CA--C 1.535 0.381 0 N-CA-C 116.488 2.033 . . . . 0.0 116.488 -177.632 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 37' ' ' ASP . 8.2 Cg_exo -95.64 -14.55 0.56 Allowed 'Trans proline' 0 CA--C 1.532 0.419 0 C-N-CA 125.096 3.864 . . . . 0.0 113.262 177.21 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 60.6 p -100.77 -39.97 7.56 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 119.046 2.98 . . . . 0.0 119.046 -177.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.729 ' N ' HD21 ' A' ' 6' ' ' ASN . 36.1 mt-30 -121.72 43.25 2.89 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 120.73 3.604 . . . . 0.0 120.73 -177.012 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.531 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 58.2 m -54.64 -36.41 64.52 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 125.609 3.822 . . . . 0.0 111.62 179.068 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.97 -37.36 66.41 Favored 'General case' 0 C--O 1.223 -0.311 0 O-C-N 120.018 -1.676 . . . . 0.0 109.589 176.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.418 ' CG ' ' HB3' ' A' ' 40' ' ' GLN . 1.8 m-20 -62.98 -50.12 72.02 Favored 'General case' 0 C--O 1.223 -0.314 0 O-C-N 120.227 -1.545 . . . . 0.0 107.245 177.649 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.531 ' HG ' ' HA ' ' A' ' 41' ' ' SER . 1.1 mt -54.83 -34.62 63.04 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 115.442 1.645 . . . . 0.0 115.442 177.285 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.556 HD22 ' HA ' ' A' ' 12' ' ' ALA . 29.0 tp -76.61 -50.18 14.46 Favored 'General case' 0 CA--C 1.509 -0.61 0 C-N-CA 124.887 1.275 . . . . 0.0 108.987 -177.312 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.72 -34.51 71.42 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 113.771 -1.559 . . . . 0.0 107.302 177.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -64.79 -58.23 6.8 Favored 'General case' 0 CA--C 1.522 -0.13 0 CA-C-O 122.056 0.932 . . . . 0.0 113.057 178.365 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -53.52 -39.86 65.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.85 0.833 . . . . 0.0 112.756 177.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -67.81 -41.19 83.5 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.197 177.48 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.3 mtpm? -60.65 -40.93 93.84 Favored 'General case' 0 CA--C 1.511 -0.525 0 O-C-N 120.725 -1.234 . . . . 0.0 109.448 178.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 19.9 mt -64.29 -53.41 49.38 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.024 -1.444 . . . . 0.0 109.247 177.695 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.401 ' HA ' ' NE2' ' A' ' 55' ' ' GLN . 2.4 t30 -49.06 -46.61 44.73 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 123.003 1.383 . . . . 0.0 112.13 -178.061 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -69.26 -50.22 48.96 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 113.533 -1.667 . . . . 0.0 111.478 177.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.68 -42.52 79.19 Favored 'General case' 0 N--CA 1.458 -0.058 0 O-C-N 120.402 -1.436 . . . . 0.0 113.424 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.401 ' NE2' ' HA ' ' A' ' 52' ' ' ASN . 1.2 pt20 -78.24 -0.58 29.14 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 121.217 -0.927 . . . . 0.0 112.944 179.563 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.811 ' HB2' HD22 ' A' ' 21' ' ' ASN . . . -90.15 -92.11 0.0 OUTLIER Pre-proline 0 CA--C 1.541 0.608 0 CA-C-O 116.125 -1.893 . . . . 0.0 115.291 -177.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.507 ' CD ' ' HB3' ' A' ' 56' ' ' ALA . 22.6 Cg_endo -72.48 69.34 3.44 Favored 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 124.958 3.772 . . . . 0.0 117.445 -177.613 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.44 0 CA-C-N 114.292 -1.322 . . . . 0.0 111.46 177.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 56.1 t . . . . . 0 CA--C 1.535 0.402 0 CA-C-O 120.77 0.319 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -67.59 -109.69 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 118.595 2.813 . . . . 0.0 118.595 -177.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -160.36 92.25 0.97 Allowed 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 116.43 2.011 . . . . 0.0 116.43 -176.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.412 ' O ' ' HG3' ' A' ' 9' ' ' GLN . 13.7 mptt -78.27 43.4 0.45 Allowed 'General case' 0 N--CA 1.478 0.951 0 O-C-N 118.801 -2.437 . . . . 0.0 117.417 -177.587 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -82.24 60.39 4.96 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 119.318 -2.114 . . . . 0.0 114.75 -177.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -128.93 -46.54 1.25 Allowed 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 115.858 1.799 . . . . 0.0 115.858 -177.773 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.7 mtpm? -90.24 -136.97 0.13 Allowed 'General case' 0 CA--C 1.543 0.703 0 O-C-N 118.761 -2.462 . . . . 0.0 115.82 -177.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -6.97 8.84 Favored 'General case' 0 N--CA 1.465 0.303 0 O-C-N 119.367 -2.083 . . . . 0.0 112.592 -178.045 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.412 ' HG3' ' O ' ' A' ' 4' ' ' LYS . 1.5 tm0? -37.41 -55.47 1.05 Allowed 'General case' 0 N--CA 1.422 -1.873 0 C-N-CA 129.061 2.944 . . . . 0.0 114.952 177.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -72.13 -36.23 69.33 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 118.733 -1.187 . . . . 0.0 112.619 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -58.89 -49.05 79.24 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 121.194 1.815 . . . . 0.0 107.75 177.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.624 ' HA ' HD22 ' A' ' 45' ' ' LEU . . . -56.12 -44.37 79.06 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 113.203 -1.817 . . . . 0.0 110.376 177.228 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -52.57 -55.63 20.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 123.523 1.63 . . . . 0.0 111.3 177.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -56.98 -44.47 82.72 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.568 -1.196 . . . . 0.0 111.618 177.073 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.449 ' HB3' HD11 ' A' ' 45' ' ' LEU . 0.0 OUTLIER -59.1 -46.12 89.11 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 123.017 1.389 . . . . 0.0 108.947 177.358 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.2 mt -56.1 -46.81 81.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 O-C-N 119.845 -1.784 . . . . 0.0 109.585 -178.025 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 72.0 mt -65.23 -38.08 89.28 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.95 0.881 . . . . 0.0 111.189 177.007 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -59.61 -38.9 82.55 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.555 1.142 . . . . 0.0 113.175 177.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 87.2 mt -54.25 104.85 0.46 Allowed Pre-proline 0 CA--C 1.539 0.534 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 -178.41 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.454 ' C ' ' H ' ' A' ' 22' ' ' LEU . 33.4 Cg_endo -81.21 -50.72 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 123.525 2.816 . . . . 0.0 114.945 -177.77 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.436 HD22 HD21 ' A' ' 52' ' ' ASN . 8.7 p30 -83.85 30.7 0.5 Allowed 'General case' 0 C--O 1.236 0.352 0 CA-C-O 125.579 2.609 . . . . 0.0 111.611 -177.766 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.454 ' H ' ' C ' ' A' ' 20' ' ' PRO . 6.8 tp -109.3 139.67 43.95 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 111.013 -2.812 . . . . 0.0 109.487 177.704 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 -70.52 129.94 40.54 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 123.245 1.497 . . . . 0.0 110.145 177.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.5 mp0 -55.56 -27.26 47.99 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 120.427 -1.421 . . . . 0.0 112.117 177.637 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.529 ' HA ' ' ND2' ' A' ' 28' ' ' ASN . 1.8 tm-20 -60.47 -68.19 0.32 Allowed 'General case' 0 C--O 1.236 0.371 0 O-C-N 121.253 -0.904 . . . . 0.0 108.952 177.221 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.409 ' N ' ' CD ' ' A' ' 25' ' ' GLU . 2.5 pt20 -50.8 -46.3 59.68 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 120.722 -1.236 . . . . 0.0 110.224 177.185 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 18.6 ttm105 -48.82 -51.37 29.83 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.134 -1.604 . . . . 0.0 112.356 177.299 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.529 ' ND2' ' HA ' ' A' ' 25' ' ' GLU . 12.7 p30 -61.33 -46.17 91.36 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 115.395 -0.821 . . . . 0.0 112.565 177.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.82 -44.51 66.73 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 122.32 1.057 . . . . 0.0 110.587 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.457 ' CE2' ' HA ' ' A' ' 48' ' ' ALA . 47.1 m-85 -62.47 -52.31 64.0 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 176.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 14.7 mt -50.17 -48.86 23.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 CA-C-O 122.338 1.066 . . . . 0.0 112.603 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.29 0.7 OUTLIER -60.51 -53.77 53.51 Favored 'General case' 0 N--CA 1.432 -1.367 0 C-N-CA 127.591 2.356 . . . . 0.0 111.639 -178.386 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 23.0 t -63.66 -41.99 98.15 Favored 'General case' 0 C--N 1.332 -0.187 0 O-C-N 120.694 -1.254 . . . . 0.0 110.941 177.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.421 HD13 HD23 ' A' ' 44' ' ' LEU . 21.1 tp -58.49 -41.33 85.09 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 121.029 -1.045 . . . . 0.0 112.557 177.536 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.78 -42.6 73.59 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.912 0.863 . . . . 0.0 111.15 177.26 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -73.51 -53.55 10.33 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 117.971 2.582 . . . . 0.0 117.971 -179.429 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.408 ' HB2' ' HD3' ' A' ' 38' ' ' PRO . 31.3 m-20 -143.7 -58.73 0.02 OUTLIER Pre-proline 0 C--O 1.237 0.41 0 N-CA-C 118.343 2.72 . . . . 0.0 118.343 -176.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.408 ' HD3' ' HB2' ' A' ' 37' ' ' ASP . 0.5 OUTLIER -43.65 127.69 6.24 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 124.36 3.373 . . . . 0.0 115.484 177.79 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.5 t -100.73 -28.67 12.7 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 111.268 -2.696 . . . . 0.0 112.058 -177.493 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.438 ' H ' ' CD ' ' A' ' 40' ' ' GLN . 0.4 OUTLIER -79.28 63.54 3.94 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 124.907 2.289 . . . . 0.0 110.386 177.759 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.408 ' CB ' ' HA ' ' A' ' 9' ' ' GLN . 66.8 p -55.21 -38.35 68.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 112.978 -1.919 . . . . 0.0 112.9 -178.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.89 -39.36 65.7 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.712 -0.617 . . . . 0.0 110.009 177.34 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -71.06 -55.5 8.11 Favored 'General case' 0 N--CA 1.454 -0.258 0 O-C-N 121.187 -0.946 . . . . 0.0 108.77 177.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.421 HD23 HD13 ' A' ' 34' ' ' LEU . 15.7 tp -57.25 -23.55 48.9 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-O 125.454 2.55 . . . . 0.0 111.751 -177.861 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.624 HD22 ' HA ' ' A' ' 12' ' ' ALA . 35.8 tp -77.42 -53.18 7.96 Favored 'General case' 0 CA--C 1.503 -0.865 0 CA-C-N 112.585 -2.098 . . . . 0.0 106.83 -177.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.44 -33.9 46.23 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 177.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -64.01 -59.26 4.71 Favored 'General case' 0 C--N 1.345 0.412 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.89 177.38 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.457 ' HA ' ' CE2' ' A' ' 30' ' ' PHE . . . -50.88 -43.09 59.51 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 122.944 1.354 . . . . 0.0 112.475 177.461 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.73 -40.29 96.74 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 121.39 -0.819 . . . . 0.0 110.096 177.65 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.87 -41.65 92.0 Favored 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.484 ' HB3' HE22 ' A' ' 55' ' ' GLN . 52.8 mt -63.36 -50.37 70.22 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 119.32 -0.952 . . . . 0.0 109.465 177.245 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.436 HD21 HD22 ' A' ' 21' ' ' ASN . 3.2 t-20 -49.9 -41.73 46.48 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 119.908 -1.745 . . . . 0.0 110.706 177.2 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASP . . . . . 0.509 ' HA ' ' CG ' ' A' ' 57' ' ' PRO . 72.9 m-20 -60.52 -50.29 74.13 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 114.222 -1.353 . . . . 0.0 112.093 177.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.97 -43.13 77.28 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 122.105 0.955 . . . . 0.0 111.723 177.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.484 HE22 ' HB3' ' A' ' 51' ' ' LEU . 4.1 mp0 -69.96 -54.29 13.96 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 115.423 1.638 . . . . 0.0 115.423 177.356 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.531 ' HB3' ' CD ' ' A' ' 57' ' ' PRO . . . -91.14 -76.05 0.04 OUTLIER Pre-proline 0 C--N 1.323 -0.572 0 N-CA-C 117.247 2.314 . . . . 0.0 117.247 -177.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.531 ' CD ' ' HB3' ' A' ' 56' ' ' ALA . 19.1 Cg_endo -76.36 61.84 6.79 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 124.401 3.4 . . . . 0.0 114.779 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.414 ' NZ ' ' C ' ' A' ' 58' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.437 -1.113 0 CA-C-N 112.843 -1.98 . . . . 0.0 115.018 177.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 91.7 t . . . . . 0 N--CA 1.466 0.335 0 CA-C-O 124.815 2.245 . . . . 0.0 108.966 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -68.73 -157.23 0.02 OUTLIER 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 109.461 -3.518 . . . . 0.0 111.595 177.1 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -118.9 7.04 11.42 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 123.282 1.515 . . . . 0.0 109.107 177.405 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.02 117.95 28.4 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 120.932 -1.105 . . . . 0.0 111.165 -177.448 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.453 ' HB2' ' NE2' ' A' ' 10' ' ' GLN . 19.2 m-85 -98.26 107.54 20.03 Favored 'General case' 0 C--O 1.239 0.507 0 O-C-N 120.115 -1.616 . . . . 0.0 111.901 177.733 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.422 HD21 ' CB ' ' A' ' 38' ' ' PRO . 0.3 OUTLIER -81.8 174.57 11.2 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 114.43 -1.259 . . . . 0.0 112.079 178.08 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.425 ' HD2' ' N ' ' A' ' 8' ' ' GLU . 3.6 pptp? -39.25 -56.73 1.47 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 119.226 3.047 . . . . 0.0 119.226 -176.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.506 ' HG3' ' HA ' ' A' ' 39' ' ' SER . 1.7 pm0 -65.25 -44.72 87.22 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 124.521 2.105 . . . . 0.0 112.182 -177.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.493 ' H ' ' HG2' ' A' ' 8' ' ' GLU 0.309 10.4 tt0 -53.53 -45.33 69.76 Favored 'General case' 0 N--CA 1.428 -1.527 0 C-N-CA 127.358 2.263 . . . . 0.0 110.051 177.798 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.453 ' NE2' ' HB2' ' A' ' 5' ' ' PHE . 33.5 mm-40 -70.04 -49.89 46.75 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.097 -0.956 . . . . 0.0 112.528 179.135 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -51.71 -45.8 63.68 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.029 1.286 . . . . 0.0 109.526 178.091 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.513 ' HA ' HD22 ' A' ' 45' ' ' LEU . . . -62.26 -42.44 99.34 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 114.582 -1.19 . . . . 0.0 112.242 177.337 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -57.76 -51.68 68.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 122.825 1.298 . . . . 0.0 112.826 177.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -57.14 -52.06 66.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.173 -0.921 . . . . 0.0 112.566 177.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -59.31 -38.07 79.32 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.164 -0.96 . . . . 0.0 109.651 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -56.01 -51.83 56.91 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 O-C-N 121.078 -1.014 . . . . 0.0 108.831 177.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 81.3 mt -52.65 -45.18 66.59 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 122.664 1.221 . . . . 0.0 109.632 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -66.41 -12.64 58.12 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 117.152 2.279 . . . . 0.0 117.152 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.777 HD13 HD13 ' A' ' 22' ' ' LEU . 57.3 mt -60.99 104.11 0.43 Allowed Pre-proline 0 CA--C 1.551 0.994 0 CA-C-N 123.778 2.99 . . . . 0.0 117.104 -177.391 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 19' ' ' LEU . 93.1 Cg_endo -63.05 -60.21 0.19 Allowed 'Trans proline' 0 CA--C 1.534 0.479 0 C-N-CA 123.77 2.98 . . . . 0.0 119.752 -177.157 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.644 HD22 ' HB2' ' A' ' 56' ' ' ALA . 1.3 p-10 -88.51 27.47 1.27 Allowed 'General case' 0 CA--C 1.523 -0.08 0 O-C-N 118.434 -2.666 . . . . 0.0 113.121 -177.378 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.777 HD13 HD13 ' A' ' 19' ' ' LEU . 6.8 tt -102.51 137.47 40.7 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 113.44 -1.709 . . . . 0.0 114.128 177.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 12.7 p30 -87.1 151.02 23.58 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 122.515 1.15 . . . . 0.0 112.832 177.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -62.82 -29.23 70.57 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 115.77 1.767 . . . . 0.0 115.77 -177.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.416 ' H ' ' CD ' ' A' ' 25' ' ' GLU . 1.7 mp0 -58.86 -51.21 71.01 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 124.186 1.946 . . . . 0.0 109.49 177.267 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.47 ' NE2' ' CD1' ' A' ' 30' ' ' PHE . 0.7 OUTLIER -62.64 -47.99 81.32 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 113.398 -1.728 . . . . 0.0 108.467 177.47 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.4 ' NH1' ' HB2' ' A' ' 19' ' ' LEU . 12.2 tpp180 -47.84 -52.44 19.01 Favored 'General case' 0 C--O 1.22 -0.486 0 O-C-N 121.196 -0.94 . . . . 0.0 111.112 177.122 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 37.8 t-20 -57.78 -52.05 67.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 113.462 -1.699 . . . . 0.0 111.879 177.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -51.41 -48.27 62.7 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 123.354 1.549 . . . . 0.0 110.425 177.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.47 ' CD1' ' NE2' ' A' ' 26' ' ' GLN . 40.6 m-85 -64.96 -47.27 78.21 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.999 177.256 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 28.6 mt -51.01 -39.08 18.88 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-N 120.913 1.688 . . . . 0.0 110.369 176.621 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.306 5.0 tp60 -67.02 -54.21 23.91 Favored 'General case' 0 N--CA 1.435 -1.177 0 O-C-N 120.668 -1.27 . . . . 0.0 111.546 177.354 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.2 t -59.63 -35.15 73.82 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 119.986 -1.696 . . . . 0.0 111.67 177.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.438 HD11 ' CB ' ' A' ' 12' ' ' ALA . 2.5 mm? -60.12 -46.73 88.63 Favored 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 125.605 1.562 . . . . 0.0 107.914 176.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.81 -39.86 90.56 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 120.986 -1.071 . . . . 0.0 109.748 176.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 -72.76 -51.3 19.69 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 115.856 1.799 . . . . 0.0 115.856 177.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -105.66 125.68 32.69 Favored Pre-proline 0 CA--C 1.539 0.523 0 O-C-N 117.972 -2.955 . . . . 0.0 114.883 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.422 ' CB ' HD21 ' A' ' 6' ' ' ASN . 77.8 Cg_endo -76.28 -72.93 0.01 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.754 2.303 . . . . 0.0 114.421 177.726 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.506 ' HA ' ' HG3' ' A' ' 8' ' ' GLU . 72.0 m -62.63 -29.47 70.64 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 118.451 -2.655 . . . . 0.0 114.897 -177.391 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.444 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 2.6 mp0 -70.14 -11.27 60.77 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 120.646 -1.284 . . . . 0.0 112.137 177.704 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 25.7 t -43.59 -39.6 3.59 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.945 1.298 . . . . 0.0 113.149 177.801 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.71 -38.22 72.02 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 120.842 -1.162 . . . . 0.0 111.926 177.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -71.62 -48.67 46.44 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 40' ' ' GLN . 0.7 OUTLIER -54.98 -30.58 59.53 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 123.966 1.841 . . . . 0.0 114.975 177.419 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.513 HD22 ' HA ' ' A' ' 12' ' ' ALA . 13.0 tp -77.24 -54.22 6.76 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-N 113.724 -1.58 . . . . 0.0 108.244 -177.62 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.88 -35.25 66.3 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 113.684 -1.598 . . . . 0.0 109.027 177.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -67.12 -59.91 3.06 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 114.833 -1.076 . . . . 0.0 112.453 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -51.05 -41.58 59.96 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 121.222 -0.924 . . . . 0.0 112.343 177.45 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.427 ' O ' ' HB3' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -64.51 -40.65 96.04 Favored 'General case' 0 C--O 1.241 0.636 0 CA-C-O 122.017 0.913 . . . . 0.0 112.323 177.811 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.437 ' HD3' ' N ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -65.04 -38.44 90.86 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-O 122.595 1.188 . . . . 0.0 108.364 177.66 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.449 ' C ' HE21 ' A' ' 55' ' ' GLN . 40.9 mt -65.94 -40.84 91.72 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 121.291 -0.88 . . . . 0.0 109.223 177.369 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.427 ' HB3' ' O ' ' A' ' 49' ' ' LYS . 1.0 OUTLIER -50.34 -52.19 39.12 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 122.468 1.127 . . . . 0.0 108.162 177.086 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -55.21 -58.68 6.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 112.504 -2.134 . . . . 0.0 110.622 178.064 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -54.98 -31.23 60.7 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 114.914 1.449 . . . . 0.0 114.914 -177.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.449 HE21 ' C ' ' A' ' 51' ' ' LEU . 41.8 mt-30 -69.2 -20.56 63.98 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 115.119 1.526 . . . . 0.0 115.119 178.159 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.644 ' HB2' HD22 ' A' ' 21' ' ' ASN . . . -82.9 -53.95 0.58 Allowed Pre-proline 0 C--N 1.326 -0.444 0 N-CA-C 114.546 1.313 . . . . 0.0 114.546 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_endo -79.96 50.94 3.7 Favored 'Trans proline' 0 CA--C 1.535 0.527 1 C-N-CA 125.35 4.033 . . . . 0.0 115.652 -177.8 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.526 ' HZ3' ' C ' ' A' ' 58' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.642 0 CA-C-N 112.358 -2.201 . . . . 0.0 111.278 177.764 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 75.7 t . . . . . 0 N--CA 1.466 0.347 0 CA-C-O 125.27 2.462 . . . . 0.0 107.983 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -84.74 -138.19 0.06 Allowed 'General case' 0 N--CA 1.442 -0.852 1 CA-C-N 108.205 -4.089 . . . . 0.0 106.205 177.129 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.401 ' HA ' ' O ' ' A' ' 35' ' ' LYS . 14.3 m120 -71.09 -13.96 62.14 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.009 -1.057 . . . . 0.0 110.76 177.215 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -86.84 144.38 27.05 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 123.557 1.646 . . . . 0.0 112.245 177.24 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -80.58 107.99 13.84 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 112.977 -1.92 . . . . 0.0 115.576 -177.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -139.09 -53.84 0.57 Allowed 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 177.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 16.5 pttp -71.94 -141.62 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 115.316 1.599 . . . . 0.0 115.316 -177.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.52 -26.24 30.51 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 119.072 -2.267 . . . . 0.0 112.155 -177.685 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . 0.333 12.5 tt0 -38.67 -49.26 1.55 Allowed 'General case' 0 N--CA 1.432 -1.361 1 C-N-CA 133.004 4.522 . . . . 0.0 109.212 176.797 . . . . . . . . 3 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -73.53 -46.8 45.53 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 120.833 -1.167 . . . . 0.0 111.989 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 21.8 m120 -52.1 -47.54 65.19 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 120.064 -1.647 . . . . 0.0 109.691 177.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.573 ' HA ' HD22 ' A' ' 45' ' ' LEU . . . -59.29 -44.01 92.53 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 113.369 -1.742 . . . . 0.0 111.104 177.22 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -56.68 -53.53 56.63 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 122.95 1.357 . . . . 0.0 112.023 177.48 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -55.4 -47.9 75.18 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.767 177.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -63.31 -36.69 84.51 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 120.757 -1.214 . . . . 0.0 111.415 177.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -56.8 -44.57 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 125.454 1.502 . . . . 0.0 108.575 177.648 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 70.6 mt -64.71 -47.66 77.52 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 122.762 1.268 . . . . 0.0 109.591 176.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -58.82 -32.01 69.0 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 116.797 2.147 . . . . 0.0 116.797 -177.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.404 HD13 ' HB2' ' A' ' 52' ' ' ASN . 84.4 mt -53.1 96.35 0.1 OUTLIER Pre-proline 0 CA--C 1.548 0.868 0 N-CA-C 115.891 1.812 . . . . 0.0 115.891 -177.584 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 0.3 OUTLIER -80.29 3.02 8.01 Favored 'Trans proline' 0 N--CA 1.462 -0.377 0 C-N-CA 123.922 3.081 . . . . 0.0 113.575 -177.523 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.543 HD22 ' HB2' ' A' ' 56' ' ' ALA . 23.9 t-20 -132.59 26.66 4.39 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 124.268 1.985 . . . . 0.0 113.377 -177.891 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.4 tt -121.33 146.58 46.7 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 113.39 -1.732 . . . . 0.0 107.805 177.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.777 ' H ' HE22 ' A' ' 55' ' ' GLN . 23.1 p-10 -71.82 -155.57 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.746 0 O-C-N 119.403 -2.06 . . . . 0.0 115.536 179.215 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.583 ' H ' ' CD ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -90.58 -66.6 0.91 Allowed 'General case' 0 N--CA 1.443 -0.793 0 O-C-N 120.022 -1.674 . . . . 0.0 114.544 177.374 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -60.5 -37.28 80.6 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 114.501 1.297 . . . . 0.0 114.501 -177.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -64.66 -37.93 89.27 Favored 'General case' 0 C--N 1.347 0.484 0 CA-C-N 123.391 2.814 . . . . 0.0 108.13 177.475 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.5 ttm-85 -57.7 -49.69 75.67 Favored 'General case' 0 C--O 1.224 -0.268 0 O-C-N 121.703 -0.623 . . . . 0.0 109.907 177.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -54.8 -52.17 63.49 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 114.39 -1.277 . . . . 0.0 112.257 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.88 -50.65 68.19 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 122.652 1.215 . . . . 0.0 110.74 178.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.469 ' CE2' HD12 ' A' ' 51' ' ' LEU . 47.5 m-85 -61.09 -47.86 84.35 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-O 117.798 -1.096 . . . . 0.0 110.446 177.329 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 34.3 mt -49.07 -50.84 14.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-N 121.222 1.828 . . . . 0.0 110.558 176.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.08 -55.17 25.92 Favored 'General case' 0 N--CA 1.424 -1.763 0 CA-C-O 122.564 1.174 . . . . 0.0 109.919 177.681 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.9 t -58.56 -31.86 68.38 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 178.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.4 mt -69.01 -43.46 74.77 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 120.574 -1.328 . . . . 0.0 108.27 177.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.481 ' HZ1' ' CG ' ' A' ' 36' ' ' ASP . 0.9 OUTLIER -58.22 -37.71 75.38 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.256 177.783 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.481 ' CG ' ' HZ1' ' A' ' 35' ' ' LYS . 12.0 m-20 -84.3 0.15 50.19 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 120.074 -1.642 . . . . 0.0 114.313 176.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.551 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 31.9 t70 -78.9 115.59 53.43 Favored Pre-proline 0 CA--C 1.54 0.593 0 N-CA-C 120.041 3.349 . . . . 0.0 120.041 -177.536 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.551 ' HD3' ' HA ' ' A' ' 37' ' ' ASP . 12.4 Cg_exo -88.86 -21.31 1.34 Allowed 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 124.135 3.223 . . . . 0.0 111.618 177.238 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 80.1 p -100.24 -88.67 0.35 Allowed 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 115.468 1.655 . . . . 0.0 115.468 -176.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.433 ' O ' HD13 ' A' ' 44' ' ' LEU . 28.5 mm-40 -142.17 91.19 2.31 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 119.311 3.078 . . . . 0.0 119.311 -176.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.438 ' HA ' HD13 ' A' ' 44' ' ' LEU . 13.6 t -50.52 -16.8 0.4 Allowed 'General case' 0 N--CA 1.468 0.443 0 O-C-N 120.396 -1.44 . . . . 0.0 109.025 176.683 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -50.24 -40.35 47.51 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 120.816 1.644 . . . . 0.0 111.581 177.164 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.456 ' HB2' HD12 ' A' ' 44' ' ' LEU . 17.1 m-80 -67.2 -47.09 71.91 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 123.077 1.418 . . . . 0.0 107.408 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.605 ' CD1' ' H ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -60.18 -25.21 65.39 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 116.373 1.99 . . . . 0.0 116.373 177.221 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.573 HD22 ' HA ' ' A' ' 12' ' ' ALA . 33.3 tp -80.57 -48.73 12.28 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 106.089 -1.819 . . . . 0.0 106.089 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.1 -37.87 75.37 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 177.181 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -65.29 -52.51 53.67 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 119.326 -0.949 . . . . 0.0 112.076 179.042 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -55.43 -41.77 73.25 Favored 'General case' 0 C--N 1.334 -0.068 0 O-C-N 121.804 -0.56 . . . . 0.0 112.013 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -61.31 -45.97 92.25 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 121.0 0.428 . . . . 0.0 110.149 177.173 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -57.14 -40.67 77.62 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 123.154 1.454 . . . . 0.0 108.415 -179.108 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.469 HD12 ' CE2' ' A' ' 30' ' ' PHE . 73.7 mt -67.3 -47.15 71.43 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 113.775 -1.557 . . . . 0.0 111.698 177.542 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.404 ' HB2' HD13 ' A' ' 19' ' ' LEU . 1.0 OUTLIER -47.0 -50.7 18.76 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 119.84 -1.788 . . . . 0.0 109.419 177.294 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -58.86 -58.35 9.0 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 111.509 -2.587 . . . . 0.0 109.694 -179.454 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.34 -26.67 53.39 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.777 HE22 ' H ' ' A' ' 23' ' ' ASN . 42.6 mt-30 -69.05 -24.45 64.17 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.543 ' HB2' HD22 ' A' ' 21' ' ' ASN . . . -81.4 -54.62 0.68 Allowed Pre-proline 0 C--N 1.327 -0.39 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -178.049 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -78.97 51.49 3.87 Favored 'Trans proline' 0 CA--C 1.533 0.465 0 C-N-CA 125.105 3.87 . . . . 0.0 115.959 -177.67 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.532 ' C ' ' HZ3' ' A' ' 58' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.579 0 CA-C-N 112.824 -1.989 . . . . 0.0 111.667 177.825 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.413 HG11 ' CZ ' ' A' ' 13' ' ' PHE . 0.2 OUTLIER . . . . . 0 CA--C 1.532 0.262 0 CA-C-O 117.865 -1.064 . . . . 0.0 112.781 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -85.5 -155.85 0.25 Allowed 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 119.129 3.011 . . . . 0.0 119.129 -177.109 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 14.9 p-10 -69.19 -24.22 64.02 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 -177.465 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.0 mttp -58.55 -28.26 65.33 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 124.0 1.857 . . . . 0.0 109.359 177.534 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.409 ' HA ' ' CD ' ' A' ' 9' ' ' GLN . 75.9 m-85 -99.87 106.8 18.67 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 111.558 -2.565 . . . . 0.0 112.181 -178.01 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -93.96 -155.01 0.43 Allowed 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.634 -0.666 . . . . 0.0 112.223 177.538 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.496 ' CG ' ' H ' ' A' ' 8' ' ' GLU . 2.1 pttm -39.01 -89.54 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 119.457 3.132 . . . . 0.0 119.457 -177.064 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.496 ' H ' ' CG ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -57.31 -45.52 84.12 Favored 'General case' 0 C--O 1.225 -0.22 0 O-C-N 118.727 -2.483 . . . . 0.0 110.202 -177.898 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.49 ' O ' HD11 ' A' ' 34' ' ' LEU . 8.4 tt0 -39.88 -49.6 2.42 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 126.904 2.082 . . . . 0.0 110.753 177.472 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -69.2 -47.79 63.88 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 119.151 -2.218 . . . . 0.0 113.579 177.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -51.91 -44.42 63.82 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 123.854 1.788 . . . . 0.0 109.743 178.353 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.651 ' HA ' HD22 ' A' ' 45' ' ' LEU . . . -60.83 -49.6 76.84 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 112.222 -2.263 . . . . 0.0 111.738 177.604 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.413 ' CZ ' HG11 ' A' ' 1' ' ' VAL . 30.9 t80 -55.21 -51.36 66.81 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 123.126 1.441 . . . . 0.0 111.804 177.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -57.24 -51.62 68.63 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 114.422 1.268 . . . . 0.0 114.422 177.832 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -61.51 -37.16 82.67 Favored 'General case' 0 N--CA 1.455 -0.209 0 O-C-N 121.166 -0.958 . . . . 0.0 110.694 178.015 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 13.1 mt -57.7 -52.97 50.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 O-C-N 121.135 -0.978 . . . . 0.0 108.995 177.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 90.4 mt -50.99 -49.48 60.24 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-O 122.527 1.156 . . . . 0.0 109.602 177.423 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 -63.87 -14.09 50.43 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 117.06 2.245 . . . . 0.0 117.06 177.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.659 HD13 HD13 ' A' ' 22' ' ' LEU . 93.3 mt -54.61 100.8 0.23 Allowed Pre-proline 0 CA--C 1.547 0.835 0 CA-C-N 123.959 3.072 . . . . 0.0 117.005 -177.378 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 19' ' ' LEU . 50.4 Cg_exo -56.76 -41.1 79.19 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 125.038 3.825 . . . . 0.0 116.108 -177.512 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 66.0 m-80 -104.98 23.63 13.27 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 122.955 1.36 . . . . 0.0 113.666 -177.417 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.659 HD13 HD13 ' A' ' 19' ' ' LEU . 1.6 tt -115.59 129.3 56.47 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-O 123.125 1.44 . . . . 0.0 110.527 179.047 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -78.69 145.42 34.56 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 112.888 -1.96 . . . . 0.0 112.695 178.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -48.9 -33.7 11.26 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.125 -1.398 . . . . 0.0 114.649 -177.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -60.56 -49.52 77.21 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 119.606 -1.934 . . . . 0.0 109.966 177.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -63.16 -43.83 97.17 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 177.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.447 ' N ' HD21 ' A' ' 22' ' ' LEU . 12.7 tpp180 -47.93 -53.23 16.59 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.06 177.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -60.22 -48.32 82.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.938 -1.028 . . . . 0.0 112.15 177.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.89 -50.88 62.99 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 124.342 2.02 . . . . 0.0 111.389 177.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PHE . . . . . 0.44 ' CG ' ' HB2' ' A' ' 48' ' ' ALA . 59.1 m-85 -60.49 -47.72 84.89 Favored 'General case' 0 C--O 1.215 -0.725 0 CA-C-N 112.471 -2.15 . . . . 0.0 109.308 177.666 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 41.6 mt -56.05 -40.44 63.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 121.679 2.036 . . . . 0.0 111.667 177.034 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.31 1.7 tp60 -59.13 -55.89 29.25 Favored 'General case' 0 C--O 1.247 0.942 0 O-C-N 119.904 -1.747 . . . . 0.0 111.346 177.324 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.3 t -66.77 -29.59 69.59 Favored 'General case' 0 C--O 1.215 -0.751 0 C-N-CA 118.912 -1.115 . . . . 0.0 108.98 177.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.686 HD22 HD23 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -57.64 -48.36 79.67 Favored 'General case' 0 N--CA 1.464 0.26 0 O-C-N 118.373 -2.704 . . . . 0.0 111.183 177.65 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.444 ' HG3' ' N ' ' A' ' 36' ' ' ASP . 12.6 pttp -68.27 -45.41 73.2 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.405 177.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.444 ' N ' ' HG3' ' A' ' 35' ' ' LYS . 97.2 m-20 -74.79 -34.99 62.5 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 117.423 2.379 . . . . 0.0 117.423 -177.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.64 ' HB3' ' CG ' ' A' ' 40' ' ' GLN . 45.2 m-20 -104.72 106.7 55.88 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 126.408 1.883 . . . . 0.0 115.685 -177.678 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 37' ' ' ASP . 87.7 Cg_endo -69.02 -96.68 0.01 OUTLIER 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.196 2.598 . . . . 0.0 118.225 -177.878 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.7 m -59.89 -27.12 66.44 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 117.983 -2.948 . . . . 0.0 115.82 -177.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.64 ' CG ' ' HB3' ' A' ' 37' ' ' ASP . 12.1 pm0 -69.89 -12.25 61.48 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.574 -0.704 . . . . 0.0 111.998 177.609 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 79.8 p -56.6 -22.85 36.77 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 120.124 -1.61 . . . . 0.0 111.17 177.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.91 -41.43 82.65 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 120.112 -1.617 . . . . 0.0 110.145 177.26 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -68.23 -46.89 69.31 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.686 HD23 HD22 ' A' ' 34' ' ' LEU . 27.7 tp -56.9 -28.63 62.15 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.978 1.37 . . . . 0.0 112.881 177.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.651 HD22 ' HA ' ' A' ' 12' ' ' ALA . 30.5 tp -78.9 -51.48 9.62 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 -178.098 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.73 -34.55 62.64 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 114.344 -1.298 . . . . 0.0 107.966 177.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -65.4 -60.73 2.66 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 115.183 -0.917 . . . . 0.0 112.825 177.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.44 ' HB2' ' CG ' ' A' ' 30' ' ' PHE . . . -51.46 -41.81 61.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 122.026 0.917 . . . . 0.0 112.627 178.067 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -62.87 -47.38 83.6 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.013 177.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.7 -35.26 79.99 Favored 'General case' 0 C--N 1.342 0.255 0 O-C-N 120.73 -1.231 . . . . 0.0 109.133 -177.606 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.0 mt -65.63 -51.73 57.37 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 119.818 -0.753 . . . . 0.0 109.048 177.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -46.71 -48.62 20.22 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 123.609 1.671 . . . . 0.0 110.583 179.219 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -60.51 -46.61 89.51 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 112.571 -2.104 . . . . 0.0 110.87 177.716 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.14 -44.74 75.37 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 120.954 -1.091 . . . . 0.0 110.333 177.069 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.08 -23.05 63.0 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 115.769 1.766 . . . . 0.0 115.769 177.696 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -62.45 167.46 5.39 Favored Pre-proline 0 CA--C 1.541 0.603 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -79.31 148.44 21.13 Favored 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 123.122 2.548 . . . . 0.0 113.64 177.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.299 0 O-C-N 120.674 -1.266 . . . . 0.0 113.133 177.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.456 HG21 ' HA ' ' A' ' 5' ' ' PHE . 5.5 m . . . . . 0 C--O 1.235 0.3 0 CA-C-O 121.127 0.489 . . . . 0.0 111.442 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -65.52 -92.82 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.579 1.152 . . . . 0.0 109.539 177.301 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -126.56 -22.37 3.96 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 125.3 1.44 . . . . 0.0 110.781 177.285 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.408 ' NZ ' ' HB3' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -97.61 122.97 41.3 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 177.734 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.456 ' HA ' HG21 ' A' ' 1' ' ' VAL . 93.0 m-85 -69.78 161.75 29.2 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 114.883 1.438 . . . . 0.0 114.883 178.283 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -94.3 173.3 7.7 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.774 0.797 . . . . 0.0 111.791 177.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.552 ' HG2' ' H ' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -53.56 -84.28 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 115.109 1.522 . . . . 0.0 115.109 -177.888 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.552 ' H ' ' HG2' ' A' ' 7' ' ' LYS . 0.9 OUTLIER -44.77 -43.55 8.65 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 123.288 1.518 . . . . 0.0 111.838 178.053 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -43.27 -49.16 6.76 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 113.143 -1.844 . . . . 0.0 112.736 177.461 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.403 ' O ' ' HB3' ' A' ' 13' ' ' PHE . 35.1 mm-40 -66.88 -38.45 86.31 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 120.729 -0.388 . . . . 0.0 111.924 177.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -58.8 -47.45 84.73 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.152 -1.593 . . . . 0.0 109.045 177.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.5 -39.32 83.43 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 113.907 -1.497 . . . . 0.0 110.11 177.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.403 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 50.4 t80 -56.48 -53.52 56.56 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 123.284 1.516 . . . . 0.0 109.725 177.349 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 39.2 m-85 -56.24 -43.53 78.73 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.143 -1.389 . . . . 0.0 110.647 176.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -60.27 -40.09 89.14 Favored 'General case' 0 C--N 1.332 -0.16 0 O-C-N 121.118 -0.989 . . . . 0.0 111.805 177.595 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.1 mt -58.33 -51.92 65.47 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-O 122.374 1.083 . . . . 0.0 108.489 177.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.461 ' HA ' ' NH1' ' A' ' 27' ' ' ARG . 59.2 mt -59.87 -36.44 76.92 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 122.465 1.126 . . . . 0.0 112.645 177.423 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 22.6 t-160 -69.97 -11.66 61.04 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.624 1.57 . . . . 0.0 112.734 177.306 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 99.7 mt -62.36 124.85 84.2 Favored Pre-proline 0 CA--C 1.543 0.678 0 O-C-N 119.657 -1.902 . . . . 0.0 114.086 -178.199 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -70.02 -38.32 7.38 Favored 'Trans proline' 0 CA--C 1.531 0.375 0 C-N-CA 123.732 2.955 . . . . 0.0 117.611 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -103.45 -15.16 15.97 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 126.102 2.858 . . . . 0.0 115.551 -177.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.46 HD21 ' N ' ' A' ' 27' ' ' ARG . 4.6 tt -90.92 123.37 34.38 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 110.103 -3.226 . . . . 0.0 107.019 177.636 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.507 ' HA ' ' HE ' ' A' ' 27' ' ' ARG . 1.7 p30 -151.5 -34.34 0.14 Allowed 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 118.088 2.625 . . . . 0.0 118.088 -176.322 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.654 ' H ' ' CD ' ' A' ' 24' ' ' GLU 0.254 0.0 OUTLIER -75.0 -132.66 0.01 OUTLIER 'General case' 0 N--CA 1.432 -1.342 0 CA-C-O 127.384 3.469 . . . . 0.0 116.162 -177.214 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.446 ' H ' ' HG2' ' A' ' 24' ' ' GLU . 13.1 mm-40 -68.0 -26.33 65.85 Favored 'General case' 0 C--N 1.315 -0.902 1 CA-C-N 107.879 -4.237 . . . . 0.0 112.728 -177.377 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -69.51 -50.15 47.86 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 104.803 -2.295 . . . . 0.0 104.803 177.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.507 ' HE ' ' HA ' ' A' ' 23' ' ' ASN . 3.0 tpp85 -48.24 -51.72 24.27 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 114.521 -1.218 . . . . 0.0 110.805 177.513 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -59.81 -51.43 69.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 113.618 -1.628 . . . . 0.0 112.788 177.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.44 -44.11 76.04 Favored 'General case' 0 CA--C 1.528 0.113 0 O-C-N 121.136 -0.978 . . . . 0.0 110.861 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -67.28 -48.88 66.36 Favored 'General case' 0 N--CA 1.452 -0.369 0 O-C-N 121.457 -0.777 . . . . 0.0 110.226 176.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 11.2 mt -52.07 -46.92 43.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 O-C-N 119.516 -1.99 . . . . 0.0 112.547 177.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.305 0.6 OUTLIER -63.98 -49.0 74.2 Favored 'General case' 0 N--CA 1.436 -1.133 0 C-N-CA 124.914 1.285 . . . . 0.0 110.196 177.796 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.6 t -58.28 -37.07 74.27 Favored 'General case' 0 C--O 1.217 -0.616 0 O-C-N 120.978 -1.076 . . . . 0.0 109.842 177.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.8 mp -65.74 -41.18 92.48 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 121.199 1.818 . . . . 0.0 107.92 176.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.77 -42.15 71.36 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 120.203 -1.561 . . . . 0.0 110.345 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -84.0 -27.77 28.17 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 116.998 2.222 . . . . 0.0 116.998 177.486 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -79.45 160.12 70.77 Favored Pre-proline 0 C--O 1.239 0.518 0 N-CA-C 116.992 2.219 . . . . 0.0 116.992 -178.508 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -102.38 -92.66 0.0 OUTLIER 'Trans proline' 0 CA--C 1.544 1.004 0 C-N-CA 123.199 2.599 . . . . 0.0 110.937 176.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.0 t -102.08 -11.11 19.11 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 119.499 -2.001 . . . . 0.0 115.337 177.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.2 mp0 -68.53 -8.93 45.74 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 118.12 -2.863 . . . . 0.0 114.946 -177.132 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.466 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 61.8 m -42.95 -35.02 1.08 Allowed 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 125.26 1.424 . . . . 0.0 112.384 177.05 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -51.57 -39.96 58.85 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 123.544 1.64 . . . . 0.0 112.962 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -72.13 -46.63 55.81 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 122.677 1.227 . . . . 0.0 107.76 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.466 ' HG ' ' HA ' ' A' ' 41' ' ' SER . 0.8 OUTLIER -56.73 -29.33 62.4 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 124.609 2.147 . . . . 0.0 113.588 177.234 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 52.2 tp -77.11 -51.11 11.58 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 112.766 -2.015 . . . . 0.0 106.474 -178.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.7 -33.19 60.57 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 122.672 1.225 . . . . 0.0 108.31 176.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -64.55 -61.6 2.11 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 114.783 -1.099 . . . . 0.0 111.935 177.653 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -51.58 -38.05 52.66 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.963 0.887 . . . . 0.0 112.014 177.64 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -65.25 -43.89 89.89 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 121.675 0.75 . . . . 0.0 110.054 177.322 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.77 -39.95 95.78 Favored 'General case' 0 C--O 1.233 0.216 0 O-C-N 120.452 -1.405 . . . . 0.0 108.606 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.402 ' HB3' HE22 ' A' ' 55' ' ' GLN . 64.3 mt -62.88 -54.94 30.98 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 121.74 0.781 . . . . 0.0 109.707 177.346 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -44.82 -44.86 9.78 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 124.029 1.871 . . . . 0.0 111.466 -178.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -67.08 -46.66 73.61 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 111.702 -2.499 . . . . 0.0 111.751 177.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.61 -46.45 77.36 Favored 'General case' 0 C--O 1.233 0.204 0 O-C-N 120.942 -1.099 . . . . 0.0 111.444 177.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.402 HE22 ' HB3' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -84.98 14.13 5.26 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 177.676 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.54 158.02 74.11 Favored Pre-proline 0 CA--C 1.534 0.359 0 O-C-N 119.83 -1.794 . . . . 0.0 111.234 177.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -70.33 69.74 1.94 Allowed 'Trans proline' 0 CA--C 1.537 0.675 0 C-N-CA 124.404 3.403 . . . . 0.0 115.894 -178.266 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.536 0.411 0 C-N-CA 124.938 1.295 . . . . 0.0 112.822 177.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 33.5 m . . . . . 0 CA--C 1.529 0.154 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.407 ' CG ' ' H ' ' A' ' 3' ' ' ASN . 5.9 p-10 -77.68 -91.27 0.04 OUTLIER 'General case' 0 N--CA 1.445 -0.724 0 O-C-N 119.574 -1.954 . . . . 0.0 109.29 177.392 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.407 ' H ' ' CG ' ' A' ' 2' ' ' ASP . 24.3 m120 -132.63 5.81 4.01 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 177.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -52.58 -55.72 20.28 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 122.829 2.559 . . . . 0.0 114.121 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.492 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 14.3 m-85 -76.7 -178.78 4.96 Favored 'General case' 0 C--O 1.238 0.458 0 O-C-N 121.386 -0.821 . . . . 0.0 110.681 177.571 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.54 ' O ' ' HB3' ' A' ' 9' ' ' GLN . 36.0 m-80 -67.69 175.81 2.76 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 118.824 2.898 . . . . 0.0 118.824 -176.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.718 ' HD3' ' H ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -55.27 -77.77 0.02 OUTLIER 'General case' 0 C--O 1.238 0.488 0 C-N-CA 126.999 2.12 . . . . 0.0 115.35 -177.485 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.65 -46.6 58.49 Favored 'General case' 0 C--O 1.22 -0.456 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 177.752 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.54 ' HB3' ' O ' ' A' ' 6' ' ' ASN 0.266 1.4 tm0? -39.42 -61.06 0.84 Allowed 'General case' 0 N--CA 1.432 -1.343 0 C-N-CA 127.261 2.224 . . . . 0.0 113.024 176.802 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.407 HE22 ' H ' ' A' ' 5' ' ' PHE . 51.7 mm-40 -59.79 -37.15 78.32 Favored 'General case' 0 C--O 1.233 0.199 0 O-C-N 120.227 -1.545 . . . . 0.0 111.409 177.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 39.5 t-20 -59.26 -46.62 88.03 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.97 0.89 . . . . 0.0 109.194 177.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.448 ' O ' HD13 ' A' ' 16' ' ' ILE . . . -63.62 -37.03 85.78 Favored 'General case' 0 C--O 1.211 -0.932 0 C-N-CA 124.097 0.959 . . . . 0.0 109.142 177.369 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -54.23 -55.5 27.51 Favored 'General case' 0 C--O 1.237 0.416 0 O-C-N 119.708 -1.87 . . . . 0.0 108.723 177.535 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -58.21 -45.97 86.67 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 113.165 -1.834 . . . . 0.0 112.202 176.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.24 -43.42 74.55 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 123.039 1.4 . . . . 0.0 111.597 177.755 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.448 HD13 ' O ' ' A' ' 12' ' ' ALA . 0.7 OUTLIER -58.65 -52.91 54.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 C-N-CA 126.537 1.935 . . . . 0.0 109.94 178.063 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 49.5 mt -62.62 -36.17 81.91 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 122.098 0.952 . . . . 0.0 113.043 177.215 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 6.3 t-80 -62.6 -21.51 65.69 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 127.487 2.315 . . . . 0.0 116.14 177.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.507 HD12 HD22 ' A' ' 22' ' ' LEU . 21.6 mt -63.08 105.63 0.7 Allowed Pre-proline 0 C--N 1.328 -0.34 0 N-CA-C 118.315 2.709 . . . . 0.0 118.315 -176.658 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -72.81 -1.95 11.19 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 123.024 2.483 . . . . 0.0 112.64 178.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.481 HD21 ' ND2' ' A' ' 52' ' ' ASN . 36.2 p-10 -132.94 27.41 4.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 122.794 1.283 . . . . 0.0 114.3 178.068 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.507 HD22 HD12 ' A' ' 19' ' ' LEU . 7.2 tt -160.02 111.82 2.01 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 122.947 1.356 . . . . 0.0 109.203 177.267 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -154.82 2.94 0.21 Allowed 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 117.249 2.315 . . . . 0.0 117.249 -177.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.702 ' H ' ' CD ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -87.16 -132.88 0.07 Allowed 'General case' 0 N--CA 1.418 -2.05 0 CA-C-O 125.485 2.564 . . . . 0.0 112.796 -177.59 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.412 ' HA ' ' HB2' ' A' ' 28' ' ' ASN . 0.4 OUTLIER -76.3 -22.07 55.47 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 109.49 -3.504 . . . . 0.0 114.086 -177.227 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -73.86 -48.99 27.19 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 105.251 -2.129 . . . . 0.0 105.251 177.392 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.465 ' CZ ' ' HB3' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -56.4 -48.36 77.09 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-N 114.698 -1.137 . . . . 0.0 110.543 177.413 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.412 ' HB2' ' HA ' ' A' ' 25' ' ' GLU . 73.0 m-20 -59.97 -47.74 84.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 113.724 -1.58 . . . . 0.0 111.809 177.431 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.57 -48.09 78.13 Favored 'General case' 0 C--N 1.333 -0.13 0 O-C-N 121.089 -1.007 . . . . 0.0 110.087 178.074 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -61.99 -47.46 84.69 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 121.633 -0.667 . . . . 0.0 110.679 177.435 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ILE . . . . . 0.457 HD12 ' NH1' ' A' ' 27' ' ' ARG . 1.6 mt -52.42 -44.81 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 O-C-N 119.111 -2.243 . . . . 0.0 110.405 177.098 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.271 5.1 tp60 -60.92 -48.2 82.89 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 123.867 0.867 . . . . 0.0 110.383 177.456 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.6 t -65.13 -28.29 69.32 Favored 'General case' 0 C--O 1.225 -0.208 0 O-C-N 121.337 -0.852 . . . . 0.0 111.714 177.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.7 mp -78.67 -24.61 45.03 Favored 'General case' 0 N--CA 1.445 -0.69 0 O-C-N 119.857 -1.777 . . . . 0.0 108.432 176.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.492 ' HA ' ' CE2' ' A' ' 5' ' ' PHE . 1.1 pttm -69.09 -54.09 16.84 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 102.375 -3.194 . . . . 0.0 102.375 176.067 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.431 ' CG ' ' HZ3' ' A' ' 35' ' ' LYS . 70.3 m-20 -91.31 70.13 6.06 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-O 124.086 1.898 . . . . 0.0 108.581 177.013 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.505 ' CG ' HE21 ' A' ' 9' ' ' GLN . 24.4 t0 -75.28 115.65 47.13 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 111.482 -2.599 . . . . 0.0 115.068 -177.415 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 0.2 OUTLIER -97.19 -121.02 0.0 OUTLIER 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 125.246 3.964 . . . . 0.0 114.532 177.916 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.5 p -102.5 -59.72 1.66 Allowed 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 117.63 2.456 . . . . 0.0 117.63 179.463 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.446 ' CD ' ' H ' ' A' ' 40' ' ' GLN . 1.1 pm0 -69.95 32.51 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 119.269 3.063 . . . . 0.0 119.269 -176.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.59 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 18.9 m -52.4 -39.39 60.84 Favored 'General case' 0 N--CA 1.475 0.775 0 O-C-N 119.279 -2.138 . . . . 0.0 113.62 178.609 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.8 -38.6 72.79 Favored 'General case' 0 CA--C 1.538 0.488 0 O-C-N 120.297 -1.502 . . . . 0.0 109.092 176.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -64.94 -55.21 20.54 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 104.339 -2.467 . . . . 0.0 104.339 177.521 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.59 ' HG ' ' HA ' ' A' ' 41' ' ' SER . 2.1 mt -48.37 -28.36 3.14 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 177.22 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 13.4 tp -74.89 -54.45 7.23 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 -178.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.17 -35.48 69.61 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 113.506 -1.679 . . . . 0.0 110.598 177.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -64.47 -62.01 1.86 Allowed 'General case' 0 C--O 1.237 0.435 0 CA-C-O 122.685 1.231 . . . . 0.0 111.125 -178.28 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -51.96 -43.13 63.4 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 123.457 1.599 . . . . 0.0 111.02 177.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 35.7 tptt -58.94 -41.9 88.52 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.197 -1.365 . . . . 0.0 110.947 177.788 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.403 ' N ' ' HZ2' ' A' ' 50' ' ' LYS . 0.2 OUTLIER -63.34 -38.45 91.18 Favored 'General case' 0 N--CA 1.457 -0.077 0 O-C-N 120.399 -1.438 . . . . 0.0 108.591 -179.695 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 71.5 mt -59.6 -49.65 76.95 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 122.904 1.335 . . . . 0.0 110.418 177.188 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.667 ' C ' HD22 ' A' ' 52' ' ' ASN . 0.0 OUTLIER -50.68 -49.75 56.55 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-O 124.156 1.932 . . . . 0.0 112.51 177.366 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -62.39 -49.12 76.77 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 111.643 -2.526 . . . . 0.0 111.379 177.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.9 -44.77 86.98 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 121.25 -0.906 . . . . 0.0 113.01 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -80.09 8.87 6.31 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 177.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -75.29 -177.69 0.73 Allowed Pre-proline 0 CA--C 1.546 0.817 0 O-C-N 119.945 -1.722 . . . . 0.0 113.201 177.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -72.27 58.92 3.03 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 124.434 3.423 . . . . 0.0 115.157 177.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.515 0 C-N-CA 125.383 1.473 . . . . 0.0 112.28 -179.419 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' VAL . . . . . 0.46 ' N ' ' OD1' ' A' ' 6' ' ' ASN . 6.8 t . . . . . 0 CA--C 1.532 0.261 0 CA-C-O 117.1 -1.428 . . . . 0.0 110.633 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.36 -160.79 0.16 Allowed 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 123.619 2.918 . . . . 0.0 113.629 -177.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 9.0 p-10 -69.68 -26.51 64.41 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 119.091 -2.255 . . . . 0.0 112.943 177.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -85.9 -60.49 2.0 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 113.912 -1.495 . . . . 0.0 112.564 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.424 ' CZ ' ' HA ' ' A' ' 35' ' ' LYS . 5.9 m-30 -70.53 62.29 0.25 Allowed 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 117.008 2.225 . . . . 0.0 117.008 -177.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.46 ' OD1' ' N ' ' A' ' 1' ' ' VAL . 77.3 m-20 -150.26 -40.96 0.13 Allowed 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 125.822 1.649 . . . . 0.0 111.787 177.45 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -88.26 -150.44 0.18 Allowed 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 117.032 2.234 . . . . 0.0 117.032 -177.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -52.85 -29.63 29.06 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 120.478 -1.389 . . . . 0.0 113.469 -177.166 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.418 ' NE2' ' O ' ' A' ' 34' ' ' LEU 0.314 3.0 tm0? -38.06 -52.32 1.4 Allowed 'General case' 0 N--CA 1.425 -1.687 0 C-N-CA 128.537 2.735 . . . . 0.0 111.815 177.655 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 48.0 mm-40 -72.82 -31.37 64.75 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.06 -0.973 . . . . 0.0 112.073 -178.014 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 40.2 t-20 -64.81 -45.36 86.58 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 177.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.7 -42.46 98.97 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-O 121.153 0.502 . . . . 0.0 110.566 177.473 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -55.45 -50.83 68.81 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 123.672 1.701 . . . . 0.0 111.716 177.37 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -60.5 -46.89 88.47 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 113.876 -1.511 . . . . 0.0 111.007 177.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.62 -41.84 74.06 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 122.753 1.264 . . . . 0.0 108.886 177.648 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -57.14 -56.65 13.66 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 177.079 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 69.6 mt -55.79 -28.9 58.48 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 122.883 1.325 . . . . 0.0 113.521 177.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -72.26 -13.2 61.45 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.544 1.538 . . . . 0.0 113.522 177.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 80.8 mt -55.13 119.76 25.15 Favored Pre-proline 0 CA--C 1.544 0.741 0 O-C-N 119.985 -1.697 . . . . 0.0 112.093 177.906 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -73.86 -11.17 23.65 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 125.129 3.886 . . . . 0.0 118.795 -177.224 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.497 HD21 ' HB2' ' A' ' 56' ' ' ALA . 4.4 p-10 -155.45 58.93 0.63 Allowed 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 124.27 1.986 . . . . 0.0 112.737 177.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.6 tt -160.28 123.0 3.36 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 112.139 -2.3 . . . . 0.0 108.269 177.409 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -154.33 -13.29 0.13 Allowed 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 117.061 2.245 . . . . 0.0 117.061 -177.753 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.657 ' H ' ' CD ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -75.89 -132.3 0.01 OUTLIER 'General case' 0 N--CA 1.425 -1.701 0 CA-C-O 125.911 2.767 . . . . 0.0 113.283 -177.478 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.408 ' HA ' ' HB3' ' A' ' 28' ' ' ASN . 0.0 OUTLIER -66.07 -27.32 67.99 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 109.69 -3.414 . . . . 0.0 115.159 -177.072 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -74.1 -52.97 10.96 Favored 'General case' 0 N--CA 1.441 -0.896 0 N-CA-C 105.653 -1.98 . . . . 0.0 105.653 177.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -48.93 -49.11 41.77 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 124.355 2.026 . . . . 0.0 111.665 177.625 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.408 ' HB3' ' HA ' ' A' ' 25' ' ' GLU . 47.9 t-20 -55.73 -58.49 7.63 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 109.59 -3.459 . . . . 0.0 111.719 178.008 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.6 -46.57 88.55 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 121.599 -0.688 . . . . 0.0 111.324 -178.163 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -61.5 -46.33 90.43 Favored 'General case' 0 C--O 1.219 -0.502 0 O-C-N 121.188 -0.945 . . . . 0.0 109.859 177.511 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 29.4 mt -54.62 -51.66 48.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-N 121.425 1.92 . . . . 0.0 110.775 177.077 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.37 -56.6 9.06 Favored 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 125.88 1.672 . . . . 0.0 111.501 177.613 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.0 t -63.3 -30.78 71.86 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 112.205 -2.271 . . . . 0.0 111.506 178.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.418 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 1.4 mm? -65.5 -45.0 85.28 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 105.875 -1.898 . . . . 0.0 105.875 177.167 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . 0.479 ' HZ3' ' CG ' ' A' ' 36' ' ' ASP . 0.0 OUTLIER -60.17 -42.21 94.5 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 119.958 -1.714 . . . . 0.0 110.709 177.419 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.479 ' CG ' ' HZ3' ' A' ' 35' ' ' LYS . 45.4 m-20 -70.97 -46.27 62.62 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 117.503 2.408 . . . . 0.0 117.503 177.545 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -79.64 142.3 57.18 Favored Pre-proline 0 CA--C 1.531 0.232 0 N-CA-C 119.575 3.176 . . . . 0.0 119.575 -178.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.46 ' HG2' ' H ' ' A' ' 39' ' ' SER . 89.1 Cg_endo -86.51 -74.35 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.098 1.865 . . . . 0.0 110.323 176.286 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.46 ' H ' ' HG2' ' A' ' 38' ' ' PRO . 61.0 m -102.25 -18.34 15.52 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 120.689 3.589 . . . . 0.0 120.689 -177.738 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -70.79 -9.71 58.0 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 125.866 3.939 . . . . 0.0 114.296 -177.067 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.402 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 74.9 m -43.87 -29.13 0.51 Allowed 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 125.664 1.586 . . . . 0.0 114.214 177.795 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.19 -44.43 97.3 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 124.195 1.95 . . . . 0.0 109.572 177.245 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 61.4 t-20 -71.37 -52.73 17.07 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 105.15 -2.167 . . . . 0.0 105.15 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.402 ' HG ' ' HA ' ' A' ' 41' ' ' SER . 1.1 mt -51.45 -29.51 16.4 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 123.834 1.778 . . . . 0.0 114.69 177.561 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 63.0 tp -74.46 -50.67 17.4 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 -177.622 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.8 -37.98 71.9 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 113.821 -1.536 . . . . 0.0 107.497 177.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -63.63 -52.52 60.46 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 119.498 -0.881 . . . . 0.0 110.992 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -54.42 -40.73 68.56 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 122.428 1.108 . . . . 0.0 111.417 177.312 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.508 ' HZ2' ' HB2' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -63.96 -41.49 97.55 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 121.115 -0.991 . . . . 0.0 110.509 177.288 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -61.89 -39.07 90.68 Favored 'General case' 0 CA--C 1.519 -0.241 0 O-C-N 121.105 -0.997 . . . . 0.0 108.7 177.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 53.4 mt -62.3 -45.58 92.61 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 122.141 0.972 . . . . 0.0 110.454 177.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -59.21 -49.61 77.17 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 119.498 -2.001 . . . . 0.0 110.668 177.552 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -52.91 -42.75 65.66 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 124.999 1.319 . . . . 0.0 111.31 177.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.01 -30.47 70.32 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.527 -0.733 . . . . 0.0 111.74 177.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -82.53 -34.31 27.92 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 123.025 1.393 . . . . 0.0 111.994 177.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.497 ' HB2' HD21 ' A' ' 21' ' ' ASN . . . -67.89 138.37 92.8 Favored Pre-proline 0 CA--C 1.542 0.645 0 CA-C-N 114.784 -1.098 . . . . 0.0 113.378 177.825 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -45.29 166.98 0.05 OUTLIER 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 125.251 3.967 . . . . 0.0 118.261 179.127 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm . . . . . 0 CA--C 1.534 0.331 0 CA-C-N 114.164 -1.38 . . . . 0.0 110.279 -177.823 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.452 -0.329 0 CA-C-O 121.958 0.885 . . . . 0.0 110.962 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . 0.266 7.6 tt0 -45.95 -55.56 6.63 Favored 'General case' 0 N--CA 1.425 -1.702 0 C-N-CA 127.609 2.364 . . . . 0.0 110.925 177.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.2 mm-40 -70.04 -45.3 67.44 Favored 'General case' 0 CA--C 1.512 -0.486 0 O-C-N 118.743 -2.473 . . . . 0.0 112.894 177.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -50.57 -49.05 57.24 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 123.788 1.756 . . . . 0.0 111.39 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.543 ' HA ' HD22 ' A' ' 45' ' ' LEU . . . -61.17 -43.53 98.74 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 111.166 -2.743 . . . . 0.0 110.801 177.47 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -54.79 -51.37 65.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 123.36 1.552 . . . . 0.0 111.556 177.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -58.59 -55.84 29.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 113.16 -1.836 . . . . 0.0 111.033 177.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -53.52 -37.87 63.2 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 123.64 1.686 . . . . 0.0 110.1 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.457 ' O ' ' NH1' ' A' ' 27' ' ' ARG . 1.6 mt -61.24 -60.69 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 177.161 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 96.2 mt -53.12 -35.81 60.08 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 121.294 1.861 . . . . 0.0 113.318 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -61.8 -19.64 62.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 112.9 -1.954 . . . . 0.0 114.072 177.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.489 ' HB2' HH11 ' A' ' 27' ' ' ARG . 70.5 mt -59.45 115.28 11.83 Favored Pre-proline 0 CA--C 1.537 0.445 0 O-C-N 120.661 -1.274 . . . . 0.0 111.196 177.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -80.57 -13.79 11.86 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 123.61 2.873 . . . . 0.0 115.592 -177.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.586 ' ND2' ' HB3' ' A' ' 56' ' ' ALA . 1.5 p-10 -139.38 40.35 2.07 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 125.612 2.625 . . . . 0.0 113.536 -178.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.458 HD11 ' HB2' ' A' ' 26' ' ' GLN . 7.8 tt -149.7 121.84 8.32 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 103.849 -2.649 . . . . 0.0 103.849 177.28 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.454 ' HA ' ' HE ' ' A' ' 27' ' ' ARG . 6.4 t30 -153.35 -19.32 0.15 Allowed 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 -177.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.647 ' H ' ' CD ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -73.36 -133.04 0.01 OUTLIER 'General case' 0 N--CA 1.424 -1.774 0 CA-C-O 126.052 2.834 . . . . 0.0 113.128 -177.54 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.533 ' HA ' HD22 ' A' ' 28' ' ' ASN . 0.3 OUTLIER -61.34 -30.8 70.74 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 109.028 -3.715 . . . . 0.0 114.637 -177.017 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.499 HE22 ' NE2' ' A' ' 55' ' ' GLN . 19.0 mt-30 -69.68 -50.71 41.25 Favored 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 177.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.489 HH11 ' HB2' ' A' ' 19' ' ' LEU . 2.1 tpp180 -50.77 -48.43 59.29 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 122.277 1.037 . . . . 0.0 110.898 177.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.533 HD22 ' HA ' ' A' ' 25' ' ' GLU . 68.9 m-80 -57.19 -54.0 51.72 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 114.005 -1.452 . . . . 0.0 111.672 177.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.41 -47.42 75.94 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-O 121.654 0.74 . . . . 0.0 110.595 -178.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.424 ' CD2' ' HB2' ' A' ' 48' ' ' ALA . 50.0 m-85 -61.9 -47.89 82.94 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 118.139 -0.934 . . . . 0.0 110.566 177.41 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 84.2 mt -54.44 -46.05 70.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-N 121.877 2.126 . . . . 0.0 110.247 177.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.31 5.7 tp60 -56.61 -50.64 71.39 Favored 'General case' 0 N--CA 1.44 -0.952 0 C-N-CA 124.798 1.239 . . . . 0.0 112.146 178.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 20.2 t -63.09 -42.01 99.51 Favored 'General case' 0 C--O 1.217 -0.611 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -58.56 -38.43 77.85 Favored 'General case' 0 CA--C 1.529 0.172 0 O-C-N 120.106 -1.621 . . . . 0.0 111.92 177.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.9 ttpm? -68.15 -43.88 77.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 113.624 -1.626 . . . . 0.0 113.574 177.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -88.53 -42.44 12.08 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 116.823 2.157 . . . . 0.0 116.823 177.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -96.11 133.49 25.08 Favored Pre-proline 0 CA--C 1.543 0.691 0 N-CA-C 118.717 2.858 . . . . 0.0 118.717 -177.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -71.14 -83.48 0.01 OUTLIER 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 124.287 3.324 . . . . 0.0 116.08 177.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.3 m -100.74 -11.24 20.08 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 118.407 2.744 . . . . 0.0 118.407 -177.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -69.46 -36.21 76.36 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 125.477 3.762 . . . . 0.0 111.529 -177.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.507 ' HA ' ' CG ' ' A' ' 44' ' ' LEU . 60.3 m -49.84 -27.1 4.64 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 112.244 -2.253 . . . . 0.0 113.969 -179.183 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.431 ' O ' ' HB3' ' A' ' 45' ' ' LEU . . . -60.98 -36.86 80.56 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 121.748 2.067 . . . . 0.0 112.364 177.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -65.9 -41.88 90.92 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 125.28 2.467 . . . . 0.0 106.739 177.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.507 ' CG ' ' HA ' ' A' ' 41' ' ' SER . 0.7 OUTLIER -66.21 -21.79 66.32 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 112.455 -2.157 . . . . 0.0 112.972 177.122 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.543 HD22 ' HA ' ' A' ' 12' ' ' ALA . 14.8 tp -70.93 -49.25 47.71 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 104.597 -2.371 . . . . 0.0 104.597 177.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.79 -37.81 69.08 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 113.262 -1.79 . . . . 0.0 106.679 176.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -64.11 -49.96 70.15 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 118.416 -1.314 . . . . 0.0 112.447 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.424 ' HB2' ' CD2' ' A' ' 30' ' ' PHE . . . -52.68 -44.94 66.57 Favored 'General case' 0 C--O 1.236 0.378 0 O-C-N 120.293 -1.505 . . . . 0.0 111.454 177.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 25.6 tptp -61.11 -44.82 96.76 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 121.432 -0.793 . . . . 0.0 111.641 177.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 21.6 mmmt -66.56 -28.62 68.67 Favored 'General case' 0 CA--C 1.511 -0.553 0 O-C-N 121.072 -1.017 . . . . 0.0 110.609 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.436 ' HA ' HD23 ' A' ' 51' ' ' LEU . 37.1 mt -66.58 -46.81 74.75 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 122.539 1.161 . . . . 0.0 108.454 176.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.488 ' ND2' HD21 ' A' ' 21' ' ' ASN . 0.7 OUTLIER -49.3 -51.31 34.81 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 124.633 2.158 . . . . 0.0 108.067 177.427 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 38.3 m-20 -60.63 -40.04 90.48 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 112.076 -2.329 . . . . 0.0 111.778 177.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.45 -44.35 89.18 Favored 'General case' 0 CA--C 1.517 -0.307 0 O-C-N 120.182 -1.574 . . . . 0.0 111.724 177.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.499 ' NE2' HE22 ' A' ' 26' ' ' GLN . 1.8 pm0 -74.48 -50.67 17.34 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 116.977 -1.889 . . . . 0.0 110.923 177.203 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.586 ' HB3' ' ND2' ' A' ' 21' ' ' ASN . . . . . . . . 0 CA--C 1.553 1.062 0 N-CA-C 114.514 1.302 . . . . 0.0 114.514 177.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.461 0.096 0 CA-C-O 123.458 1.599 . . . . 0.0 108.559 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . 0.274 8.2 tt0 -43.38 -45.41 6.12 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 127.655 2.382 . . . . 0.0 110.778 177.372 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -73.21 -44.63 59.36 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 112.877 -1.965 . . . . 0.0 113.473 178.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 18.8 t30 -54.71 -47.19 74.04 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-O 123.857 1.789 . . . . 0.0 108.931 177.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.424 ' CB ' HD22 ' A' ' 45' ' ' LEU . . . -57.9 -48.05 81.01 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 111.678 -2.51 . . . . 0.0 111.307 177.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -55.29 -41.62 72.53 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 124.253 1.978 . . . . 0.0 111.949 177.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -62.71 -52.35 63.59 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 112.955 -1.929 . . . . 0.0 110.426 177.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -53.06 -42.88 66.23 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 122.178 0.989 . . . . 0.0 109.648 177.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.435 ' O ' ' HD2' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -54.29 -59.47 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.159 0 CA-C-N 114.563 -1.199 . . . . 0.0 109.636 177.496 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 35.0 mt -49.69 -49.4 47.74 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.902 0.858 . . . . 0.0 111.377 177.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -61.5 -10.84 8.66 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 113.608 -1.633 . . . . 0.0 115.347 178.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 75.7 mt -58.56 104.72 0.45 Allowed Pre-proline 0 CA--C 1.541 0.617 0 CA-C-N 122.307 2.322 . . . . 0.0 111.26 177.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -82.08 -4.17 11.82 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 124.191 3.261 . . . . 0.0 116.657 -177.025 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -140.64 44.15 1.84 Allowed 'General case' 0 N--CA 1.456 -0.157 0 CA-C-O 123.309 1.528 . . . . 0.0 112.485 177.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.405 ' HB2' ' HB2' ' A' ' 52' ' ' ASN . 1.7 tt -126.94 137.93 53.2 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 113.333 -1.758 . . . . 0.0 106.679 177.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -67.82 131.49 45.64 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 124.141 1.924 . . . . 0.0 113.698 -177.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -40.59 -45.48 2.32 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 112.983 -1.917 . . . . 0.0 114.778 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.533 ' CD ' ' H ' ' A' ' 25' ' ' GLU . 16.1 mp0 -55.79 -55.25 34.61 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 123.247 1.498 . . . . 0.0 111.2 177.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.431 ' NE2' ' HB3' ' A' ' 51' ' ' LEU . 35.0 tt0 -59.06 -38.97 80.68 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.305 177.18 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.435 ' HD2' ' O ' ' A' ' 16' ' ' ILE . 0.0 OUTLIER -56.62 -50.73 71.16 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 120.731 -1.231 . . . . 0.0 108.123 176.963 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 46.9 m-80 -57.99 -46.14 85.68 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 177.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.16 -47.51 78.11 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 122.117 0.961 . . . . 0.0 109.414 177.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -62.44 -50.67 70.54 Favored 'General case' 0 C--O 1.217 -0.61 0 O-C-N 121.447 -0.783 . . . . 0.0 110.111 177.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.7 mt -45.6 -49.82 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-O 123.359 1.552 . . . . 0.0 112.387 177.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.429 ' O ' ' HB3' ' A' ' 35' ' ' LYS 0.405 4.8 tp-100 -60.0 -56.23 24.26 Favored 'General case' 0 N--CA 1.424 -1.726 0 CA-C-N 113.522 -1.672 . . . . 0.0 109.169 179.265 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.9 t -61.62 -33.83 74.61 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 120.443 -1.41 . . . . 0.0 114.064 177.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 31.7 mt -65.95 -36.18 82.64 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 125.397 1.479 . . . . 0.0 109.668 177.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.429 ' HB3' ' O ' ' A' ' 32' ' ' GLN . 1.3 ttpm? -66.59 -41.08 89.04 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 114.48 -1.236 . . . . 0.0 109.779 176.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -71.83 -66.68 0.61 Allowed 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 115.802 1.779 . . . . 0.0 115.802 177.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -102.83 126.76 31.73 Favored Pre-proline 0 C--O 1.239 0.535 0 CA-C-N 120.656 1.571 . . . . 0.0 114.215 -177.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -77.82 -50.09 0.09 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 123.091 2.528 . . . . 0.0 114.713 177.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 95.8 p -60.5 -43.51 96.95 Favored 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 -177.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.461 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 58.0 mt-30 -74.51 -21.23 59.65 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 117.766 -1.111 . . . . 0.0 112.929 -178.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.491 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 94.2 p -48.35 -37.73 17.43 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 121.238 1.836 . . . . 0.0 114.515 -177.318 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.33 -42.19 77.3 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 123.655 1.693 . . . . 0.0 109.739 177.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.452 HD22 ' HA ' ' A' ' 43' ' ' ASN . 1.7 t-20 -70.75 -52.6 19.76 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 105.993 -1.854 . . . . 0.0 105.993 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.491 ' HG ' ' HA ' ' A' ' 41' ' ' SER . 1.1 mt -50.31 -30.46 12.07 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 115.636 1.717 . . . . 0.0 115.636 177.29 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.424 HD22 ' CB ' ' A' ' 12' ' ' ALA . 26.3 tp -75.75 -52.95 9.3 Favored 'General case' 0 CA--C 1.504 -0.795 0 N-CA-C 107.308 -1.368 . . . . 0.0 107.308 -177.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.51 -41.08 63.11 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 113.073 -1.876 . . . . 0.0 107.811 177.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -65.98 -51.85 54.75 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 119.174 -1.01 . . . . 0.0 112.397 -177.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.13 -38.77 73.97 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 120.503 -1.373 . . . . 0.0 112.208 177.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 9.1 tmtm? -65.4 -45.11 85.29 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.752 0.787 . . . . 0.0 109.552 177.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 46.8 mtpt -60.59 -41.22 94.24 Favored 'General case' 0 C--O 1.233 0.218 0 O-C-N 119.915 -1.741 . . . . 0.0 108.859 -178.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.537 ' C ' HE21 ' A' ' 55' ' ' GLN . 39.4 mt -65.64 -51.1 62.12 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 114.418 -1.265 . . . . 0.0 110.955 177.531 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.405 ' HB2' ' HB2' ' A' ' 22' ' ' LEU . 2.1 t30 -46.85 -49.68 19.75 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 123.856 1.789 . . . . 0.0 110.975 178.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -62.6 -46.89 86.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 111.684 -2.507 . . . . 0.0 111.263 177.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.3 -39.93 73.52 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 119.299 -2.126 . . . . 0.0 110.809 176.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.537 HE21 ' C ' ' A' ' 51' ' ' LEU . 39.8 mt-30 -75.41 -5.69 46.24 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.332 1.053 . . . . 0.0 112.902 177.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.308 0 O-C-N 120.092 -1.63 . . . . 0.0 113.555 -177.67 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.447 -0.602 0 CA-C-O 123.417 1.579 . . . . 0.0 108.649 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.48 ' HA ' HD11 ' A' ' 34' ' ' LEU 0.329 0.1 OUTLIER -44.63 -80.61 0.01 OUTLIER 'General case' 0 N--CA 1.426 -1.675 0 N-CA-C 117.197 2.295 . . . . 0.0 117.197 -176.989 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 -65.49 -25.61 67.55 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 111.448 -2.614 . . . . 0.0 112.297 -179.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.41 -49.78 62.33 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 120.531 1.514 . . . . 0.0 107.569 177.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.556 ' HA ' HD22 ' A' ' 45' ' ' LEU . . . -58.06 -45.51 86.95 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.061 177.289 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -53.2 -51.14 63.07 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 123.652 1.691 . . . . 0.0 111.266 177.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -54.45 -55.58 27.49 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 113.636 -1.62 . . . . 0.0 112.296 177.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -61.73 -33.36 73.91 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 121.708 0.766 . . . . 0.0 111.362 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 14.6 mt -60.48 -53.39 49.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 O-C-N 120.359 -1.463 . . . . 0.0 108.354 177.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.438 ' HA ' ' HD3' ' A' ' 27' ' ' ARG . 51.9 mt -51.22 -49.74 60.49 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 122.856 1.313 . . . . 0.0 110.297 177.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 26.8 t-80 -59.39 -16.53 23.67 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 112.661 -2.063 . . . . 0.0 116.208 179.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.401 HD13 HD13 ' A' ' 22' ' ' LEU . 71.7 mt -58.33 102.55 0.31 Allowed Pre-proline 0 CA--C 1.547 0.847 0 CA-C-N 122.926 2.603 . . . . 0.0 114.733 -177.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -80.52 -17.0 10.28 Favored 'Trans proline' 0 N--CA 1.463 -0.299 0 C-N-CA 123.47 2.78 . . . . 0.0 114.37 -177.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.811 HD22 ' HB2' ' A' ' 56' ' ' ALA . 1.5 p-10 -118.61 40.66 3.18 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 126.223 2.916 . . . . 0.0 111.204 177.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.401 HD13 HD13 ' A' ' 19' ' ' LEU . 1.0 OUTLIER -141.19 141.55 34.07 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 109.725 -3.398 . . . . 0.0 106.68 177.435 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -87.55 158.68 18.85 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 122.36 1.076 . . . . 0.0 112.846 -177.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -50.25 -43.53 53.14 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.036 -0.984 . . . . 0.0 112.413 178.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -52.47 -54.93 25.83 Favored 'General case' 0 C--O 1.237 0.422 0 O-C-N 121.547 -0.72 . . . . 0.0 111.83 177.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.561 ' NE2' HE22 ' A' ' 55' ' ' GLN . 32.7 mt-30 -60.56 -43.91 96.73 Favored 'General case' 0 C--N 1.343 0.31 0 O-C-N 120.409 -1.432 . . . . 0.0 110.49 177.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.438 ' HD3' ' HA ' ' A' ' 17' ' ' LEU . 20.3 ttm-85 -50.83 -54.55 22.81 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 122.336 1.065 . . . . 0.0 110.931 178.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 62.1 m-80 -60.25 -44.12 95.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.577 177.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.29 -47.76 77.99 Favored 'General case' 0 CA--C 1.528 0.099 0 O-C-N 120.715 -1.24 . . . . 0.0 110.807 177.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -63.22 -45.04 93.52 Favored 'General case' 0 C--N 1.331 -0.208 0 O-C-N 121.389 -0.82 . . . . 0.0 110.287 177.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 34.1 mt -53.55 -47.73 59.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-O 122.822 1.296 . . . . 0.0 110.409 176.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.323 1.5 tp60 -55.4 -49.63 71.84 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 125.127 1.371 . . . . 0.0 110.703 177.166 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 34.2 t -63.58 -32.93 74.55 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.128 177.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.48 HD11 ' HA ' ' A' ' 9' ' ' GLN . 0.1 OUTLIER -62.77 -37.92 88.55 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.546 1.539 . . . . 0.0 109.99 177.63 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.21 -49.1 65.82 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 113.056 -1.884 . . . . 0.0 110.041 177.106 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -72.26 -48.13 44.93 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 116.407 2.002 . . . . 0.0 116.407 177.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.457 ' HB3' HD11 ' A' ' 44' ' ' LEU . 29.1 t0 -79.47 118.72 73.95 Favored Pre-proline 0 CA--C 1.535 0.381 0 N-CA-C 116.488 2.033 . . . . 0.0 116.488 -177.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 37' ' ' ASP . 8.2 Cg_exo -95.64 -14.55 0.56 Allowed 'Trans proline' 0 CA--C 1.532 0.419 0 C-N-CA 125.096 3.864 . . . . 0.0 113.262 177.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 60.6 p -100.77 -39.97 7.56 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 119.046 2.98 . . . . 0.0 119.046 -177.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.42 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 36.1 mt-30 -121.72 43.25 2.89 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 120.73 3.604 . . . . 0.0 120.73 -177.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.531 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 58.2 m -54.64 -36.41 64.52 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 125.609 3.822 . . . . 0.0 111.62 179.068 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.97 -37.36 66.41 Favored 'General case' 0 C--O 1.223 -0.311 0 O-C-N 120.018 -1.676 . . . . 0.0 109.589 176.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.418 ' CG ' ' HB3' ' A' ' 40' ' ' GLN . 1.8 m-20 -62.98 -50.12 72.02 Favored 'General case' 0 C--O 1.223 -0.314 0 O-C-N 120.227 -1.545 . . . . 0.0 107.245 177.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.531 ' HG ' ' HA ' ' A' ' 41' ' ' SER . 1.1 mt -54.83 -34.62 63.04 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 115.442 1.645 . . . . 0.0 115.442 177.285 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.556 HD22 ' HA ' ' A' ' 12' ' ' ALA . 29.0 tp -76.61 -50.18 14.46 Favored 'General case' 0 CA--C 1.509 -0.61 0 C-N-CA 124.887 1.275 . . . . 0.0 108.987 -177.312 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.72 -34.51 71.42 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 113.771 -1.559 . . . . 0.0 107.302 177.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -64.79 -58.23 6.8 Favored 'General case' 0 CA--C 1.522 -0.13 0 CA-C-O 122.056 0.932 . . . . 0.0 113.057 178.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -53.52 -39.86 65.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.85 0.833 . . . . 0.0 112.756 177.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -67.81 -41.19 83.5 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.197 177.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.3 mtpm? -60.65 -40.93 93.84 Favored 'General case' 0 CA--C 1.511 -0.525 0 O-C-N 120.725 -1.234 . . . . 0.0 109.448 178.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 19.9 mt -64.29 -53.41 49.38 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.024 -1.444 . . . . 0.0 109.247 177.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.401 ' HA ' ' NE2' ' A' ' 55' ' ' GLN . 2.4 t30 -49.06 -46.61 44.73 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 123.003 1.383 . . . . 0.0 112.13 -178.061 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -69.26 -50.22 48.96 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 113.533 -1.667 . . . . 0.0 111.478 177.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.68 -42.52 79.19 Favored 'General case' 0 N--CA 1.458 -0.058 0 O-C-N 120.402 -1.436 . . . . 0.0 113.424 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.561 HE22 ' NE2' ' A' ' 26' ' ' GLN . 1.2 pt20 -78.24 -0.58 29.14 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 121.217 -0.927 . . . . 0.0 112.944 179.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.811 ' HB2' HD22 ' A' ' 21' ' ' ASN . . . . . . . . 0 CA--C 1.541 0.608 0 CA-C-O 116.125 -1.893 . . . . 0.0 115.291 -177.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.303 0 CA-C-O 122.293 1.044 . . . . 0.0 112.592 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.408 ' HA ' ' CB ' ' A' ' 41' ' ' SER . 1.5 tm0? -37.41 -55.47 1.05 Allowed 'General case' 0 N--CA 1.422 -1.873 0 C-N-CA 129.061 2.944 . . . . 0.0 114.952 177.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -72.13 -36.23 69.33 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 118.733 -1.187 . . . . 0.0 112.619 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -58.89 -49.05 79.24 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 121.194 1.815 . . . . 0.0 107.75 177.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.624 ' HA ' HD22 ' A' ' 45' ' ' LEU . . . -56.12 -44.37 79.06 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 113.203 -1.817 . . . . 0.0 110.376 177.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -52.57 -55.63 20.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 123.523 1.63 . . . . 0.0 111.3 177.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -56.98 -44.47 82.72 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.568 -1.196 . . . . 0.0 111.618 177.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.449 ' HB3' HD11 ' A' ' 45' ' ' LEU . 0.0 OUTLIER -59.1 -46.12 89.11 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 123.017 1.389 . . . . 0.0 108.947 177.358 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.2 mt -56.1 -46.81 81.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 O-C-N 119.845 -1.784 . . . . 0.0 109.585 -178.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 72.0 mt -65.23 -38.08 89.28 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.95 0.881 . . . . 0.0 111.189 177.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -59.61 -38.9 82.55 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.555 1.142 . . . . 0.0 113.175 177.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 87.2 mt -54.25 104.85 0.46 Allowed Pre-proline 0 CA--C 1.539 0.534 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 -178.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.454 ' C ' ' H ' ' A' ' 22' ' ' LEU . 33.4 Cg_endo -81.21 -50.72 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 123.525 2.816 . . . . 0.0 114.945 -177.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.6 HD21 ' CG ' ' A' ' 52' ' ' ASN . 2.5 p-10 -83.85 30.7 0.5 Allowed 'General case' 0 C--O 1.236 0.352 0 CA-C-O 125.579 2.609 . . . . 0.0 111.611 -177.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.469 ' HA ' ' NE2' ' A' ' 55' ' ' GLN . 6.8 tp -109.3 139.67 43.95 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 111.013 -2.812 . . . . 0.0 109.487 177.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.427 ' H ' ' NE2' ' A' ' 26' ' ' GLN . 48.4 t-20 -70.52 129.94 40.54 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 123.245 1.497 . . . . 0.0 110.145 177.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.5 mp0 -55.56 -27.26 47.99 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 120.427 -1.421 . . . . 0.0 112.117 177.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.529 ' HA ' ' ND2' ' A' ' 28' ' ' ASN . 1.8 tm-20 -60.47 -68.19 0.32 Allowed 'General case' 0 C--O 1.236 0.371 0 O-C-N 121.253 -0.904 . . . . 0.0 108.952 177.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.478 ' NE2' HE22 ' A' ' 55' ' ' GLN . 10.6 pt20 -50.8 -46.3 59.68 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 120.722 -1.236 . . . . 0.0 110.224 177.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 18.6 ttm105 -48.82 -51.37 29.83 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.134 -1.604 . . . . 0.0 112.356 177.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.529 ' ND2' ' HA ' ' A' ' 25' ' ' GLU . 12.7 p30 -61.33 -46.17 91.36 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 115.395 -0.821 . . . . 0.0 112.565 177.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.82 -44.51 66.73 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 122.32 1.057 . . . . 0.0 110.587 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.457 ' CE2' ' HA ' ' A' ' 48' ' ' ALA . 47.1 m-85 -62.47 -52.31 64.0 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 176.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 14.7 mt -50.17 -48.86 23.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 CA-C-O 122.338 1.066 . . . . 0.0 112.603 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.29 0.0 OUTLIER -60.51 -53.77 53.51 Favored 'General case' 0 N--CA 1.432 -1.367 0 C-N-CA 127.591 2.356 . . . . 0.0 111.639 -178.386 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 23.0 t -63.66 -41.99 98.15 Favored 'General case' 0 C--N 1.332 -0.187 0 O-C-N 120.694 -1.254 . . . . 0.0 110.941 177.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.421 HD13 HD23 ' A' ' 44' ' ' LEU . 21.1 tp -58.49 -41.33 85.09 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 121.029 -1.045 . . . . 0.0 112.557 177.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.78 -42.6 73.59 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.912 0.863 . . . . 0.0 111.15 177.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -73.51 -53.55 10.33 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 117.971 2.582 . . . . 0.0 117.971 -179.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.408 ' HB2' ' HD3' ' A' ' 38' ' ' PRO . 31.3 m-20 -143.7 -58.73 0.02 OUTLIER Pre-proline 0 C--O 1.237 0.41 0 N-CA-C 118.343 2.72 . . . . 0.0 118.343 -176.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.408 ' HD3' ' HB2' ' A' ' 37' ' ' ASP . 0.5 OUTLIER -43.65 127.69 6.24 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 124.36 3.373 . . . . 0.0 115.484 177.79 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.5 t -100.73 -28.67 12.7 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 111.268 -2.696 . . . . 0.0 112.058 -177.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.438 ' H ' ' CD ' ' A' ' 40' ' ' GLN . 0.4 OUTLIER -79.28 63.54 3.94 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 124.907 2.289 . . . . 0.0 110.386 177.759 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.408 ' CB ' ' HA ' ' A' ' 9' ' ' GLN . 66.8 p -55.21 -38.35 68.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 112.978 -1.919 . . . . 0.0 112.9 -178.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.89 -39.36 65.7 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.712 -0.617 . . . . 0.0 110.009 177.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -71.06 -55.5 8.11 Favored 'General case' 0 N--CA 1.454 -0.258 0 O-C-N 121.187 -0.946 . . . . 0.0 108.77 177.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.421 HD23 HD13 ' A' ' 34' ' ' LEU . 15.7 tp -57.25 -23.55 48.9 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-O 125.454 2.55 . . . . 0.0 111.751 -177.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.624 HD22 ' HA ' ' A' ' 12' ' ' ALA . 35.8 tp -77.42 -53.18 7.96 Favored 'General case' 0 CA--C 1.503 -0.865 0 CA-C-N 112.585 -2.098 . . . . 0.0 106.83 -177.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.44 -33.9 46.23 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 177.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -64.01 -59.26 4.71 Favored 'General case' 0 C--N 1.345 0.412 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.89 177.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.457 ' HA ' ' CE2' ' A' ' 30' ' ' PHE . . . -50.88 -43.09 59.51 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 122.944 1.354 . . . . 0.0 112.475 177.461 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.73 -40.29 96.74 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 121.39 -0.819 . . . . 0.0 110.096 177.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.87 -41.65 92.0 Favored 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 52.8 mt -63.36 -50.37 70.22 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 119.32 -0.952 . . . . 0.0 109.465 177.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.6 ' CG ' HD21 ' A' ' 21' ' ' ASN . 3.2 t-20 -49.9 -41.73 46.48 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 119.908 -1.745 . . . . 0.0 110.706 177.2 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -60.52 -50.29 74.13 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 114.222 -1.353 . . . . 0.0 112.093 177.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.97 -43.13 77.28 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 122.105 0.955 . . . . 0.0 111.723 177.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.478 HE22 ' NE2' ' A' ' 26' ' ' GLN . 0.0 OUTLIER -69.96 -54.29 13.96 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 115.423 1.638 . . . . 0.0 115.423 177.356 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.572 0 N-CA-C 117.247 2.314 . . . . 0.0 117.247 -177.959 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.506 ' HG3' ' HA ' ' A' ' 39' ' ' SER . 1.7 pm0 . . . . . 0 C--O 1.236 0.385 0 CA-C-O 124.521 2.105 . . . . 0.0 112.182 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.493 ' H ' ' HG2' ' A' ' 8' ' ' GLU 0.309 10.4 tt0 -53.53 -45.33 69.76 Favored 'General case' 0 N--CA 1.428 -1.527 0 C-N-CA 127.358 2.263 . . . . 0.0 110.051 177.798 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 33.5 mm-40 -70.04 -49.89 46.75 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.097 -0.956 . . . . 0.0 112.528 179.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -51.71 -45.8 63.68 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.029 1.286 . . . . 0.0 109.526 178.091 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.513 ' HA ' HD22 ' A' ' 45' ' ' LEU . . . -62.26 -42.44 99.34 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 114.582 -1.19 . . . . 0.0 112.242 177.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -57.76 -51.68 68.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 122.825 1.298 . . . . 0.0 112.826 177.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -57.14 -52.06 66.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.173 -0.921 . . . . 0.0 112.566 177.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -59.31 -38.07 79.32 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.164 -0.96 . . . . 0.0 109.651 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -56.01 -51.83 56.91 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 O-C-N 121.078 -1.014 . . . . 0.0 108.831 177.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 81.3 mt -52.65 -45.18 66.59 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 122.664 1.221 . . . . 0.0 109.632 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -66.41 -12.64 58.12 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 117.152 2.279 . . . . 0.0 117.152 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.777 HD13 HD13 ' A' ' 22' ' ' LEU . 57.3 mt -60.99 104.11 0.43 Allowed Pre-proline 0 CA--C 1.551 0.994 0 CA-C-N 123.778 2.99 . . . . 0.0 117.104 -177.391 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 19' ' ' LEU . 93.1 Cg_endo -63.05 -60.21 0.19 Allowed 'Trans proline' 0 CA--C 1.534 0.479 0 C-N-CA 123.77 2.98 . . . . 0.0 119.752 -177.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.644 HD22 ' HB2' ' A' ' 56' ' ' ALA . 1.3 p-10 -88.51 27.47 1.27 Allowed 'General case' 0 CA--C 1.523 -0.08 0 O-C-N 118.434 -2.666 . . . . 0.0 113.121 -177.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.777 HD13 HD13 ' A' ' 19' ' ' LEU . 6.8 tt -102.51 137.47 40.7 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 113.44 -1.709 . . . . 0.0 114.128 177.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 12.7 p30 -87.1 151.02 23.58 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 122.515 1.15 . . . . 0.0 112.832 177.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -62.82 -29.23 70.57 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 115.77 1.767 . . . . 0.0 115.77 -177.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.416 ' H ' ' CD ' ' A' ' 25' ' ' GLU . 1.7 mp0 -58.86 -51.21 71.01 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 124.186 1.946 . . . . 0.0 109.49 177.267 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.543 HE22 HD11 ' A' ' 22' ' ' LEU . 0.8 OUTLIER -62.64 -47.99 81.32 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 113.398 -1.728 . . . . 0.0 108.467 177.47 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.4 ' NH1' ' HB2' ' A' ' 19' ' ' LEU . 12.2 tpp180 -47.84 -52.44 19.01 Favored 'General case' 0 C--O 1.22 -0.486 0 O-C-N 121.196 -0.94 . . . . 0.0 111.112 177.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 37.8 t-20 -57.78 -52.05 67.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 113.462 -1.699 . . . . 0.0 111.879 177.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -51.41 -48.27 62.7 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 123.354 1.549 . . . . 0.0 110.425 177.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -64.96 -47.27 78.21 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.999 177.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 28.6 mt -51.01 -39.08 18.88 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-N 120.913 1.688 . . . . 0.0 110.369 176.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.306 5.0 tp60 -67.02 -54.21 23.91 Favored 'General case' 0 N--CA 1.435 -1.177 0 O-C-N 120.668 -1.27 . . . . 0.0 111.546 177.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.2 t -59.63 -35.15 73.82 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 119.986 -1.696 . . . . 0.0 111.67 177.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.438 HD11 ' CB ' ' A' ' 12' ' ' ALA . 2.5 mm? -60.12 -46.73 88.63 Favored 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 125.605 1.562 . . . . 0.0 107.914 176.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.81 -39.86 90.56 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 120.986 -1.071 . . . . 0.0 109.748 176.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 -72.76 -51.3 19.69 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 115.856 1.799 . . . . 0.0 115.856 177.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -105.66 125.68 32.69 Favored Pre-proline 0 CA--C 1.539 0.523 0 O-C-N 117.972 -2.955 . . . . 0.0 114.883 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -76.28 -72.93 0.01 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.754 2.303 . . . . 0.0 114.421 177.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.506 ' HA ' ' HG3' ' A' ' 8' ' ' GLU . 72.0 m -62.63 -29.47 70.64 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 118.451 -2.655 . . . . 0.0 114.897 -177.391 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.444 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 2.6 mp0 -70.14 -11.27 60.77 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 120.646 -1.284 . . . . 0.0 112.137 177.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 25.7 t -43.59 -39.6 3.59 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.945 1.298 . . . . 0.0 113.149 177.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.71 -38.22 72.02 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 120.842 -1.162 . . . . 0.0 111.926 177.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -71.62 -48.67 46.44 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 40' ' ' GLN . 0.7 OUTLIER -54.98 -30.58 59.53 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 123.966 1.841 . . . . 0.0 114.975 177.419 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.513 HD22 ' HA ' ' A' ' 12' ' ' ALA . 13.0 tp -77.24 -54.22 6.76 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-N 113.724 -1.58 . . . . 0.0 108.244 -177.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.88 -35.25 66.3 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 113.684 -1.598 . . . . 0.0 109.027 177.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -67.12 -59.91 3.06 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 114.833 -1.076 . . . . 0.0 112.453 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -51.05 -41.58 59.96 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 121.222 -0.924 . . . . 0.0 112.343 177.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.427 ' O ' ' HB3' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -64.51 -40.65 96.04 Favored 'General case' 0 C--O 1.241 0.636 0 CA-C-O 122.017 0.913 . . . . 0.0 112.323 177.811 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.437 ' HD3' ' N ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -65.04 -38.44 90.86 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-O 122.595 1.188 . . . . 0.0 108.364 177.66 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.449 ' C ' HE21 ' A' ' 55' ' ' GLN . 40.9 mt -65.94 -40.84 91.72 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 121.291 -0.88 . . . . 0.0 109.223 177.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.427 ' HB3' ' O ' ' A' ' 49' ' ' LYS . 1.0 OUTLIER -50.34 -52.19 39.12 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 122.468 1.127 . . . . 0.0 108.162 177.086 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -55.21 -58.68 6.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 112.504 -2.134 . . . . 0.0 110.622 178.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -54.98 -31.23 60.7 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 114.914 1.449 . . . . 0.0 114.914 -177.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.449 HE21 ' C ' ' A' ' 51' ' ' LEU . 41.8 mt-30 -69.2 -20.56 63.98 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 115.119 1.526 . . . . 0.0 115.119 178.159 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.644 ' HB2' HD22 ' A' ' 21' ' ' ASN . . . . . . . . 0 C--N 1.326 -0.444 0 N-CA-C 114.546 1.313 . . . . 0.0 114.546 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.473 0.682 0 CA-C-O 124.176 1.941 . . . . 0.0 112.155 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . 0.333 12.5 tt0 -38.67 -49.26 1.55 Allowed 'General case' 0 N--CA 1.432 -1.361 1 C-N-CA 133.004 4.522 . . . . 0.0 109.212 176.797 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -73.53 -46.8 45.53 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 120.833 -1.167 . . . . 0.0 111.989 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -52.1 -47.54 65.19 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 120.064 -1.647 . . . . 0.0 109.691 177.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.573 ' HA ' HD22 ' A' ' 45' ' ' LEU . . . -59.29 -44.01 92.53 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 113.369 -1.742 . . . . 0.0 111.104 177.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -56.68 -53.53 56.63 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 122.95 1.357 . . . . 0.0 112.023 177.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -55.4 -47.9 75.18 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.767 177.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -63.31 -36.69 84.51 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 120.757 -1.214 . . . . 0.0 111.415 177.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -56.8 -44.57 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 125.454 1.502 . . . . 0.0 108.575 177.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 70.6 mt -64.71 -47.66 77.52 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 122.762 1.268 . . . . 0.0 109.591 176.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -58.82 -32.01 69.0 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 116.797 2.147 . . . . 0.0 116.797 -177.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.404 HD13 ' HB2' ' A' ' 52' ' ' ASN . 84.4 mt -53.1 96.35 0.1 OUTLIER Pre-proline 0 CA--C 1.548 0.868 0 N-CA-C 115.891 1.812 . . . . 0.0 115.891 -177.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 0.3 OUTLIER -80.29 3.02 8.01 Favored 'Trans proline' 0 N--CA 1.462 -0.377 0 C-N-CA 123.922 3.081 . . . . 0.0 113.575 -177.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.727 HD21 ' HB2' ' A' ' 56' ' ' ALA . 14.3 t30 -132.59 26.66 4.39 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 124.268 1.985 . . . . 0.0 113.377 -177.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.4 tt -121.33 146.58 46.7 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 113.39 -1.732 . . . . 0.0 107.805 177.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 23.1 p-10 -71.82 -155.57 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.746 0 O-C-N 119.403 -2.06 . . . . 0.0 115.536 179.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.583 ' H ' ' CD ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -90.58 -66.6 0.91 Allowed 'General case' 0 N--CA 1.443 -0.793 0 O-C-N 120.022 -1.674 . . . . 0.0 114.544 177.374 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -60.5 -37.28 80.6 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 114.501 1.297 . . . . 0.0 114.501 -177.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.453 HE21 ' CD ' ' A' ' 55' ' ' GLN . 23.7 mt-30 -64.66 -37.93 89.27 Favored 'General case' 0 C--N 1.347 0.484 0 CA-C-N 123.391 2.814 . . . . 0.0 108.13 177.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.5 ttm-85 -57.7 -49.69 75.67 Favored 'General case' 0 C--O 1.224 -0.268 0 O-C-N 121.703 -0.623 . . . . 0.0 109.907 177.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -54.8 -52.17 63.49 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 114.39 -1.277 . . . . 0.0 112.257 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.88 -50.65 68.19 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 122.652 1.215 . . . . 0.0 110.74 178.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.469 ' CE2' HD12 ' A' ' 51' ' ' LEU . 47.5 m-85 -61.09 -47.86 84.35 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-O 117.798 -1.096 . . . . 0.0 110.446 177.329 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 34.3 mt -49.07 -50.84 14.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-N 121.222 1.828 . . . . 0.0 110.558 176.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.08 -55.17 25.92 Favored 'General case' 0 N--CA 1.424 -1.763 0 CA-C-O 122.564 1.174 . . . . 0.0 109.919 177.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.9 t -58.56 -31.86 68.38 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 178.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.4 mt -69.01 -43.46 74.77 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 120.574 -1.328 . . . . 0.0 108.27 177.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.481 ' HZ1' ' CG ' ' A' ' 36' ' ' ASP . 0.9 OUTLIER -58.22 -37.71 75.38 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.256 177.783 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.481 ' CG ' ' HZ1' ' A' ' 35' ' ' LYS . 12.0 m-20 -84.3 0.15 50.19 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 120.074 -1.642 . . . . 0.0 114.313 176.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.551 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 31.9 t70 -78.9 115.59 53.43 Favored Pre-proline 0 CA--C 1.54 0.593 0 N-CA-C 120.041 3.349 . . . . 0.0 120.041 -177.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.551 ' HD3' ' HA ' ' A' ' 37' ' ' ASP . 12.4 Cg_exo -88.86 -21.31 1.34 Allowed 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 124.135 3.223 . . . . 0.0 111.618 177.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 80.1 p -100.24 -88.67 0.35 Allowed 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 115.468 1.655 . . . . 0.0 115.468 -176.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.433 ' O ' HD13 ' A' ' 44' ' ' LEU . 28.5 mm-40 -142.17 91.19 2.31 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 119.311 3.078 . . . . 0.0 119.311 -176.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.438 ' HA ' HD13 ' A' ' 44' ' ' LEU . 13.6 t -50.52 -16.8 0.4 Allowed 'General case' 0 N--CA 1.468 0.443 0 O-C-N 120.396 -1.44 . . . . 0.0 109.025 176.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -50.24 -40.35 47.51 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 120.816 1.644 . . . . 0.0 111.581 177.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.456 ' HB2' HD12 ' A' ' 44' ' ' LEU . 17.1 m-80 -67.2 -47.09 71.91 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 123.077 1.418 . . . . 0.0 107.408 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.605 ' CD1' ' H ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -60.18 -25.21 65.39 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 116.373 1.99 . . . . 0.0 116.373 177.221 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.573 HD22 ' HA ' ' A' ' 12' ' ' ALA . 33.3 tp -80.57 -48.73 12.28 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 106.089 -1.819 . . . . 0.0 106.089 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.1 -37.87 75.37 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 177.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -65.29 -52.51 53.67 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 119.326 -0.949 . . . . 0.0 112.076 179.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -55.43 -41.77 73.25 Favored 'General case' 0 C--N 1.334 -0.068 0 O-C-N 121.804 -0.56 . . . . 0.0 112.013 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -61.31 -45.97 92.25 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 121.0 0.428 . . . . 0.0 110.149 177.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -57.14 -40.67 77.62 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 123.154 1.454 . . . . 0.0 108.415 -179.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.485 ' C ' HE21 ' A' ' 55' ' ' GLN . 73.7 mt -67.3 -47.15 71.43 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 113.775 -1.557 . . . . 0.0 111.698 177.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.404 ' HB2' HD13 ' A' ' 19' ' ' LEU . 1.0 OUTLIER -47.0 -50.7 18.76 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 119.84 -1.788 . . . . 0.0 109.419 177.294 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -58.86 -58.35 9.0 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 111.509 -2.587 . . . . 0.0 109.694 -179.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.34 -26.67 53.39 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.485 HE21 ' C ' ' A' ' 51' ' ' LEU . 41.4 mt-30 -69.05 -24.45 64.17 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.727 ' HB2' HD21 ' A' ' 21' ' ' ASN . . . . . . . . 0 C--N 1.327 -0.39 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -178.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.225 -0.22 0 CA-C-O 120.939 0.4 . . . . 0.0 110.202 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.49 ' O ' HD11 ' A' ' 34' ' ' LEU . 8.4 tt0 -39.88 -49.6 2.42 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 126.904 2.082 . . . . 0.0 110.753 177.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -69.2 -47.79 63.88 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 119.151 -2.218 . . . . 0.0 113.579 177.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -51.91 -44.42 63.82 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 123.854 1.788 . . . . 0.0 109.743 178.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.651 ' HA ' HD22 ' A' ' 45' ' ' LEU . . . -60.83 -49.6 76.84 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 112.222 -2.263 . . . . 0.0 111.738 177.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -55.21 -51.36 66.81 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 123.126 1.441 . . . . 0.0 111.804 177.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -57.24 -51.62 68.63 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 114.422 1.268 . . . . 0.0 114.422 177.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -61.51 -37.16 82.67 Favored 'General case' 0 N--CA 1.455 -0.209 0 O-C-N 121.166 -0.958 . . . . 0.0 110.694 178.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 13.1 mt -57.7 -52.97 50.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 O-C-N 121.135 -0.978 . . . . 0.0 108.995 177.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 90.4 mt -50.99 -49.48 60.24 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-O 122.527 1.156 . . . . 0.0 109.602 177.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 -63.87 -14.09 50.43 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 117.06 2.245 . . . . 0.0 117.06 177.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.659 HD13 HD13 ' A' ' 22' ' ' LEU . 93.3 mt -54.61 100.8 0.23 Allowed Pre-proline 0 CA--C 1.547 0.835 0 CA-C-N 123.959 3.072 . . . . 0.0 117.005 -177.378 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 19' ' ' LEU . 50.4 Cg_exo -56.76 -41.1 79.19 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 125.038 3.825 . . . . 0.0 116.108 -177.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 66.0 m-80 -104.98 23.63 13.27 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 122.955 1.36 . . . . 0.0 113.666 -177.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.659 HD13 HD13 ' A' ' 19' ' ' LEU . 1.6 tt -115.59 129.3 56.47 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-O 123.125 1.44 . . . . 0.0 110.527 179.047 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -78.69 145.42 34.56 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 112.888 -1.96 . . . . 0.0 112.695 178.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -48.9 -33.7 11.26 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.125 -1.398 . . . . 0.0 114.649 -177.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -60.56 -49.52 77.21 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 119.606 -1.934 . . . . 0.0 109.966 177.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.457 HE22 ' CD ' ' A' ' 55' ' ' GLN . 33.3 mt-30 -63.16 -43.83 97.17 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 177.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.447 ' N ' HD21 ' A' ' 22' ' ' LEU . 12.7 tpp180 -47.93 -53.23 16.59 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.06 177.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -60.22 -48.32 82.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.938 -1.028 . . . . 0.0 112.15 177.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.89 -50.88 62.99 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 124.342 2.02 . . . . 0.0 111.389 177.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . 0.44 ' CG ' ' HB2' ' A' ' 48' ' ' ALA . 59.1 m-85 -60.49 -47.72 84.89 Favored 'General case' 0 C--O 1.215 -0.725 0 CA-C-N 112.471 -2.15 . . . . 0.0 109.308 177.666 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 41.6 mt -56.05 -40.44 63.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 121.679 2.036 . . . . 0.0 111.667 177.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.31 1.7 tp60 -59.13 -55.89 29.25 Favored 'General case' 0 C--O 1.247 0.942 0 O-C-N 119.904 -1.747 . . . . 0.0 111.346 177.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.3 t -66.77 -29.59 69.59 Favored 'General case' 0 C--O 1.215 -0.751 0 C-N-CA 118.912 -1.115 . . . . 0.0 108.98 177.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.686 HD22 HD23 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -57.64 -48.36 79.67 Favored 'General case' 0 N--CA 1.464 0.26 0 O-C-N 118.373 -2.704 . . . . 0.0 111.183 177.65 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.444 ' HG3' ' N ' ' A' ' 36' ' ' ASP . 12.6 pttp -68.27 -45.41 73.2 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.405 177.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.444 ' N ' ' HG3' ' A' ' 35' ' ' LYS . 97.2 m-20 -74.79 -34.99 62.5 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 117.423 2.379 . . . . 0.0 117.423 -177.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.64 ' HB3' ' CG ' ' A' ' 40' ' ' GLN . 45.2 m-20 -104.72 106.7 55.88 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 126.408 1.883 . . . . 0.0 115.685 -177.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 37' ' ' ASP . 87.7 Cg_endo -69.02 -96.68 0.01 OUTLIER 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.196 2.598 . . . . 0.0 118.225 -177.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.7 m -59.89 -27.12 66.44 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 117.983 -2.948 . . . . 0.0 115.82 -177.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.64 ' CG ' ' HB3' ' A' ' 37' ' ' ASP . 12.1 pm0 -69.89 -12.25 61.48 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.574 -0.704 . . . . 0.0 111.998 177.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 79.8 p -56.6 -22.85 36.77 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 120.124 -1.61 . . . . 0.0 111.17 177.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.91 -41.43 82.65 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 120.112 -1.617 . . . . 0.0 110.145 177.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -68.23 -46.89 69.31 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.686 HD23 HD22 ' A' ' 34' ' ' LEU . 27.7 tp -56.9 -28.63 62.15 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.978 1.37 . . . . 0.0 112.881 177.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.651 HD22 ' HA ' ' A' ' 12' ' ' ALA . 30.5 tp -78.9 -51.48 9.62 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 -178.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.73 -34.55 62.64 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 114.344 -1.298 . . . . 0.0 107.966 177.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -65.4 -60.73 2.66 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 115.183 -0.917 . . . . 0.0 112.825 177.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.44 ' HB2' ' CG ' ' A' ' 30' ' ' PHE . . . -51.46 -41.81 61.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 122.026 0.917 . . . . 0.0 112.627 178.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -62.87 -47.38 83.6 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.013 177.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.7 -35.26 79.99 Favored 'General case' 0 C--N 1.342 0.255 0 O-C-N 120.73 -1.231 . . . . 0.0 109.133 -177.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.0 mt -65.63 -51.73 57.37 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 119.818 -0.753 . . . . 0.0 109.048 177.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -46.71 -48.62 20.22 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 123.609 1.671 . . . . 0.0 110.583 179.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -60.51 -46.61 89.51 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 112.571 -2.104 . . . . 0.0 110.87 177.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.14 -44.74 75.37 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 120.954 -1.091 . . . . 0.0 110.333 177.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.457 ' CD ' HE22 ' A' ' 26' ' ' GLN . 0.0 OUTLIER -70.08 -23.05 63.0 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 115.769 1.766 . . . . 0.0 115.769 177.696 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.603 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 179.618 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.234 0.256 0 CA-C-O 123.288 1.518 . . . . 0.0 111.838 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -43.27 -49.16 6.76 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 113.143 -1.844 . . . . 0.0 112.736 177.461 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.403 ' O ' ' HB3' ' A' ' 13' ' ' PHE . 35.1 mm-40 -66.88 -38.45 86.31 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 120.729 -0.388 . . . . 0.0 111.924 177.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -58.8 -47.45 84.73 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.152 -1.593 . . . . 0.0 109.045 177.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.5 -39.32 83.43 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 113.907 -1.497 . . . . 0.0 110.11 177.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.403 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 50.4 t80 -56.48 -53.52 56.56 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 123.284 1.516 . . . . 0.0 109.725 177.349 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 39.2 m-85 -56.24 -43.53 78.73 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.143 -1.389 . . . . 0.0 110.647 176.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -60.27 -40.09 89.14 Favored 'General case' 0 C--N 1.332 -0.16 0 O-C-N 121.118 -0.989 . . . . 0.0 111.805 177.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.1 mt -58.33 -51.92 65.47 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-O 122.374 1.083 . . . . 0.0 108.489 177.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.461 ' HA ' ' NH1' ' A' ' 27' ' ' ARG . 59.2 mt -59.87 -36.44 76.92 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 122.465 1.126 . . . . 0.0 112.645 177.423 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 22.6 t-160 -69.97 -11.66 61.04 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.624 1.57 . . . . 0.0 112.734 177.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 99.7 mt -62.36 124.85 84.2 Favored Pre-proline 0 CA--C 1.543 0.678 0 O-C-N 119.657 -1.902 . . . . 0.0 114.086 -178.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -70.02 -38.32 7.38 Favored 'Trans proline' 0 CA--C 1.531 0.375 0 C-N-CA 123.732 2.955 . . . . 0.0 117.611 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -103.45 -15.16 15.97 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 126.102 2.858 . . . . 0.0 115.551 -177.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.46 HD21 ' N ' ' A' ' 27' ' ' ARG . 4.6 tt -90.92 123.37 34.38 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 110.103 -3.226 . . . . 0.0 107.019 177.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.507 ' HA ' ' HE ' ' A' ' 27' ' ' ARG . 1.7 p30 -151.5 -34.34 0.14 Allowed 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 118.088 2.625 . . . . 0.0 118.088 -176.322 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.654 ' H ' ' CD ' ' A' ' 24' ' ' GLU 0.254 0.0 OUTLIER -75.0 -132.66 0.01 OUTLIER 'General case' 0 N--CA 1.432 -1.342 0 CA-C-O 127.384 3.469 . . . . 0.0 116.162 -177.214 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.446 ' H ' ' HG2' ' A' ' 24' ' ' GLU . 13.1 mm-40 -68.0 -26.33 65.85 Favored 'General case' 0 C--N 1.315 -0.902 1 CA-C-N 107.879 -4.237 . . . . 0.0 112.728 -177.377 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.541 HE22 ' CD ' ' A' ' 55' ' ' GLN . 22.0 mt-30 -69.51 -50.15 47.86 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 104.803 -2.295 . . . . 0.0 104.803 177.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.507 ' HE ' ' HA ' ' A' ' 23' ' ' ASN . 3.0 tpp85 -48.24 -51.72 24.27 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 114.521 -1.218 . . . . 0.0 110.805 177.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -59.81 -51.43 69.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 113.618 -1.628 . . . . 0.0 112.788 177.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.44 -44.11 76.04 Favored 'General case' 0 CA--C 1.528 0.113 0 O-C-N 121.136 -0.978 . . . . 0.0 110.861 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -67.28 -48.88 66.36 Favored 'General case' 0 N--CA 1.452 -0.369 0 O-C-N 121.457 -0.777 . . . . 0.0 110.226 176.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 11.2 mt -52.07 -46.92 43.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 O-C-N 119.516 -1.99 . . . . 0.0 112.547 177.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.305 0.0 OUTLIER -63.98 -49.0 74.2 Favored 'General case' 0 N--CA 1.436 -1.133 0 C-N-CA 124.914 1.285 . . . . 0.0 110.196 177.796 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.6 t -58.28 -37.07 74.27 Favored 'General case' 0 C--O 1.217 -0.616 0 O-C-N 120.978 -1.076 . . . . 0.0 109.842 177.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.8 mp -65.74 -41.18 92.48 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 121.199 1.818 . . . . 0.0 107.92 176.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.77 -42.15 71.36 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 120.203 -1.561 . . . . 0.0 110.345 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -84.0 -27.77 28.17 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 116.998 2.222 . . . . 0.0 116.998 177.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -79.45 160.12 70.77 Favored Pre-proline 0 C--O 1.239 0.518 0 N-CA-C 116.992 2.219 . . . . 0.0 116.992 -178.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -102.38 -92.66 0.0 OUTLIER 'Trans proline' 0 CA--C 1.544 1.004 0 C-N-CA 123.199 2.599 . . . . 0.0 110.937 176.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.0 t -102.08 -11.11 19.11 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 119.499 -2.001 . . . . 0.0 115.337 177.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.2 mp0 -68.53 -8.93 45.74 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 118.12 -2.863 . . . . 0.0 114.946 -177.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.466 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 61.8 m -42.95 -35.02 1.08 Allowed 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 125.26 1.424 . . . . 0.0 112.384 177.05 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -51.57 -39.96 58.85 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 123.544 1.64 . . . . 0.0 112.962 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -72.13 -46.63 55.81 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 122.677 1.227 . . . . 0.0 107.76 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.466 ' HG ' ' HA ' ' A' ' 41' ' ' SER . 0.8 OUTLIER -56.73 -29.33 62.4 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 124.609 2.147 . . . . 0.0 113.588 177.234 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 52.2 tp -77.11 -51.11 11.58 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 112.766 -2.015 . . . . 0.0 106.474 -178.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.7 -33.19 60.57 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 122.672 1.225 . . . . 0.0 108.31 176.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -64.55 -61.6 2.11 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 114.783 -1.099 . . . . 0.0 111.935 177.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -51.58 -38.05 52.66 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.963 0.887 . . . . 0.0 112.014 177.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -65.25 -43.89 89.89 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 121.675 0.75 . . . . 0.0 110.054 177.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.77 -39.95 95.78 Favored 'General case' 0 C--O 1.233 0.216 0 O-C-N 120.452 -1.405 . . . . 0.0 108.606 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 51' ' ' LEU . 64.3 mt -62.88 -54.94 30.98 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 121.74 0.781 . . . . 0.0 109.707 177.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -44.82 -44.86 9.78 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 124.029 1.871 . . . . 0.0 111.466 -178.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -67.08 -46.66 73.61 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 111.702 -2.499 . . . . 0.0 111.751 177.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.61 -46.45 77.36 Favored 'General case' 0 C--O 1.233 0.204 0 O-C-N 120.942 -1.099 . . . . 0.0 111.444 177.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.541 ' CD ' HE22 ' A' ' 26' ' ' GLN . 5.7 pm0 -84.98 14.13 5.26 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 177.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.359 0 O-C-N 119.83 -1.794 . . . . 0.0 111.234 177.534 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.22 -0.456 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.505 HE21 ' CG ' ' A' ' 37' ' ' ASP 0.266 1.4 tm0? -39.42 -61.06 0.84 Allowed 'General case' 0 N--CA 1.432 -1.343 0 C-N-CA 127.261 2.224 . . . . 0.0 113.024 176.802 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 51.7 mm-40 -59.79 -37.15 78.32 Favored 'General case' 0 C--O 1.233 0.199 0 O-C-N 120.227 -1.545 . . . . 0.0 111.409 177.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.26 -46.62 88.03 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.97 0.89 . . . . 0.0 109.194 177.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.448 ' O ' HD13 ' A' ' 16' ' ' ILE . . . -63.62 -37.03 85.78 Favored 'General case' 0 C--O 1.211 -0.932 0 C-N-CA 124.097 0.959 . . . . 0.0 109.142 177.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -54.23 -55.5 27.51 Favored 'General case' 0 C--O 1.237 0.416 0 O-C-N 119.708 -1.87 . . . . 0.0 108.723 177.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -58.21 -45.97 86.67 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 113.165 -1.834 . . . . 0.0 112.202 176.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.24 -43.42 74.55 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 123.039 1.4 . . . . 0.0 111.597 177.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.448 HD13 ' O ' ' A' ' 12' ' ' ALA . 0.7 OUTLIER -58.65 -52.91 54.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 C-N-CA 126.537 1.935 . . . . 0.0 109.94 178.063 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 49.5 mt -62.62 -36.17 81.91 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 122.098 0.952 . . . . 0.0 113.043 177.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 6.3 t-80 -62.6 -21.51 65.69 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 127.487 2.315 . . . . 0.0 116.14 177.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.507 HD12 HD22 ' A' ' 22' ' ' LEU . 21.6 mt -63.08 105.63 0.7 Allowed Pre-proline 0 C--N 1.328 -0.34 0 N-CA-C 118.315 2.709 . . . . 0.0 118.315 -176.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -72.81 -1.95 11.19 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 123.024 2.483 . . . . 0.0 112.64 178.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.481 HD21 ' ND2' ' A' ' 52' ' ' ASN . 36.2 p-10 -132.94 27.41 4.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 122.794 1.283 . . . . 0.0 114.3 178.068 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.507 HD22 HD12 ' A' ' 19' ' ' LEU . 7.2 tt -160.02 111.82 2.01 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 122.947 1.356 . . . . 0.0 109.203 177.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -154.82 2.94 0.21 Allowed 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 117.249 2.315 . . . . 0.0 117.249 -177.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.702 ' H ' ' CD ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -87.16 -132.88 0.07 Allowed 'General case' 0 N--CA 1.418 -2.05 0 CA-C-O 125.485 2.564 . . . . 0.0 112.796 -177.59 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.412 ' HA ' ' HB2' ' A' ' 28' ' ' ASN . 0.4 OUTLIER -76.3 -22.07 55.47 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 109.49 -3.504 . . . . 0.0 114.086 -177.227 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.424 ' NE2' ' NE2' ' A' ' 55' ' ' GLN . 27.2 mt-30 -73.86 -48.99 27.19 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 105.251 -2.129 . . . . 0.0 105.251 177.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.465 ' HB3' ' CZ ' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -56.4 -48.36 77.09 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-N 114.698 -1.137 . . . . 0.0 110.543 177.413 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.412 ' HB2' ' HA ' ' A' ' 25' ' ' GLU . 73.0 m-20 -59.97 -47.74 84.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 113.724 -1.58 . . . . 0.0 111.809 177.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.57 -48.09 78.13 Favored 'General case' 0 C--N 1.333 -0.13 0 O-C-N 121.089 -1.007 . . . . 0.0 110.087 178.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -61.99 -47.46 84.69 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 121.633 -0.667 . . . . 0.0 110.679 177.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . 0.457 HD12 ' NH1' ' A' ' 27' ' ' ARG . 1.6 mt -52.42 -44.81 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 O-C-N 119.111 -2.243 . . . . 0.0 110.405 177.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.271 5.1 tp60 -60.92 -48.2 82.89 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 123.867 0.867 . . . . 0.0 110.383 177.456 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.6 t -65.13 -28.29 69.32 Favored 'General case' 0 C--O 1.225 -0.208 0 O-C-N 121.337 -0.852 . . . . 0.0 111.714 177.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.7 mp -78.67 -24.61 45.03 Favored 'General case' 0 N--CA 1.445 -0.69 0 O-C-N 119.857 -1.777 . . . . 0.0 108.432 176.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.431 ' HZ3' ' CG ' ' A' ' 36' ' ' ASP . 1.1 pttm -69.09 -54.09 16.84 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 102.375 -3.194 . . . . 0.0 102.375 176.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.431 ' CG ' ' HZ3' ' A' ' 35' ' ' LYS . 70.3 m-20 -91.31 70.13 6.06 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-O 124.086 1.898 . . . . 0.0 108.581 177.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.505 ' CG ' HE21 ' A' ' 9' ' ' GLN . 24.4 t0 -75.28 115.65 47.13 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 111.482 -2.599 . . . . 0.0 115.068 -177.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 0.2 OUTLIER -97.19 -121.02 0.0 OUTLIER 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 125.246 3.964 . . . . 0.0 114.532 177.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.5 p -102.5 -59.72 1.66 Allowed 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 117.63 2.456 . . . . 0.0 117.63 179.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.446 ' CD ' ' H ' ' A' ' 40' ' ' GLN . 1.1 pm0 -69.95 32.51 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 119.269 3.063 . . . . 0.0 119.269 -176.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.59 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 18.9 m -52.4 -39.39 60.84 Favored 'General case' 0 N--CA 1.475 0.775 0 O-C-N 119.279 -2.138 . . . . 0.0 113.62 178.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.8 -38.6 72.79 Favored 'General case' 0 CA--C 1.538 0.488 0 O-C-N 120.297 -1.502 . . . . 0.0 109.092 176.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -64.94 -55.21 20.54 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 104.339 -2.467 . . . . 0.0 104.339 177.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.59 ' HG ' ' HA ' ' A' ' 41' ' ' SER . 2.1 mt -48.37 -28.36 3.14 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 177.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 13.4 tp -74.89 -54.45 7.23 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 -178.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.17 -35.48 69.61 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 113.506 -1.679 . . . . 0.0 110.598 177.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -64.47 -62.01 1.86 Allowed 'General case' 0 C--O 1.237 0.435 0 CA-C-O 122.685 1.231 . . . . 0.0 111.125 -178.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -51.96 -43.13 63.4 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 123.457 1.599 . . . . 0.0 111.02 177.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 35.7 tptt -58.94 -41.9 88.52 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.197 -1.365 . . . . 0.0 110.947 177.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.403 ' HZ2' ' N ' ' A' ' 50' ' ' LYS . 0.2 OUTLIER -63.34 -38.45 91.18 Favored 'General case' 0 N--CA 1.457 -0.077 0 O-C-N 120.399 -1.438 . . . . 0.0 108.591 -179.695 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 71.5 mt -59.6 -49.65 76.95 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 122.904 1.335 . . . . 0.0 110.418 177.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.667 HD22 ' C ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -50.68 -49.75 56.55 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-O 124.156 1.932 . . . . 0.0 112.51 177.366 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -62.39 -49.12 76.77 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 111.643 -2.526 . . . . 0.0 111.379 177.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.9 -44.77 86.98 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 121.25 -0.906 . . . . 0.0 113.01 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.424 ' NE2' ' NE2' ' A' ' 26' ' ' GLN . 29.8 pt20 -80.09 8.87 6.31 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 177.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.546 0.817 0 O-C-N 119.945 -1.722 . . . . 0.0 113.201 177.957 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.471 0.598 0 CA-C-O 122.54 1.162 . . . . 0.0 113.469 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.418 ' NE2' ' O ' ' A' ' 34' ' ' LEU 0.314 3.0 tm0? -38.06 -52.32 1.4 Allowed 'General case' 0 N--CA 1.425 -1.687 0 C-N-CA 128.537 2.735 . . . . 0.0 111.815 177.655 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 48.0 mm-40 -72.82 -31.37 64.75 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.06 -0.973 . . . . 0.0 112.073 -178.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ASN . . . . . 0.407 HD22 ' C ' ' A' ' 11' ' ' ASN . 0.1 OUTLIER -64.81 -45.36 86.58 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 177.425 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.7 -42.46 98.97 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-O 121.153 0.502 . . . . 0.0 110.566 177.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -55.45 -50.83 68.81 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 123.672 1.701 . . . . 0.0 111.716 177.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -60.5 -46.89 88.47 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 113.876 -1.511 . . . . 0.0 111.007 177.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.62 -41.84 74.06 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 122.753 1.264 . . . . 0.0 108.886 177.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -57.14 -56.65 13.66 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 177.079 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 69.6 mt -55.79 -28.9 58.48 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 122.883 1.325 . . . . 0.0 113.521 177.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -72.26 -13.2 61.45 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.544 1.538 . . . . 0.0 113.522 177.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 80.8 mt -55.13 119.76 25.15 Favored Pre-proline 0 CA--C 1.544 0.741 0 O-C-N 119.985 -1.697 . . . . 0.0 112.093 177.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -73.86 -11.17 23.65 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 125.129 3.886 . . . . 0.0 118.795 -177.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASN . . . . . 0.497 HD21 ' HB2' ' A' ' 56' ' ' ALA . 4.4 p-10 -155.45 58.93 0.63 Allowed 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 124.27 1.986 . . . . 0.0 112.737 177.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.6 tt -160.28 123.0 3.36 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 112.139 -2.3 . . . . 0.0 108.269 177.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -154.33 -13.29 0.13 Allowed 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 117.061 2.245 . . . . 0.0 117.061 -177.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.657 ' H ' ' CD ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -75.89 -132.3 0.01 OUTLIER 'General case' 0 N--CA 1.425 -1.701 0 CA-C-O 125.911 2.767 . . . . 0.0 113.283 -177.478 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.408 ' HA ' ' HB3' ' A' ' 28' ' ' ASN . 0.0 OUTLIER -66.07 -27.32 67.99 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 109.69 -3.414 . . . . 0.0 115.159 -177.072 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.61 HE22 ' NE2' ' A' ' 55' ' ' GLN . 16.1 mt-30 -74.1 -52.97 10.96 Favored 'General case' 0 N--CA 1.441 -0.896 0 N-CA-C 105.653 -1.98 . . . . 0.0 105.653 177.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -48.93 -49.11 41.77 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 124.355 2.026 . . . . 0.0 111.665 177.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.408 ' HB3' ' HA ' ' A' ' 25' ' ' GLU . 47.9 t-20 -55.73 -58.49 7.63 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 109.59 -3.459 . . . . 0.0 111.719 178.008 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.6 -46.57 88.55 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 121.599 -0.688 . . . . 0.0 111.324 -178.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -61.5 -46.33 90.43 Favored 'General case' 0 C--O 1.219 -0.502 0 O-C-N 121.188 -0.945 . . . . 0.0 109.859 177.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 29.4 mt -54.62 -51.66 48.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-N 121.425 1.92 . . . . 0.0 110.775 177.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.37 -56.6 9.06 Favored 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 125.88 1.672 . . . . 0.0 111.501 177.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.0 t -63.3 -30.78 71.86 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 112.205 -2.271 . . . . 0.0 111.506 178.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.418 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 1.4 mm? -65.5 -45.0 85.28 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 105.875 -1.898 . . . . 0.0 105.875 177.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . 0.479 ' HZ3' ' CG ' ' A' ' 36' ' ' ASP . 0.0 OUTLIER -60.17 -42.21 94.5 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 119.958 -1.714 . . . . 0.0 110.709 177.419 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.479 ' CG ' ' HZ3' ' A' ' 35' ' ' LYS . 45.4 m-20 -70.97 -46.27 62.62 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 117.503 2.408 . . . . 0.0 117.503 177.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -79.64 142.3 57.18 Favored Pre-proline 0 CA--C 1.531 0.232 0 N-CA-C 119.575 3.176 . . . . 0.0 119.575 -178.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.46 ' HG2' ' H ' ' A' ' 39' ' ' SER . 89.1 Cg_endo -86.51 -74.35 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.098 1.865 . . . . 0.0 110.323 176.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.46 ' H ' ' HG2' ' A' ' 38' ' ' PRO . 61.0 m -102.25 -18.34 15.52 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 120.689 3.589 . . . . 0.0 120.689 -177.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -70.79 -9.71 58.0 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 125.866 3.939 . . . . 0.0 114.296 -177.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.402 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 74.9 m -43.87 -29.13 0.51 Allowed 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 125.664 1.586 . . . . 0.0 114.214 177.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.19 -44.43 97.3 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 124.195 1.95 . . . . 0.0 109.572 177.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.405 ' C ' HD22 ' A' ' 43' ' ' ASN . 0.2 OUTLIER -71.37 -52.73 17.07 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 105.15 -2.167 . . . . 0.0 105.15 -179.98 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.402 ' HG ' ' HA ' ' A' ' 41' ' ' SER . 1.1 mt -51.45 -29.51 16.4 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 123.834 1.778 . . . . 0.0 114.69 177.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 63.0 tp -74.46 -50.67 17.4 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 -177.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.8 -37.98 71.9 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 113.821 -1.536 . . . . 0.0 107.497 177.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -63.63 -52.52 60.46 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 119.498 -0.881 . . . . 0.0 110.992 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -54.42 -40.73 68.56 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 122.428 1.108 . . . . 0.0 111.417 177.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.508 ' HZ2' ' HB2' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -63.96 -41.49 97.55 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 121.115 -0.991 . . . . 0.0 110.509 177.288 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -61.89 -39.07 90.68 Favored 'General case' 0 CA--C 1.519 -0.241 0 O-C-N 121.105 -0.997 . . . . 0.0 108.7 177.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 53.4 mt -62.3 -45.58 92.61 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 122.141 0.972 . . . . 0.0 110.454 177.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -59.21 -49.61 77.17 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 119.498 -2.001 . . . . 0.0 110.668 177.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -52.91 -42.75 65.66 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 124.999 1.319 . . . . 0.0 111.31 177.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.01 -30.47 70.32 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.527 -0.733 . . . . 0.0 111.74 177.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.61 ' NE2' HE22 ' A' ' 26' ' ' GLN . 40.0 mt-30 -82.53 -34.31 27.92 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 123.025 1.393 . . . . 0.0 111.994 177.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.497 ' HB2' HD21 ' A' ' 21' ' ' ASN . . . . . . . . 0 CA--C 1.542 0.645 0 CA-C-N 114.784 -1.098 . . . . 0.0 113.378 177.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.459 HG12 ' N ' ' A' ' 2' ' ' ASP . 84.5 t . . . . . 0 N--CA 1.468 0.466 0 CA-C-O 117.937 -1.03 . . . . 0.0 111.125 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.459 ' N ' HG12 ' A' ' 1' ' ' VAL . 21.8 p30 -71.92 -169.25 0.45 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 121.732 2.06 . . . . 0.0 113.665 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 8.8 p-10 -69.27 -5.97 26.39 Favored 'General case' 0 CA--C 1.528 0.1 0 O-C-N 120.952 -1.093 . . . . 0.0 113.576 -177.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.5 ttpp -100.75 -52.96 3.19 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.032 0.933 . . . . 0.0 111.389 177.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.444 ' HA ' ' OE1' ' A' ' 9' ' ' GLN . 40.3 m-85 -67.68 82.39 0.18 Allowed 'General case' 0 C--O 1.235 0.318 0 CA-C-O 123.622 1.677 . . . . 0.0 112.919 -177.117 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.629 HD22 ' H ' ' A' ' 6' ' ' ASN . 0.1 OUTLIER -109.89 -130.24 0.3 Allowed 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 110.085 -3.234 . . . . 0.0 116.309 -177.528 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.418 ' H ' ' CG ' ' A' ' 6' ' ' ASN . 7.7 mtmp? -39.58 -106.55 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 119.318 3.081 . . . . 0.0 119.318 -177.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.405 ' CD ' ' H ' ' A' ' 8' ' ' GLU . 0.1 OUTLIER -53.69 -46.52 70.72 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 120.694 -1.254 . . . . 0.0 110.962 -178.061 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.444 ' OE1' ' HA ' ' A' ' 5' ' ' PHE 0.266 7.6 tt0 -45.95 -55.56 6.63 Favored 'General case' 0 N--CA 1.425 -1.702 0 C-N-CA 127.609 2.364 . . . . 0.0 110.925 177.76 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.42 ' HB2' ' O ' ' A' ' 6' ' ' ASN . 10.2 mm-40 -70.04 -45.3 67.44 Favored 'General case' 0 CA--C 1.512 -0.486 0 O-C-N 118.743 -2.473 . . . . 0.0 112.894 177.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -50.57 -49.05 57.24 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-O 123.788 1.756 . . . . 0.0 111.39 179.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.543 ' HA ' HD22 ' A' ' 45' ' ' LEU . . . -61.17 -43.53 98.74 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 111.166 -2.743 . . . . 0.0 110.801 177.47 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -54.79 -51.37 65.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 123.36 1.552 . . . . 0.0 111.556 177.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 32.9 m-85 -58.59 -55.84 29.86 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 113.16 -1.836 . . . . 0.0 111.033 177.368 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -53.52 -37.87 63.2 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 123.64 1.686 . . . . 0.0 110.1 179.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.457 ' O ' ' NH1' ' A' ' 27' ' ' ARG . 1.6 mt -61.24 -60.69 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 177.161 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 96.2 mt -53.12 -35.81 60.08 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 121.294 1.861 . . . . 0.0 113.318 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 6.4 t-80 -61.8 -19.64 62.75 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 112.9 -1.954 . . . . 0.0 114.072 177.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.489 ' HB2' HH11 ' A' ' 27' ' ' ARG . 70.5 mt -59.45 115.28 11.83 Favored Pre-proline 0 CA--C 1.537 0.445 0 O-C-N 120.661 -1.274 . . . . 0.0 111.196 177.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -80.57 -13.79 11.86 Favored 'Trans proline' 0 C--N 1.344 0.297 0 C-N-CA 123.61 2.873 . . . . 0.0 115.592 -177.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.586 ' ND2' ' HB3' ' A' ' 56' ' ' ALA . 1.5 p-10 -139.38 40.35 2.07 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 125.612 2.625 . . . . 0.0 113.536 -178.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.458 HD11 ' HB2' ' A' ' 26' ' ' GLN . 7.8 tt -149.7 121.84 8.32 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 103.849 -2.649 . . . . 0.0 103.849 177.28 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.454 ' HA ' ' HE ' ' A' ' 27' ' ' ARG . 6.4 t30 -153.35 -19.32 0.15 Allowed 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 116.607 2.077 . . . . 0.0 116.607 -177.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.647 ' H ' ' CD ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -73.36 -133.04 0.01 OUTLIER 'General case' 0 N--CA 1.424 -1.774 0 CA-C-O 126.052 2.834 . . . . 0.0 113.128 -177.54 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.533 ' HA ' HD22 ' A' ' 28' ' ' ASN . 0.3 OUTLIER -61.34 -30.8 70.74 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 109.028 -3.715 . . . . 0.0 114.637 -177.017 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.499 HE22 ' NE2' ' A' ' 55' ' ' GLN . 19.0 mt-30 -69.68 -50.71 41.25 Favored 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 105.313 -2.106 . . . . 0.0 105.313 177.607 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.489 HH11 ' HB2' ' A' ' 19' ' ' LEU . 2.1 tpp180 -50.77 -48.43 59.29 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 122.277 1.037 . . . . 0.0 110.898 177.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.533 HD22 ' HA ' ' A' ' 25' ' ' GLU . 68.9 m-80 -57.19 -54.0 51.72 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 114.005 -1.452 . . . . 0.0 111.672 177.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.41 -47.42 75.94 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-O 121.654 0.74 . . . . 0.0 110.595 -178.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.424 ' CD2' ' HB2' ' A' ' 48' ' ' ALA . 50.0 m-85 -61.9 -47.89 82.94 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 118.139 -0.934 . . . . 0.0 110.566 177.41 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 84.2 mt -54.44 -46.05 70.34 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 CA-C-N 121.877 2.126 . . . . 0.0 110.247 177.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.31 5.7 tp60 -56.61 -50.64 71.39 Favored 'General case' 0 N--CA 1.44 -0.952 0 C-N-CA 124.798 1.239 . . . . 0.0 112.146 178.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 20.2 t -63.09 -42.01 99.51 Favored 'General case' 0 C--O 1.217 -0.611 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 177.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -58.56 -38.43 77.85 Favored 'General case' 0 CA--C 1.529 0.172 0 O-C-N 120.106 -1.621 . . . . 0.0 111.92 177.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.9 ttpm? -68.15 -43.88 77.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 113.624 -1.626 . . . . 0.0 113.574 177.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -88.53 -42.44 12.08 Favored 'General case' 0 CA--C 1.54 0.579 0 N-CA-C 116.823 2.157 . . . . 0.0 116.823 177.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -96.11 133.49 25.08 Favored Pre-proline 0 CA--C 1.543 0.691 0 N-CA-C 118.717 2.858 . . . . 0.0 118.717 -177.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -71.14 -83.48 0.01 OUTLIER 'Trans proline' 0 C--N 1.35 0.658 0 C-N-CA 124.287 3.324 . . . . 0.0 116.08 177.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 44.3 m -100.74 -11.24 20.08 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 118.407 2.744 . . . . 0.0 118.407 -177.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -69.46 -36.21 76.36 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-N 125.477 3.762 . . . . 0.0 111.529 -177.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.507 ' HA ' ' CG ' ' A' ' 44' ' ' LEU . 60.3 m -49.84 -27.1 4.64 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 112.244 -2.253 . . . . 0.0 113.969 -179.183 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.431 ' O ' ' HB3' ' A' ' 45' ' ' LEU . . . -60.98 -36.86 80.56 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 121.748 2.067 . . . . 0.0 112.364 177.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -65.9 -41.88 90.92 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 125.28 2.467 . . . . 0.0 106.739 177.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.507 ' CG ' ' HA ' ' A' ' 41' ' ' SER . 0.7 OUTLIER -66.21 -21.79 66.32 Favored 'General case' 0 C--O 1.219 -0.509 0 CA-C-N 112.455 -2.157 . . . . 0.0 112.972 177.122 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.543 HD22 ' HA ' ' A' ' 12' ' ' ALA . 14.8 tp -70.93 -49.25 47.71 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 104.597 -2.371 . . . . 0.0 104.597 177.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.79 -37.81 69.08 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 113.262 -1.79 . . . . 0.0 106.679 176.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 15.7 mm-40 -64.11 -49.96 70.15 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 118.416 -1.314 . . . . 0.0 112.447 177.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.424 ' HB2' ' CD2' ' A' ' 30' ' ' PHE . . . -52.68 -44.94 66.57 Favored 'General case' 0 C--O 1.236 0.378 0 O-C-N 120.293 -1.505 . . . . 0.0 111.454 177.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 25.6 tptp -61.11 -44.82 96.76 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 121.432 -0.793 . . . . 0.0 111.641 177.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 21.6 mmmt -66.56 -28.62 68.67 Favored 'General case' 0 CA--C 1.511 -0.553 0 O-C-N 121.072 -1.017 . . . . 0.0 110.609 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.436 ' HA ' HD23 ' A' ' 51' ' ' LEU . 37.1 mt -66.58 -46.81 74.75 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 122.539 1.161 . . . . 0.0 108.454 176.667 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.488 ' ND2' HD21 ' A' ' 21' ' ' ASN . 0.7 OUTLIER -49.3 -51.31 34.81 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-O 124.633 2.158 . . . . 0.0 108.067 177.427 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.443 ' HB3' ' HA ' ' A' ' 58' ' ' LYS . 38.3 m-20 -60.63 -40.04 90.48 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 112.076 -2.329 . . . . 0.0 111.778 177.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -58.45 -44.35 89.18 Favored 'General case' 0 CA--C 1.517 -0.307 0 O-C-N 120.182 -1.574 . . . . 0.0 111.724 177.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.499 ' NE2' HE22 ' A' ' 26' ' ' GLN . 1.8 pm0 -74.48 -50.67 17.34 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 116.977 -1.889 . . . . 0.0 110.923 177.203 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.586 ' HB3' ' ND2' ' A' ' 21' ' ' ASN . . . -92.62 -111.34 0.0 OUTLIER Pre-proline 0 CA--C 1.553 1.062 0 N-CA-C 114.514 1.302 . . . . 0.0 114.514 177.614 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.547 ' CD ' ' CB ' ' A' ' 56' ' ' ALA . 8.6 Cg_endo -86.05 101.23 0.64 Allowed 'Trans proline' 0 C--N 1.359 1.082 0 CA-C-N 125.928 3.153 . . . . 0.0 112.739 178.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.443 ' HA ' ' HB3' ' A' ' 53' ' ' ASP . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.16 0 N-CA-C 116.76 2.133 . . . . 0.0 116.76 -177.354 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 5.4 m . . . . . 0 CA--C 1.53 0.185 0 CA-C-O 124.005 1.86 . . . . 0.0 111.6 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -39.49 -81.41 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 130.468 3.507 . . . . 0.0 117.279 177.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -160.42 -60.91 0.06 Allowed 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 124.176 1.941 . . . . 0.0 110.448 177.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.3 mtpm? -55.74 -45.23 78.07 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 112.432 -2.167 . . . . 0.0 110.421 177.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.442 ' CZ ' ' HA ' ' A' ' 35' ' ' LYS . 52.7 m-85 -85.6 95.09 9.22 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 122.608 1.194 . . . . 0.0 114.141 177.523 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.422 HD21 ' NZ ' ' A' ' 7' ' ' LYS . 46.2 t30 -77.32 168.64 19.7 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.075 177.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.472 ' HD2' ' H ' ' A' ' 8' ' ' GLU . 0.4 OUTLIER -52.32 -46.05 65.86 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 119.344 3.09 . . . . 0.0 119.344 -177.223 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.472 ' H ' ' HD2' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -64.52 -50.38 67.62 Favored 'General case' 0 N--CA 1.461 0.096 0 O-C-N 118.67 -2.519 . . . . 0.0 108.559 179.222 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . 0.274 8.2 tt0 -43.38 -45.41 6.12 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 127.655 2.382 . . . . 0.0 110.778 177.372 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.5 mm-40 -73.21 -44.63 59.36 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 112.877 -1.965 . . . . 0.0 113.473 178.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 18.8 t30 -54.71 -47.19 74.04 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-O 123.857 1.789 . . . . 0.0 108.931 177.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.424 ' CB ' HD22 ' A' ' 45' ' ' LEU . . . -57.9 -48.05 81.01 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 111.678 -2.51 . . . . 0.0 111.307 177.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 61.9 t80 -55.29 -41.62 72.53 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-O 124.253 1.978 . . . . 0.0 111.949 177.445 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 2.4 m-30 -62.71 -52.35 63.59 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 112.955 -1.929 . . . . 0.0 110.426 177.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -53.06 -42.88 66.23 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 122.178 0.989 . . . . 0.0 109.648 177.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.435 ' O ' ' HD2' ' A' ' 27' ' ' ARG . 0.5 OUTLIER -54.29 -59.47 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.159 0 CA-C-N 114.563 -1.199 . . . . 0.0 109.636 177.496 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 35.0 mt -49.69 -49.4 47.74 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.902 0.858 . . . . 0.0 111.377 177.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -61.5 -10.84 8.66 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 113.608 -1.633 . . . . 0.0 115.347 178.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 75.7 mt -58.56 104.72 0.45 Allowed Pre-proline 0 CA--C 1.541 0.617 0 CA-C-N 122.307 2.322 . . . . 0.0 111.26 177.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 0.4 OUTLIER -82.08 -4.17 11.82 Favored 'Trans proline' 0 C--N 1.347 0.453 0 C-N-CA 124.191 3.261 . . . . 0.0 116.657 -177.025 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -140.64 44.15 1.84 Allowed 'General case' 0 N--CA 1.456 -0.157 0 CA-C-O 123.309 1.528 . . . . 0.0 112.485 177.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.405 ' HB2' ' HB2' ' A' ' 52' ' ' ASN . 1.7 tt -126.94 137.93 53.2 Favored 'General case' 0 N--CA 1.448 -0.533 0 CA-C-N 113.333 -1.758 . . . . 0.0 106.679 177.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -67.82 131.49 45.64 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 124.141 1.924 . . . . 0.0 113.698 -177.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -40.59 -45.48 2.32 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 112.983 -1.917 . . . . 0.0 114.778 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.533 ' CD ' ' H ' ' A' ' 25' ' ' GLU . 16.1 mp0 -55.79 -55.25 34.61 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 123.247 1.498 . . . . 0.0 111.2 177.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.431 ' NE2' ' HB3' ' A' ' 51' ' ' LEU . 35.0 tt0 -59.06 -38.97 80.68 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.305 177.18 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.435 ' HD2' ' O ' ' A' ' 16' ' ' ILE . 0.0 OUTLIER -56.62 -50.73 71.16 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 120.731 -1.231 . . . . 0.0 108.123 176.963 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 46.9 m-80 -57.99 -46.14 85.68 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.732 0.641 . . . . 0.0 112.732 177.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.16 -47.51 78.11 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-O 122.117 0.961 . . . . 0.0 109.414 177.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -62.44 -50.67 70.54 Favored 'General case' 0 C--O 1.217 -0.61 0 O-C-N 121.447 -0.783 . . . . 0.0 110.111 177.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 16.7 mt -45.6 -49.82 3.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-O 123.359 1.552 . . . . 0.0 112.387 177.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.429 ' O ' ' HB3' ' A' ' 35' ' ' LYS 0.405 4.8 tp-100 -60.0 -56.23 24.26 Favored 'General case' 0 N--CA 1.424 -1.726 0 CA-C-N 113.522 -1.672 . . . . 0.0 109.169 179.265 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.9 t -61.62 -33.83 74.61 Favored 'General case' 0 N--CA 1.467 0.402 0 O-C-N 120.443 -1.41 . . . . 0.0 114.064 177.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 31.7 mt -65.95 -36.18 82.64 Favored 'General case' 0 C--O 1.235 0.342 0 C-N-CA 125.397 1.479 . . . . 0.0 109.668 177.322 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.442 ' HA ' ' CZ ' ' A' ' 5' ' ' PHE . 1.3 ttpm? -66.59 -41.08 89.04 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 114.48 -1.236 . . . . 0.0 109.779 176.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -71.83 -66.68 0.61 Allowed 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 115.802 1.779 . . . . 0.0 115.802 177.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -102.83 126.76 31.73 Favored Pre-proline 0 C--O 1.239 0.535 0 CA-C-N 120.656 1.571 . . . . 0.0 114.215 -177.809 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -77.82 -50.09 0.09 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.841 0 C-N-CA 123.091 2.528 . . . . 0.0 114.713 177.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 95.8 p -60.5 -43.51 96.95 Favored 'General case' 0 N--CA 1.465 0.275 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 -177.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.461 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 58.0 mt-30 -74.51 -21.23 59.65 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-O 117.766 -1.111 . . . . 0.0 112.929 -178.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.491 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 94.2 p -48.35 -37.73 17.43 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 121.238 1.836 . . . . 0.0 114.515 -177.318 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.33 -42.19 77.3 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-O 123.655 1.693 . . . . 0.0 109.739 177.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.452 HD22 ' HA ' ' A' ' 43' ' ' ASN . 1.7 t-20 -70.75 -52.6 19.76 Favored 'General case' 0 C--O 1.219 -0.509 0 N-CA-C 105.993 -1.854 . . . . 0.0 105.993 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.491 ' HG ' ' HA ' ' A' ' 41' ' ' SER . 1.1 mt -50.31 -30.46 12.07 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 115.636 1.717 . . . . 0.0 115.636 177.29 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.424 HD22 ' CB ' ' A' ' 12' ' ' ALA . 26.3 tp -75.75 -52.95 9.3 Favored 'General case' 0 CA--C 1.504 -0.795 0 N-CA-C 107.308 -1.368 . . . . 0.0 107.308 -177.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.51 -41.08 63.11 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 113.073 -1.876 . . . . 0.0 107.811 177.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -65.98 -51.85 54.75 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 119.174 -1.01 . . . . 0.0 112.397 -177.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.13 -38.77 73.97 Favored 'General case' 0 C--N 1.327 -0.398 0 O-C-N 120.503 -1.373 . . . . 0.0 112.208 177.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 9.1 tmtm? -65.4 -45.11 85.29 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.752 0.787 . . . . 0.0 109.552 177.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 46.8 mtpt -60.59 -41.22 94.24 Favored 'General case' 0 C--O 1.233 0.218 0 O-C-N 119.915 -1.741 . . . . 0.0 108.859 -178.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.537 ' C ' HE21 ' A' ' 55' ' ' GLN . 39.4 mt -65.64 -51.1 62.12 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 114.418 -1.265 . . . . 0.0 110.955 177.531 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.405 ' HB2' ' HB2' ' A' ' 22' ' ' LEU . 2.1 t30 -46.85 -49.68 19.75 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 123.856 1.789 . . . . 0.0 110.975 178.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -62.6 -46.89 86.22 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 111.684 -2.507 . . . . 0.0 111.263 177.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.3 -39.93 73.52 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 119.299 -2.126 . . . . 0.0 110.809 176.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.537 HE21 ' C ' ' A' ' 51' ' ' LEU . 39.8 mt-30 -75.41 -5.69 46.24 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.332 1.053 . . . . 0.0 112.902 177.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -64.56 155.47 81.23 Favored Pre-proline 0 C--O 1.235 0.308 0 O-C-N 120.092 -1.63 . . . . 0.0 113.555 -177.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -72.25 66.95 3.49 Favored 'Trans proline' 0 CA--C 1.538 0.68 0 C-N-CA 124.119 3.213 . . . . 0.0 114.254 177.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.452 0 CA-C-N 113.504 -1.68 . . . . 0.0 111.965 178.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 27.3 m . . . . . 0 CA--C 1.532 0.251 0 CA-C-O 118.62 -0.705 . . . . 0.0 112.366 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.7 p30 -78.54 176.85 9.04 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 117.821 2.526 . . . . 0.0 117.821 -177.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 41.6 m-20 -103.11 14.96 30.59 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 113.302 -1.772 . . . . 0.0 111.326 177.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.486 ' HB3' ' HZ2' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -82.12 -9.91 59.37 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 115.606 1.706 . . . . 0.0 115.606 -177.376 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.415 ' CZ ' ' NZ ' ' A' ' 4' ' ' LYS . 48.2 m-85 -86.54 -122.75 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.267 0 O-C-N 120.331 -1.48 . . . . 0.0 113.33 -178.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.729 HD21 ' N ' ' A' ' 40' ' ' GLN . 0.7 OUTLIER -83.22 -170.32 2.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 123.251 1.5 . . . . 0.0 112.682 177.838 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.1 mtmm -78.32 -62.96 1.51 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 123.973 1.844 . . . . 0.0 112.033 -177.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -89.9 33.93 0.85 Allowed 'General case' 0 N--CA 1.447 -0.602 0 C-N-CA 128.698 2.799 . . . . 0.0 108.649 -178.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.48 ' HA ' HD11 ' A' ' 34' ' ' LEU 0.329 0.1 OUTLIER -44.63 -80.61 0.01 OUTLIER 'General case' 0 N--CA 1.426 -1.675 0 N-CA-C 117.197 2.295 . . . . 0.0 117.197 -176.989 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 15.3 mm-40 -65.49 -25.61 67.55 Favored 'General case' 0 C--N 1.311 -1.075 0 CA-C-N 111.448 -2.614 . . . . 0.0 112.297 -179.364 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.41 -49.78 62.33 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 120.531 1.514 . . . . 0.0 107.569 177.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.556 ' HA ' HD22 ' A' ' 45' ' ' LEU . . . -58.06 -45.51 86.95 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.061 177.289 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -53.2 -51.14 63.07 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 123.652 1.691 . . . . 0.0 111.266 177.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 6.8 m-30 -54.45 -55.58 27.49 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 113.636 -1.62 . . . . 0.0 112.296 177.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -61.73 -33.36 73.91 Favored 'General case' 0 N--CA 1.454 -0.238 0 CA-C-O 121.708 0.766 . . . . 0.0 111.362 179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 14.6 mt -60.48 -53.39 49.56 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 O-C-N 120.359 -1.463 . . . . 0.0 108.354 177.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.438 ' HA ' ' HD3' ' A' ' 27' ' ' ARG . 51.9 mt -51.22 -49.74 60.49 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-O 122.856 1.313 . . . . 0.0 110.297 177.237 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 26.8 t-80 -59.39 -16.53 23.67 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 112.661 -2.063 . . . . 0.0 116.208 179.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.401 HD13 HD13 ' A' ' 22' ' ' LEU . 71.7 mt -58.33 102.55 0.31 Allowed Pre-proline 0 CA--C 1.547 0.847 0 CA-C-N 122.926 2.603 . . . . 0.0 114.733 -177.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -80.52 -17.0 10.28 Favored 'Trans proline' 0 N--CA 1.463 -0.299 0 C-N-CA 123.47 2.78 . . . . 0.0 114.37 -177.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.811 HD22 ' HB2' ' A' ' 56' ' ' ALA . 1.5 p-10 -118.61 40.66 3.18 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 126.223 2.916 . . . . 0.0 111.204 177.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.401 HD13 HD13 ' A' ' 19' ' ' LEU . 1.0 OUTLIER -141.19 141.55 34.07 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 109.725 -3.398 . . . . 0.0 106.68 177.435 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 44.2 p-10 -87.55 158.68 18.85 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 122.36 1.076 . . . . 0.0 112.846 -177.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.1 mm-40 -50.25 -43.53 53.14 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.036 -0.984 . . . . 0.0 112.413 178.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -52.47 -54.93 25.83 Favored 'General case' 0 C--O 1.237 0.422 0 O-C-N 121.547 -0.72 . . . . 0.0 111.83 177.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.561 ' NE2' HE22 ' A' ' 55' ' ' GLN . 32.7 mt-30 -60.56 -43.91 96.73 Favored 'General case' 0 C--N 1.343 0.31 0 O-C-N 120.409 -1.432 . . . . 0.0 110.49 177.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.438 ' HD3' ' HA ' ' A' ' 17' ' ' LEU . 20.3 ttm-85 -50.83 -54.55 22.81 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-O 122.336 1.065 . . . . 0.0 110.931 178.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 62.1 m-80 -60.25 -44.12 95.55 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.577 177.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.29 -47.76 77.99 Favored 'General case' 0 CA--C 1.528 0.099 0 O-C-N 120.715 -1.24 . . . . 0.0 110.807 177.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 58.1 m-85 -63.22 -45.04 93.52 Favored 'General case' 0 C--N 1.331 -0.208 0 O-C-N 121.389 -0.82 . . . . 0.0 110.287 177.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 34.1 mt -53.55 -47.73 59.75 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-O 122.822 1.296 . . . . 0.0 110.409 176.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.323 1.5 tp60 -55.4 -49.63 71.84 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 125.127 1.371 . . . . 0.0 110.703 177.166 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 34.2 t -63.58 -32.93 74.55 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.128 177.162 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.48 HD11 ' HA ' ' A' ' 9' ' ' GLN . 0.1 OUTLIER -62.77 -37.92 88.55 Favored 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.546 1.539 . . . . 0.0 109.99 177.63 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.21 -49.1 65.82 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 113.056 -1.884 . . . . 0.0 110.041 177.106 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -72.26 -48.13 44.93 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 116.407 2.002 . . . . 0.0 116.407 177.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.457 ' HB3' HD11 ' A' ' 44' ' ' LEU . 29.1 t0 -79.47 118.72 73.95 Favored Pre-proline 0 CA--C 1.535 0.381 0 N-CA-C 116.488 2.033 . . . . 0.0 116.488 -177.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.432 ' HD3' ' HA ' ' A' ' 37' ' ' ASP . 8.2 Cg_exo -95.64 -14.55 0.56 Allowed 'Trans proline' 0 CA--C 1.532 0.419 0 C-N-CA 125.096 3.864 . . . . 0.0 113.262 177.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 60.6 p -100.77 -39.97 7.56 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 119.046 2.98 . . . . 0.0 119.046 -177.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.729 ' N ' HD21 ' A' ' 6' ' ' ASN . 36.1 mt-30 -121.72 43.25 2.89 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 120.73 3.604 . . . . 0.0 120.73 -177.012 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.531 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 58.2 m -54.64 -36.41 64.52 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 125.609 3.822 . . . . 0.0 111.62 179.068 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -54.97 -37.36 66.41 Favored 'General case' 0 C--O 1.223 -0.311 0 O-C-N 120.018 -1.676 . . . . 0.0 109.589 176.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.418 ' CG ' ' HB3' ' A' ' 40' ' ' GLN . 1.8 m-20 -62.98 -50.12 72.02 Favored 'General case' 0 C--O 1.223 -0.314 0 O-C-N 120.227 -1.545 . . . . 0.0 107.245 177.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.531 ' HG ' ' HA ' ' A' ' 41' ' ' SER . 1.1 mt -54.83 -34.62 63.04 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 115.442 1.645 . . . . 0.0 115.442 177.285 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.556 HD22 ' HA ' ' A' ' 12' ' ' ALA . 29.0 tp -76.61 -50.18 14.46 Favored 'General case' 0 CA--C 1.509 -0.61 0 C-N-CA 124.887 1.275 . . . . 0.0 108.987 -177.312 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.72 -34.51 71.42 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-N 113.771 -1.559 . . . . 0.0 107.302 177.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -64.79 -58.23 6.8 Favored 'General case' 0 CA--C 1.522 -0.13 0 CA-C-O 122.056 0.932 . . . . 0.0 113.057 178.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -53.52 -39.86 65.0 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.85 0.833 . . . . 0.0 112.756 177.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -67.81 -41.19 83.5 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.197 177.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.3 mtpm? -60.65 -40.93 93.84 Favored 'General case' 0 CA--C 1.511 -0.525 0 O-C-N 120.725 -1.234 . . . . 0.0 109.448 178.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 19.9 mt -64.29 -53.41 49.38 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.024 -1.444 . . . . 0.0 109.247 177.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.401 ' HA ' ' NE2' ' A' ' 55' ' ' GLN . 2.4 t30 -49.06 -46.61 44.73 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-O 123.003 1.383 . . . . 0.0 112.13 -178.061 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 77.7 m-20 -69.26 -50.22 48.96 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 113.533 -1.667 . . . . 0.0 111.478 177.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.68 -42.52 79.19 Favored 'General case' 0 N--CA 1.458 -0.058 0 O-C-N 120.402 -1.436 . . . . 0.0 113.424 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.561 HE22 ' NE2' ' A' ' 26' ' ' GLN . 1.2 pt20 -78.24 -0.58 29.14 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 121.217 -0.927 . . . . 0.0 112.944 179.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.811 ' HB2' HD22 ' A' ' 21' ' ' ASN . . . -90.15 -92.11 0.0 OUTLIER Pre-proline 0 CA--C 1.541 0.608 0 CA-C-O 116.125 -1.893 . . . . 0.0 115.291 -177.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.507 ' CD ' ' HB3' ' A' ' 56' ' ' ALA . 22.6 Cg_endo -72.48 69.34 3.44 Favored 'Trans proline' 0 C--N 1.351 0.671 0 C-N-CA 124.958 3.772 . . . . 0.0 117.445 -177.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.44 0 CA-C-N 114.292 -1.322 . . . . 0.0 111.46 177.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 56.1 t . . . . . 0 CA--C 1.535 0.402 0 CA-C-O 120.77 0.319 . . . . 0.0 111.136 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -67.59 -109.69 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.594 0 N-CA-C 118.595 2.813 . . . . 0.0 118.595 -177.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -160.36 92.25 0.97 Allowed 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 116.43 2.011 . . . . 0.0 116.43 -176.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.412 ' O ' ' HG3' ' A' ' 9' ' ' GLN . 13.7 mptt -78.27 43.4 0.45 Allowed 'General case' 0 N--CA 1.478 0.951 0 O-C-N 118.801 -2.437 . . . . 0.0 117.417 -177.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 61.7 m-85 -82.24 60.39 4.96 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 119.318 -2.114 . . . . 0.0 114.75 -177.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -128.93 -46.54 1.25 Allowed 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 115.858 1.799 . . . . 0.0 115.858 -177.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 4.7 mtpm? -90.24 -136.97 0.13 Allowed 'General case' 0 CA--C 1.543 0.703 0 O-C-N 118.761 -2.462 . . . . 0.0 115.82 -177.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.64 -6.97 8.84 Favored 'General case' 0 N--CA 1.465 0.303 0 O-C-N 119.367 -2.083 . . . . 0.0 112.592 -178.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.412 ' HG3' ' O ' ' A' ' 4' ' ' LYS . 1.5 tm0? -37.41 -55.47 1.05 Allowed 'General case' 0 N--CA 1.422 -1.873 0 C-N-CA 129.061 2.944 . . . . 0.0 114.952 177.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 53.6 mm-40 -72.13 -36.23 69.33 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 118.733 -1.187 . . . . 0.0 112.619 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -58.89 -49.05 79.24 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 121.194 1.815 . . . . 0.0 107.75 177.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.624 ' HA ' HD22 ' A' ' 45' ' ' LEU . . . -56.12 -44.37 79.06 Favored 'General case' 0 C--O 1.217 -0.626 0 CA-C-N 113.203 -1.817 . . . . 0.0 110.376 177.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -52.57 -55.63 20.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 123.523 1.63 . . . . 0.0 111.3 177.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -56.98 -44.47 82.72 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 114.568 -1.196 . . . . 0.0 111.618 177.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.449 ' HB3' HD11 ' A' ' 45' ' ' LEU . 0.0 OUTLIER -59.1 -46.12 89.11 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 123.017 1.389 . . . . 0.0 108.947 177.358 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.2 mt -56.1 -46.81 81.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 O-C-N 119.845 -1.784 . . . . 0.0 109.585 -178.025 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 72.0 mt -65.23 -38.08 89.28 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.95 0.881 . . . . 0.0 111.189 177.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -59.61 -38.9 82.55 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.555 1.142 . . . . 0.0 113.175 177.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 87.2 mt -54.25 104.85 0.46 Allowed Pre-proline 0 CA--C 1.539 0.534 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 -178.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.454 ' C ' ' H ' ' A' ' 22' ' ' LEU . 33.4 Cg_endo -81.21 -50.72 0.05 OUTLIER 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 123.525 2.816 . . . . 0.0 114.945 -177.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.6 HD21 ' CG ' ' A' ' 52' ' ' ASN . 2.5 p-10 -83.85 30.7 0.5 Allowed 'General case' 0 C--O 1.236 0.352 0 CA-C-O 125.579 2.609 . . . . 0.0 111.611 -177.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.469 ' HA ' ' NE2' ' A' ' 55' ' ' GLN . 6.8 tp -109.3 139.67 43.95 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 111.013 -2.812 . . . . 0.0 109.487 177.704 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.427 ' H ' ' NE2' ' A' ' 26' ' ' GLN . 48.4 t-20 -70.52 129.94 40.54 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-O 123.245 1.497 . . . . 0.0 110.145 177.31 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.5 mp0 -55.56 -27.26 47.99 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 120.427 -1.421 . . . . 0.0 112.117 177.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.529 ' HA ' ' ND2' ' A' ' 28' ' ' ASN . 1.8 tm-20 -60.47 -68.19 0.32 Allowed 'General case' 0 C--O 1.236 0.371 0 O-C-N 121.253 -0.904 . . . . 0.0 108.952 177.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.478 ' NE2' HE22 ' A' ' 55' ' ' GLN . 10.6 pt20 -50.8 -46.3 59.68 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 120.722 -1.236 . . . . 0.0 110.224 177.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 18.6 ttm105 -48.82 -51.37 29.83 Favored 'General case' 0 N--CA 1.477 0.884 0 O-C-N 120.134 -1.604 . . . . 0.0 112.356 177.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.529 ' ND2' ' HA ' ' A' ' 25' ' ' GLU . 12.7 p30 -61.33 -46.17 91.36 Favored 'General case' 0 C--O 1.222 -0.364 0 CA-C-N 115.395 -0.821 . . . . 0.0 112.565 177.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.82 -44.51 66.73 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 122.32 1.057 . . . . 0.0 110.587 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.457 ' CE2' ' HA ' ' A' ' 48' ' ' ALA . 47.1 m-85 -62.47 -52.31 64.0 Favored 'General case' 0 N--CA 1.454 -0.273 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 176.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 14.7 mt -50.17 -48.86 23.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 CA-C-O 122.338 1.066 . . . . 0.0 112.603 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.29 0.0 OUTLIER -60.51 -53.77 53.51 Favored 'General case' 0 N--CA 1.432 -1.367 0 C-N-CA 127.591 2.356 . . . . 0.0 111.639 -178.386 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 23.0 t -63.66 -41.99 98.15 Favored 'General case' 0 C--N 1.332 -0.187 0 O-C-N 120.694 -1.254 . . . . 0.0 110.941 177.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.421 HD13 HD23 ' A' ' 44' ' ' LEU . 21.1 tp -58.49 -41.33 85.09 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 121.029 -1.045 . . . . 0.0 112.557 177.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.78 -42.6 73.59 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 121.912 0.863 . . . . 0.0 111.15 177.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -73.51 -53.55 10.33 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 117.971 2.582 . . . . 0.0 117.971 -179.429 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.408 ' HB2' ' HD3' ' A' ' 38' ' ' PRO . 31.3 m-20 -143.7 -58.73 0.02 OUTLIER Pre-proline 0 C--O 1.237 0.41 0 N-CA-C 118.343 2.72 . . . . 0.0 118.343 -176.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.408 ' HD3' ' HB2' ' A' ' 37' ' ' ASP . 0.5 OUTLIER -43.65 127.69 6.24 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 124.36 3.373 . . . . 0.0 115.484 177.79 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.5 t -100.73 -28.67 12.7 Favored 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 111.268 -2.696 . . . . 0.0 112.058 -177.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.438 ' H ' ' CD ' ' A' ' 40' ' ' GLN . 0.4 OUTLIER -79.28 63.54 3.94 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 124.907 2.289 . . . . 0.0 110.386 177.759 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.408 ' CB ' ' HA ' ' A' ' 9' ' ' GLN . 66.8 p -55.21 -38.35 68.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 112.978 -1.919 . . . . 0.0 112.9 -178.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -53.89 -39.36 65.7 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.712 -0.617 . . . . 0.0 110.009 177.34 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -71.06 -55.5 8.11 Favored 'General case' 0 N--CA 1.454 -0.258 0 O-C-N 121.187 -0.946 . . . . 0.0 108.77 177.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.421 HD23 HD13 ' A' ' 34' ' ' LEU . 15.7 tp -57.25 -23.55 48.9 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-O 125.454 2.55 . . . . 0.0 111.751 -177.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.624 HD22 ' HA ' ' A' ' 12' ' ' ALA . 35.8 tp -77.42 -53.18 7.96 Favored 'General case' 0 CA--C 1.503 -0.865 0 CA-C-N 112.585 -2.098 . . . . 0.0 106.83 -177.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -52.44 -33.9 46.23 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 107.781 -1.192 . . . . 0.0 107.781 177.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -64.01 -59.26 4.71 Favored 'General case' 0 C--N 1.345 0.412 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.89 177.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.457 ' HA ' ' CE2' ' A' ' 30' ' ' PHE . . . -50.88 -43.09 59.51 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 122.944 1.354 . . . . 0.0 112.475 177.461 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.73 -40.29 96.74 Favored 'General case' 0 N--CA 1.447 -0.611 0 O-C-N 121.39 -0.819 . . . . 0.0 110.096 177.65 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.87 -41.65 92.0 Favored 'General case' 0 CA--C 1.517 -0.306 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 52.8 mt -63.36 -50.37 70.22 Favored 'General case' 0 N--CA 1.451 -0.391 0 C-N-CA 119.32 -0.952 . . . . 0.0 109.465 177.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.6 ' CG ' HD21 ' A' ' 21' ' ' ASN . 3.2 t-20 -49.9 -41.73 46.48 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 119.908 -1.745 . . . . 0.0 110.706 177.2 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.509 ' HA ' ' CG ' ' A' ' 57' ' ' PRO . 72.9 m-20 -60.52 -50.29 74.13 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 114.222 -1.353 . . . . 0.0 112.093 177.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.97 -43.13 77.28 Favored 'General case' 0 N--CA 1.456 -0.167 0 CA-C-O 122.105 0.955 . . . . 0.0 111.723 177.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.478 HE22 ' NE2' ' A' ' 26' ' ' GLN . 0.0 OUTLIER -69.96 -54.29 13.96 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 115.423 1.638 . . . . 0.0 115.423 177.356 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.531 ' HB3' ' CD ' ' A' ' 57' ' ' PRO . . . -91.14 -76.05 0.04 OUTLIER Pre-proline 0 C--N 1.323 -0.572 0 N-CA-C 117.247 2.314 . . . . 0.0 117.247 -177.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.531 ' CD ' ' HB3' ' A' ' 56' ' ' ALA . 19.1 Cg_endo -76.36 61.84 6.79 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 124.401 3.4 . . . . 0.0 114.779 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.414 ' C ' ' NZ ' ' A' ' 58' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.437 -1.113 0 CA-C-N 112.843 -1.98 . . . . 0.0 115.018 177.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 91.7 t . . . . . 0 N--CA 1.466 0.335 0 CA-C-O 124.815 2.245 . . . . 0.0 108.966 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.6 p30 -68.73 -157.23 0.02 OUTLIER 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 109.461 -3.518 . . . . 0.0 111.595 177.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -118.9 7.04 11.42 Favored 'General case' 0 CA--C 1.542 0.643 0 CA-C-O 123.282 1.515 . . . . 0.0 109.107 177.405 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.02 117.95 28.4 Favored 'General case' 0 N--CA 1.451 -0.4 0 O-C-N 120.932 -1.105 . . . . 0.0 111.165 -177.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.453 ' HB2' ' NE2' ' A' ' 10' ' ' GLN . 19.2 m-85 -98.26 107.54 20.03 Favored 'General case' 0 C--O 1.239 0.507 0 O-C-N 120.115 -1.616 . . . . 0.0 111.901 177.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.422 HD21 ' CB ' ' A' ' 38' ' ' PRO . 0.3 OUTLIER -81.8 174.57 11.2 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 114.43 -1.259 . . . . 0.0 112.079 178.08 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.425 ' HD2' ' N ' ' A' ' 8' ' ' GLU . 3.6 pptp? -39.25 -56.73 1.47 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 119.226 3.047 . . . . 0.0 119.226 -176.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.506 ' HG3' ' HA ' ' A' ' 39' ' ' SER . 1.7 pm0 -65.25 -44.72 87.22 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 124.521 2.105 . . . . 0.0 112.182 -177.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.493 ' H ' ' HG2' ' A' ' 8' ' ' GLU 0.309 10.4 tt0 -53.53 -45.33 69.76 Favored 'General case' 0 N--CA 1.428 -1.527 0 C-N-CA 127.358 2.263 . . . . 0.0 110.051 177.798 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.453 ' NE2' ' HB2' ' A' ' 5' ' ' PHE . 33.5 mm-40 -70.04 -49.89 46.75 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.097 -0.956 . . . . 0.0 112.528 179.135 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -51.71 -45.8 63.68 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 120.029 1.286 . . . . 0.0 109.526 178.091 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.513 ' HA ' HD22 ' A' ' 45' ' ' LEU . . . -62.26 -42.44 99.34 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 114.582 -1.19 . . . . 0.0 112.242 177.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -57.76 -51.68 68.58 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 122.825 1.298 . . . . 0.0 112.826 177.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -57.14 -52.06 66.82 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.173 -0.921 . . . . 0.0 112.566 177.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -59.31 -38.07 79.32 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.164 -0.96 . . . . 0.0 109.651 177.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.2 mt -56.01 -51.83 56.91 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.318 0 O-C-N 121.078 -1.014 . . . . 0.0 108.831 177.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 81.3 mt -52.65 -45.18 66.59 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 122.664 1.221 . . . . 0.0 109.632 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 51.5 t-80 -66.41 -12.64 58.12 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 117.152 2.279 . . . . 0.0 117.152 178.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.777 HD13 HD13 ' A' ' 22' ' ' LEU . 57.3 mt -60.99 104.11 0.43 Allowed Pre-proline 0 CA--C 1.551 0.994 0 CA-C-N 123.778 2.99 . . . . 0.0 117.104 -177.391 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 19' ' ' LEU . 93.1 Cg_endo -63.05 -60.21 0.19 Allowed 'Trans proline' 0 CA--C 1.534 0.479 0 C-N-CA 123.77 2.98 . . . . 0.0 119.752 -177.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.644 HD22 ' HB2' ' A' ' 56' ' ' ALA . 1.3 p-10 -88.51 27.47 1.27 Allowed 'General case' 0 CA--C 1.523 -0.08 0 O-C-N 118.434 -2.666 . . . . 0.0 113.121 -177.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.777 HD13 HD13 ' A' ' 19' ' ' LEU . 6.8 tt -102.51 137.47 40.7 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 113.44 -1.709 . . . . 0.0 114.128 177.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 12.7 p30 -87.1 151.02 23.58 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-O 122.515 1.15 . . . . 0.0 112.832 177.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -62.82 -29.23 70.57 Favored 'General case' 0 N--CA 1.448 -0.571 0 N-CA-C 115.77 1.767 . . . . 0.0 115.77 -177.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.416 ' H ' ' CD ' ' A' ' 25' ' ' GLU . 1.7 mp0 -58.86 -51.21 71.01 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 124.186 1.946 . . . . 0.0 109.49 177.267 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.543 HE22 HD11 ' A' ' 22' ' ' LEU . 0.8 OUTLIER -62.64 -47.99 81.32 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 113.398 -1.728 . . . . 0.0 108.467 177.47 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.4 ' NH1' ' HB2' ' A' ' 19' ' ' LEU . 12.2 tpp180 -47.84 -52.44 19.01 Favored 'General case' 0 C--O 1.22 -0.486 0 O-C-N 121.196 -0.94 . . . . 0.0 111.112 177.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 37.8 t-20 -57.78 -52.05 67.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 113.462 -1.699 . . . . 0.0 111.879 177.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -51.41 -48.27 62.7 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 123.354 1.549 . . . . 0.0 110.425 177.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -64.96 -47.27 78.21 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 114.677 -1.147 . . . . 0.0 110.999 177.256 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 28.6 mt -51.01 -39.08 18.88 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 CA-C-N 120.913 1.688 . . . . 0.0 110.369 176.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.306 5.0 tp60 -67.02 -54.21 23.91 Favored 'General case' 0 N--CA 1.435 -1.177 0 O-C-N 120.668 -1.27 . . . . 0.0 111.546 177.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.2 t -59.63 -35.15 73.82 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 119.986 -1.696 . . . . 0.0 111.67 177.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.438 HD11 ' CB ' ' A' ' 12' ' ' ALA . 2.5 mm? -60.12 -46.73 88.63 Favored 'General case' 0 CA--C 1.521 -0.147 0 C-N-CA 125.605 1.562 . . . . 0.0 107.914 176.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.81 -39.86 90.56 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 120.986 -1.071 . . . . 0.0 109.748 176.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 -72.76 -51.3 19.69 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 115.856 1.799 . . . . 0.0 115.856 177.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -105.66 125.68 32.69 Favored Pre-proline 0 CA--C 1.539 0.523 0 O-C-N 117.972 -2.955 . . . . 0.0 114.883 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.422 ' CB ' HD21 ' A' ' 6' ' ' ASN . 77.8 Cg_endo -76.28 -72.93 0.01 OUTLIER 'Trans proline' 0 N--CA 1.457 -0.65 0 C-N-CA 122.754 2.303 . . . . 0.0 114.421 177.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.506 ' HA ' ' HG3' ' A' ' 8' ' ' GLU . 72.0 m -62.63 -29.47 70.64 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 118.451 -2.655 . . . . 0.0 114.897 -177.391 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.444 ' O ' ' HG ' ' A' ' 44' ' ' LEU . 2.6 mp0 -70.14 -11.27 60.77 Favored 'General case' 0 C--N 1.332 -0.168 0 O-C-N 120.646 -1.284 . . . . 0.0 112.137 177.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 25.7 t -43.59 -39.6 3.59 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.945 1.298 . . . . 0.0 113.149 177.801 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.71 -38.22 72.02 Favored 'General case' 0 CA--C 1.538 0.518 0 O-C-N 120.842 -1.162 . . . . 0.0 111.926 177.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -71.62 -48.67 46.44 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 106.588 -1.634 . . . . 0.0 106.588 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 40' ' ' GLN . 0.7 OUTLIER -54.98 -30.58 59.53 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 123.966 1.841 . . . . 0.0 114.975 177.419 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.513 HD22 ' HA ' ' A' ' 12' ' ' ALA . 13.0 tp -77.24 -54.22 6.76 Favored 'General case' 0 CA--C 1.508 -0.663 0 CA-C-N 113.724 -1.58 . . . . 0.0 108.244 -177.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.88 -35.25 66.3 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-N 113.684 -1.598 . . . . 0.0 109.027 177.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 19.8 mm-40 -67.12 -59.91 3.06 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-N 114.833 -1.076 . . . . 0.0 112.453 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -51.05 -41.58 59.96 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 121.222 -0.924 . . . . 0.0 112.343 177.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.427 ' O ' ' HB3' ' A' ' 52' ' ' ASN . 0.6 OUTLIER -64.51 -40.65 96.04 Favored 'General case' 0 C--O 1.241 0.636 0 CA-C-O 122.017 0.913 . . . . 0.0 112.323 177.811 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.437 ' HD3' ' N ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -65.04 -38.44 90.86 Favored 'General case' 0 C--N 1.341 0.237 0 CA-C-O 122.595 1.188 . . . . 0.0 108.364 177.66 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.449 ' C ' HE21 ' A' ' 55' ' ' GLN . 40.9 mt -65.94 -40.84 91.72 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 121.291 -0.88 . . . . 0.0 109.223 177.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.427 ' HB3' ' O ' ' A' ' 49' ' ' LYS . 1.0 OUTLIER -50.34 -52.19 39.12 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 122.468 1.127 . . . . 0.0 108.162 177.086 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -55.21 -58.68 6.68 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 112.504 -2.134 . . . . 0.0 110.622 178.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -54.98 -31.23 60.7 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 114.914 1.449 . . . . 0.0 114.914 -177.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.449 HE21 ' C ' ' A' ' 51' ' ' LEU . 41.8 mt-30 -69.2 -20.56 63.98 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 115.119 1.526 . . . . 0.0 115.119 178.159 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.644 ' HB2' HD22 ' A' ' 21' ' ' ASN . . . -82.9 -53.95 0.58 Allowed Pre-proline 0 C--N 1.326 -0.444 0 N-CA-C 114.546 1.313 . . . . 0.0 114.546 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_endo -79.96 50.94 3.7 Favored 'Trans proline' 0 CA--C 1.535 0.527 1 C-N-CA 125.35 4.033 . . . . 0.0 115.652 -177.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.526 ' HZ3' ' C ' ' A' ' 58' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.321 -0.642 0 CA-C-N 112.358 -2.201 . . . . 0.0 111.278 177.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 75.7 t . . . . . 0 N--CA 1.466 0.347 0 CA-C-O 125.27 2.462 . . . . 0.0 107.983 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.4 p-10 -84.74 -138.19 0.06 Allowed 'General case' 0 N--CA 1.442 -0.852 1 CA-C-N 108.205 -4.089 . . . . 0.0 106.205 177.129 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.401 ' HA ' ' O ' ' A' ' 35' ' ' LYS . 14.3 m120 -71.09 -13.96 62.14 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.009 -1.057 . . . . 0.0 110.76 177.215 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -86.84 144.38 27.05 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-O 123.557 1.646 . . . . 0.0 112.245 177.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -80.58 107.99 13.84 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 112.977 -1.92 . . . . 0.0 115.576 -177.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.7 m120 -139.09 -53.84 0.57 Allowed 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 113.65 0.981 . . . . 0.0 113.65 177.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 16.5 pttp -71.94 -141.62 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 115.316 1.599 . . . . 0.0 115.316 -177.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -54.52 -26.24 30.51 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 119.072 -2.267 . . . . 0.0 112.155 -177.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . 0.333 12.5 tt0 -38.67 -49.26 1.55 Allowed 'General case' 0 N--CA 1.432 -1.361 1 C-N-CA 133.004 4.522 . . . . 0.0 109.212 176.797 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -73.53 -46.8 45.53 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 120.833 -1.167 . . . . 0.0 111.989 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -52.1 -47.54 65.19 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 120.064 -1.647 . . . . 0.0 109.691 177.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.573 ' HA ' HD22 ' A' ' 45' ' ' LEU . . . -59.29 -44.01 92.53 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 113.369 -1.742 . . . . 0.0 111.104 177.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -56.68 -53.53 56.63 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-O 122.95 1.357 . . . . 0.0 112.023 177.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -55.4 -47.9 75.18 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.767 177.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -63.31 -36.69 84.51 Favored 'General case' 0 CA--C 1.54 0.59 0 O-C-N 120.757 -1.214 . . . . 0.0 111.415 177.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -56.8 -44.57 82.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 125.454 1.502 . . . . 0.0 108.575 177.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 70.6 mt -64.71 -47.66 77.52 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 122.762 1.268 . . . . 0.0 109.591 176.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -58.82 -32.01 69.0 Favored 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 116.797 2.147 . . . . 0.0 116.797 -177.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.404 HD13 ' HB2' ' A' ' 52' ' ' ASN . 84.4 mt -53.1 96.35 0.1 OUTLIER Pre-proline 0 CA--C 1.548 0.868 0 N-CA-C 115.891 1.812 . . . . 0.0 115.891 -177.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 0.3 OUTLIER -80.29 3.02 8.01 Favored 'Trans proline' 0 N--CA 1.462 -0.377 0 C-N-CA 123.922 3.081 . . . . 0.0 113.575 -177.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.727 HD21 ' HB2' ' A' ' 56' ' ' ALA . 14.3 t30 -132.59 26.66 4.39 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-O 124.268 1.985 . . . . 0.0 113.377 -177.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.4 tt -121.33 146.58 46.7 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 113.39 -1.732 . . . . 0.0 107.805 177.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 23.1 p-10 -71.82 -155.57 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.746 0 O-C-N 119.403 -2.06 . . . . 0.0 115.536 179.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.583 ' H ' ' CD ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -90.58 -66.6 0.91 Allowed 'General case' 0 N--CA 1.443 -0.793 0 O-C-N 120.022 -1.674 . . . . 0.0 114.544 177.374 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -60.5 -37.28 80.6 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 114.501 1.297 . . . . 0.0 114.501 -177.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.453 HE21 ' CD ' ' A' ' 55' ' ' GLN . 23.7 mt-30 -64.66 -37.93 89.27 Favored 'General case' 0 C--N 1.347 0.484 0 CA-C-N 123.391 2.814 . . . . 0.0 108.13 177.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 15.5 ttm-85 -57.7 -49.69 75.67 Favored 'General case' 0 C--O 1.224 -0.268 0 O-C-N 121.703 -0.623 . . . . 0.0 109.907 177.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -54.8 -52.17 63.49 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 114.39 -1.277 . . . . 0.0 112.257 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.88 -50.65 68.19 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 122.652 1.215 . . . . 0.0 110.74 178.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.469 ' CE2' HD12 ' A' ' 51' ' ' LEU . 47.5 m-85 -61.09 -47.86 84.35 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-O 117.798 -1.096 . . . . 0.0 110.446 177.329 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 34.3 mt -49.07 -50.84 14.26 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 CA-C-N 121.222 1.828 . . . . 0.0 110.558 176.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.08 -55.17 25.92 Favored 'General case' 0 N--CA 1.424 -1.763 0 CA-C-O 122.564 1.174 . . . . 0.0 109.919 177.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 15.9 t -58.56 -31.86 68.38 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 113.89 1.07 . . . . 0.0 113.89 178.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 4.4 mt -69.01 -43.46 74.77 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 120.574 -1.328 . . . . 0.0 108.27 177.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.481 ' HZ1' ' CG ' ' A' ' 36' ' ' ASP . 0.9 OUTLIER -58.22 -37.71 75.38 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.256 177.783 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.481 ' CG ' ' HZ1' ' A' ' 35' ' ' LYS . 12.0 m-20 -84.3 0.15 50.19 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 120.074 -1.642 . . . . 0.0 114.313 176.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.551 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 31.9 t70 -78.9 115.59 53.43 Favored Pre-proline 0 CA--C 1.54 0.593 0 N-CA-C 120.041 3.349 . . . . 0.0 120.041 -177.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.551 ' HD3' ' HA ' ' A' ' 37' ' ' ASP . 12.4 Cg_exo -88.86 -21.31 1.34 Allowed 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 124.135 3.223 . . . . 0.0 111.618 177.238 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 80.1 p -100.24 -88.67 0.35 Allowed 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 115.468 1.655 . . . . 0.0 115.468 -176.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.433 ' O ' HD13 ' A' ' 44' ' ' LEU . 28.5 mm-40 -142.17 91.19 2.31 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 119.311 3.078 . . . . 0.0 119.311 -176.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.438 ' HA ' HD13 ' A' ' 44' ' ' LEU . 13.6 t -50.52 -16.8 0.4 Allowed 'General case' 0 N--CA 1.468 0.443 0 O-C-N 120.396 -1.44 . . . . 0.0 109.025 176.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -50.24 -40.35 47.51 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 120.816 1.644 . . . . 0.0 111.581 177.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.456 ' HB2' HD12 ' A' ' 44' ' ' LEU . 17.1 m-80 -67.2 -47.09 71.91 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 123.077 1.418 . . . . 0.0 107.408 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.605 ' CD1' ' H ' ' A' ' 44' ' ' LEU . 0.0 OUTLIER -60.18 -25.21 65.39 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 116.373 1.99 . . . . 0.0 116.373 177.221 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.573 HD22 ' HA ' ' A' ' 12' ' ' ALA . 33.3 tp -80.57 -48.73 12.28 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 106.089 -1.819 . . . . 0.0 106.089 -179.791 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -58.1 -37.87 75.37 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 177.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -65.29 -52.51 53.67 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 119.326 -0.949 . . . . 0.0 112.076 179.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -55.43 -41.77 73.25 Favored 'General case' 0 C--N 1.334 -0.068 0 O-C-N 121.804 -0.56 . . . . 0.0 112.013 177.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -61.31 -45.97 92.25 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 121.0 0.428 . . . . 0.0 110.149 177.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -57.14 -40.67 77.62 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 123.154 1.454 . . . . 0.0 108.415 -179.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.485 ' C ' HE21 ' A' ' 55' ' ' GLN . 73.7 mt -67.3 -47.15 71.43 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 113.775 -1.557 . . . . 0.0 111.698 177.542 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.404 ' HB2' HD13 ' A' ' 19' ' ' LEU . 1.0 OUTLIER -47.0 -50.7 18.76 Favored 'General case' 0 N--CA 1.468 0.473 0 O-C-N 119.84 -1.788 . . . . 0.0 109.419 177.294 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -58.86 -58.35 9.0 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 111.509 -2.587 . . . . 0.0 109.694 -179.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -56.34 -26.67 53.39 Favored 'General case' 0 CA--C 1.529 0.168 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.485 HE21 ' C ' ' A' ' 51' ' ' LEU . 41.4 mt-30 -69.05 -24.45 64.17 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 114.0 1.111 . . . . 0.0 114.0 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.727 ' HB2' HD21 ' A' ' 21' ' ' ASN . . . -81.4 -54.62 0.68 Allowed Pre-proline 0 C--N 1.327 -0.39 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 -178.049 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -78.97 51.49 3.87 Favored 'Trans proline' 0 CA--C 1.533 0.465 0 C-N-CA 125.105 3.87 . . . . 0.0 115.959 -177.67 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.532 ' C ' ' HZ3' ' A' ' 58' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.323 -0.579 0 CA-C-N 112.824 -1.989 . . . . 0.0 111.667 177.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.413 HG11 ' CZ ' ' A' ' 13' ' ' PHE . 0.2 OUTLIER . . . . . 0 CA--C 1.532 0.262 0 CA-C-O 117.865 -1.064 . . . . 0.0 112.781 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -85.5 -155.85 0.25 Allowed 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 119.129 3.011 . . . . 0.0 119.129 -177.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.655 HD22 ' H ' ' A' ' 3' ' ' ASN . 0.5 OUTLIER -69.19 -24.22 64.02 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 -177.465 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.0 mttp -58.55 -28.26 65.33 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 124.0 1.857 . . . . 0.0 109.359 177.534 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.409 ' HA ' ' CD ' ' A' ' 9' ' ' GLN . 75.9 m-85 -99.87 106.8 18.67 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 111.558 -2.565 . . . . 0.0 112.181 -178.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -93.96 -155.01 0.43 Allowed 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.634 -0.666 . . . . 0.0 112.223 177.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.496 ' CG ' ' H ' ' A' ' 8' ' ' GLU . 2.1 pttm -39.01 -89.54 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 119.457 3.132 . . . . 0.0 119.457 -177.064 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.496 ' H ' ' CG ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -57.31 -45.52 84.12 Favored 'General case' 0 C--O 1.225 -0.22 0 O-C-N 118.727 -2.483 . . . . 0.0 110.202 -177.898 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.49 ' O ' HD11 ' A' ' 34' ' ' LEU . 8.4 tt0 -39.88 -49.6 2.42 Favored 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 126.904 2.082 . . . . 0.0 110.753 177.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 26.1 mm-40 -69.2 -47.79 63.88 Favored 'General case' 0 C--N 1.329 -0.296 0 O-C-N 119.151 -2.218 . . . . 0.0 113.579 177.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -51.91 -44.42 63.82 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 123.854 1.788 . . . . 0.0 109.743 178.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.651 ' HA ' HD22 ' A' ' 45' ' ' LEU . . . -60.83 -49.6 76.84 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 112.222 -2.263 . . . . 0.0 111.738 177.604 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.413 ' CZ ' HG11 ' A' ' 1' ' ' VAL . 30.9 t80 -55.21 -51.36 66.81 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 123.126 1.441 . . . . 0.0 111.804 177.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 -57.24 -51.62 68.63 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 114.422 1.268 . . . . 0.0 114.422 177.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 13.1 tp10 -61.51 -37.16 82.67 Favored 'General case' 0 N--CA 1.455 -0.209 0 O-C-N 121.166 -0.958 . . . . 0.0 110.694 178.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 13.1 mt -57.7 -52.97 50.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 O-C-N 121.135 -0.978 . . . . 0.0 108.995 177.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 90.4 mt -50.99 -49.48 60.24 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-O 122.527 1.156 . . . . 0.0 109.602 177.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 55.3 t-80 -63.87 -14.09 50.43 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 117.06 2.245 . . . . 0.0 117.06 177.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.659 HD13 HD13 ' A' ' 22' ' ' LEU . 93.3 mt -54.61 100.8 0.23 Allowed Pre-proline 0 CA--C 1.547 0.835 0 CA-C-N 123.959 3.072 . . . . 0.0 117.005 -177.378 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 19' ' ' LEU . 50.4 Cg_exo -56.76 -41.1 79.19 Favored 'Trans proline' 0 C--N 1.351 0.707 0 C-N-CA 125.038 3.825 . . . . 0.0 116.108 -177.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 66.0 m-80 -104.98 23.63 13.27 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 122.955 1.36 . . . . 0.0 113.666 -177.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.659 HD13 HD13 ' A' ' 19' ' ' LEU . 1.6 tt -115.59 129.3 56.47 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-O 123.125 1.44 . . . . 0.0 110.527 179.047 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -78.69 145.42 34.56 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-N 112.888 -1.96 . . . . 0.0 112.695 178.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -48.9 -33.7 11.26 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 114.125 -1.398 . . . . 0.0 114.649 -177.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -60.56 -49.52 77.21 Favored 'General case' 0 C--N 1.324 -0.533 0 O-C-N 119.606 -1.934 . . . . 0.0 109.966 177.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.457 HE22 ' CD ' ' A' ' 55' ' ' GLN . 33.3 mt-30 -63.16 -43.83 97.17 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 177.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.447 ' N ' HD21 ' A' ' 22' ' ' LEU . 12.7 tpp180 -47.93 -53.23 16.59 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 115.362 -0.835 . . . . 0.0 111.06 177.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 71.5 m-20 -60.22 -48.32 82.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.938 -1.028 . . . . 0.0 112.15 177.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -52.89 -50.88 62.99 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-O 124.342 2.02 . . . . 0.0 111.389 177.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . 0.44 ' CG ' ' HB2' ' A' ' 48' ' ' ALA . 59.1 m-85 -60.49 -47.72 84.89 Favored 'General case' 0 C--O 1.215 -0.725 0 CA-C-N 112.471 -2.15 . . . . 0.0 109.308 177.666 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 41.6 mt -56.05 -40.44 63.8 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 CA-C-N 121.679 2.036 . . . . 0.0 111.667 177.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.31 1.7 tp60 -59.13 -55.89 29.25 Favored 'General case' 0 C--O 1.247 0.942 0 O-C-N 119.904 -1.747 . . . . 0.0 111.346 177.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 37.3 t -66.77 -29.59 69.59 Favored 'General case' 0 C--O 1.215 -0.751 0 C-N-CA 118.912 -1.115 . . . . 0.0 108.98 177.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.686 HD22 HD23 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -57.64 -48.36 79.67 Favored 'General case' 0 N--CA 1.464 0.26 0 O-C-N 118.373 -2.704 . . . . 0.0 111.183 177.65 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.444 ' HG3' ' N ' ' A' ' 36' ' ' ASP . 12.6 pttp -68.27 -45.41 73.2 Favored 'General case' 0 CA--C 1.536 0.421 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.405 177.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.444 ' N ' ' HG3' ' A' ' 35' ' ' LYS . 97.2 m-20 -74.79 -34.99 62.5 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 117.423 2.379 . . . . 0.0 117.423 -177.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.64 ' HB3' ' CG ' ' A' ' 40' ' ' GLN . 45.2 m-20 -104.72 106.7 55.88 Favored Pre-proline 0 CA--C 1.545 0.768 0 C-N-CA 126.408 1.883 . . . . 0.0 115.685 -177.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.408 ' HD2' ' HA ' ' A' ' 37' ' ' ASP . 87.7 Cg_endo -69.02 -96.68 0.01 OUTLIER 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.196 2.598 . . . . 0.0 118.225 -177.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 3.7 m -59.89 -27.12 66.44 Favored 'General case' 0 N--CA 1.471 0.619 0 O-C-N 117.983 -2.948 . . . . 0.0 115.82 -177.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.64 ' CG ' ' HB3' ' A' ' 37' ' ' ASP . 12.1 pm0 -69.89 -12.25 61.48 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 121.574 -0.704 . . . . 0.0 111.998 177.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 79.8 p -56.6 -22.85 36.77 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 120.124 -1.61 . . . . 0.0 111.17 177.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -57.91 -41.43 82.65 Favored 'General case' 0 CA--C 1.533 0.307 0 O-C-N 120.112 -1.617 . . . . 0.0 110.145 177.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -68.23 -46.89 69.31 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 178.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.686 HD23 HD22 ' A' ' 34' ' ' LEU . 27.7 tp -56.9 -28.63 62.15 Favored 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 122.978 1.37 . . . . 0.0 112.881 177.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.651 HD22 ' HA ' ' A' ' 12' ' ' ALA . 30.5 tp -78.9 -51.48 9.62 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 -178.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.73 -34.55 62.64 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 114.344 -1.298 . . . . 0.0 107.966 177.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -65.4 -60.73 2.66 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-N 115.183 -0.917 . . . . 0.0 112.825 177.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.44 ' HB2' ' CG ' ' A' ' 30' ' ' PHE . . . -51.46 -41.81 61.13 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 122.026 0.917 . . . . 0.0 112.627 178.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 26.3 tptp -62.87 -47.38 83.6 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.013 177.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.7 -35.26 79.99 Favored 'General case' 0 C--N 1.342 0.255 0 O-C-N 120.73 -1.231 . . . . 0.0 109.133 -177.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 14.0 mt -65.63 -51.73 57.37 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 119.818 -0.753 . . . . 0.0 109.048 177.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -46.71 -48.62 20.22 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 123.609 1.671 . . . . 0.0 110.583 179.219 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -60.51 -46.61 89.51 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 112.571 -2.104 . . . . 0.0 110.87 177.716 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.14 -44.74 75.37 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 120.954 -1.091 . . . . 0.0 110.333 177.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.457 ' CD ' HE22 ' A' ' 26' ' ' GLN . 0.0 OUTLIER -70.08 -23.05 63.0 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 115.769 1.766 . . . . 0.0 115.769 177.696 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -62.45 167.46 5.39 Favored Pre-proline 0 CA--C 1.541 0.603 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 179.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -79.31 148.44 21.13 Favored 'Trans proline' 0 CA--C 1.534 0.51 0 C-N-CA 123.122 2.548 . . . . 0.0 113.64 177.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.299 0 O-C-N 120.674 -1.266 . . . . 0.0 113.133 177.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.469 HG13 HD21 ' A' ' 6' ' ' ASN . 5.5 m . . . . . 0 C--O 1.235 0.3 0 CA-C-O 121.127 0.489 . . . . 0.0 111.442 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 1.8 p-10 -65.52 -92.82 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.579 1.152 . . . . 0.0 109.539 177.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -126.56 -22.37 3.96 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 125.3 1.44 . . . . 0.0 110.781 177.285 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.408 ' HB3' ' NZ ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -97.61 122.97 41.3 Favored 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 177.734 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.456 ' HA ' HG21 ' A' ' 1' ' ' VAL . 93.0 m-85 -69.78 161.75 29.2 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 114.883 1.438 . . . . 0.0 114.883 178.283 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.469 HD21 HG13 ' A' ' 1' ' ' VAL . 5.5 m-80 -94.3 173.3 7.7 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.774 0.797 . . . . 0.0 111.791 177.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.552 ' HG2' ' H ' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -53.56 -84.28 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 115.109 1.522 . . . . 0.0 115.109 -177.888 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.552 ' H ' ' HG2' ' A' ' 7' ' ' LYS . 0.9 OUTLIER -44.77 -43.55 8.65 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 123.288 1.518 . . . . 0.0 111.838 178.053 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.417 ' CD ' HD22 ' A' ' 6' ' ' ASN . 9.8 tt0 -43.27 -49.16 6.76 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 113.143 -1.844 . . . . 0.0 112.736 177.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.403 ' O ' ' HB3' ' A' ' 13' ' ' PHE . 35.1 mm-40 -66.88 -38.45 86.31 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 120.729 -0.388 . . . . 0.0 111.924 177.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 9.1 m120 -58.8 -47.45 84.73 Favored 'General case' 0 N--CA 1.47 0.573 0 O-C-N 120.152 -1.593 . . . . 0.0 109.045 177.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.5 -39.32 83.43 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 113.907 -1.497 . . . . 0.0 110.11 177.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.403 ' HB3' ' O ' ' A' ' 10' ' ' GLN . 50.4 t80 -56.48 -53.52 56.56 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-O 123.284 1.516 . . . . 0.0 109.725 177.349 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 39.2 m-85 -56.24 -43.53 78.73 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.143 -1.389 . . . . 0.0 110.647 176.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -60.27 -40.09 89.14 Favored 'General case' 0 C--N 1.332 -0.16 0 O-C-N 121.118 -0.989 . . . . 0.0 111.805 177.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.1 mt -58.33 -51.92 65.47 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.124 0 CA-C-O 122.374 1.083 . . . . 0.0 108.489 177.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.461 ' HA ' ' NH1' ' A' ' 27' ' ' ARG . 59.2 mt -59.87 -36.44 76.92 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 122.465 1.126 . . . . 0.0 112.645 177.423 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 22.6 t-160 -69.97 -11.66 61.04 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.624 1.57 . . . . 0.0 112.734 177.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 99.7 mt -62.36 124.85 84.2 Favored Pre-proline 0 CA--C 1.543 0.678 0 O-C-N 119.657 -1.902 . . . . 0.0 114.086 -178.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -70.02 -38.32 7.38 Favored 'Trans proline' 0 CA--C 1.531 0.375 0 C-N-CA 123.732 2.955 . . . . 0.0 117.611 -178.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -103.45 -15.16 15.97 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-O 126.102 2.858 . . . . 0.0 115.551 -177.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.46 HD21 ' N ' ' A' ' 27' ' ' ARG . 4.6 tt -90.92 123.37 34.38 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 110.103 -3.226 . . . . 0.0 107.019 177.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.507 ' HA ' ' HE ' ' A' ' 27' ' ' ARG . 1.7 p30 -151.5 -34.34 0.14 Allowed 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 118.088 2.625 . . . . 0.0 118.088 -176.322 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.654 ' H ' ' CD ' ' A' ' 24' ' ' GLU 0.254 0.0 OUTLIER -75.0 -132.66 0.01 OUTLIER 'General case' 0 N--CA 1.432 -1.342 0 CA-C-O 127.384 3.469 . . . . 0.0 116.162 -177.214 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.446 ' H ' ' HG2' ' A' ' 24' ' ' GLU . 13.1 mm-40 -68.0 -26.33 65.85 Favored 'General case' 0 C--N 1.315 -0.902 1 CA-C-N 107.879 -4.237 . . . . 0.0 112.728 -177.377 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.541 HE22 ' CD ' ' A' ' 55' ' ' GLN . 22.0 mt-30 -69.51 -50.15 47.86 Favored 'General case' 0 N--CA 1.446 -0.628 0 N-CA-C 104.803 -2.295 . . . . 0.0 104.803 177.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.507 ' HE ' ' HA ' ' A' ' 23' ' ' ASN . 3.0 tpp85 -48.24 -51.72 24.27 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 114.521 -1.218 . . . . 0.0 110.805 177.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 86.4 m-20 -59.81 -51.43 69.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 113.618 -1.628 . . . . 0.0 112.788 177.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.44 -44.11 76.04 Favored 'General case' 0 CA--C 1.528 0.113 0 O-C-N 121.136 -0.978 . . . . 0.0 110.861 -179.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 56.0 m-85 -67.28 -48.88 66.36 Favored 'General case' 0 N--CA 1.452 -0.369 0 O-C-N 121.457 -0.777 . . . . 0.0 110.226 176.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 11.2 mt -52.07 -46.92 43.47 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 O-C-N 119.516 -1.99 . . . . 0.0 112.547 177.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.305 0.0 OUTLIER -63.98 -49.0 74.2 Favored 'General case' 0 N--CA 1.436 -1.133 0 C-N-CA 124.914 1.285 . . . . 0.0 110.196 177.796 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 22.6 t -58.28 -37.07 74.27 Favored 'General case' 0 C--O 1.217 -0.616 0 O-C-N 120.978 -1.076 . . . . 0.0 109.842 177.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.8 mp -65.74 -41.18 92.48 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 121.199 1.818 . . . . 0.0 107.92 176.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.77 -42.15 71.36 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 120.203 -1.561 . . . . 0.0 110.345 177.504 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -84.0 -27.77 28.17 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 116.998 2.222 . . . . 0.0 116.998 177.486 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -79.45 160.12 70.77 Favored Pre-proline 0 C--O 1.239 0.518 0 N-CA-C 116.992 2.219 . . . . 0.0 116.992 -178.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_endo -102.38 -92.66 0.0 OUTLIER 'Trans proline' 0 CA--C 1.544 1.004 0 C-N-CA 123.199 2.599 . . . . 0.0 110.937 176.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 5.0 t -102.08 -11.11 19.11 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 119.499 -2.001 . . . . 0.0 115.337 177.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 12.2 mp0 -68.53 -8.93 45.74 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 118.12 -2.863 . . . . 0.0 114.946 -177.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.466 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 61.8 m -42.95 -35.02 1.08 Allowed 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 125.26 1.424 . . . . 0.0 112.384 177.05 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -51.57 -39.96 58.85 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 123.544 1.64 . . . . 0.0 112.962 178.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 13.3 m-80 -72.13 -46.63 55.81 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 122.677 1.227 . . . . 0.0 107.76 -179.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.466 ' HG ' ' HA ' ' A' ' 41' ' ' SER . 0.8 OUTLIER -56.73 -29.33 62.4 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-O 124.609 2.147 . . . . 0.0 113.588 177.234 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 52.2 tp -77.11 -51.11 11.58 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 112.766 -2.015 . . . . 0.0 106.474 -178.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -54.7 -33.19 60.57 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 122.672 1.225 . . . . 0.0 108.31 176.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -64.55 -61.6 2.11 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 114.783 -1.099 . . . . 0.0 111.935 177.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -51.58 -38.05 52.66 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.963 0.887 . . . . 0.0 112.014 177.64 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -65.25 -43.89 89.89 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 121.675 0.75 . . . . 0.0 110.054 177.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -62.77 -39.95 95.78 Favored 'General case' 0 C--O 1.233 0.216 0 O-C-N 120.452 -1.405 . . . . 0.0 108.606 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 51' ' ' LEU . 64.3 mt -62.88 -54.94 30.98 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 121.74 0.781 . . . . 0.0 109.707 177.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -44.82 -44.86 9.78 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-O 124.029 1.871 . . . . 0.0 111.466 -178.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 28.5 m-20 -67.08 -46.66 73.61 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 111.702 -2.499 . . . . 0.0 111.751 177.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -55.61 -46.45 77.36 Favored 'General case' 0 C--O 1.233 0.204 0 O-C-N 120.942 -1.099 . . . . 0.0 111.444 177.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.541 ' CD ' HE22 ' A' ' 26' ' ' GLN . 5.7 pm0 -84.98 14.13 5.26 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 177.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -79.54 158.02 74.11 Favored Pre-proline 0 CA--C 1.534 0.359 0 O-C-N 119.83 -1.794 . . . . 0.0 111.234 177.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -70.33 69.74 1.94 Allowed 'Trans proline' 0 CA--C 1.537 0.675 0 C-N-CA 124.404 3.403 . . . . 0.0 115.894 -178.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.536 0.411 0 C-N-CA 124.938 1.295 . . . . 0.0 112.822 177.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 33.5 m . . . . . 0 CA--C 1.529 0.154 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.407 ' CG ' ' H ' ' A' ' 3' ' ' ASN . 5.9 p-10 -77.68 -91.27 0.04 OUTLIER 'General case' 0 N--CA 1.445 -0.724 0 O-C-N 119.574 -1.954 . . . . 0.0 109.29 177.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.407 ' H ' ' CG ' ' A' ' 2' ' ' ASP . 24.3 m120 -132.63 5.81 4.01 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 114.158 1.17 . . . . 0.0 114.158 177.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 14.4 mptt -52.58 -55.72 20.28 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 122.829 2.559 . . . . 0.0 114.121 -178.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.492 ' CE2' ' HA ' ' A' ' 35' ' ' LYS . 14.3 m-85 -76.7 -178.78 4.96 Favored 'General case' 0 C--O 1.238 0.458 0 O-C-N 121.386 -0.821 . . . . 0.0 110.681 177.571 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.54 ' O ' ' HB3' ' A' ' 9' ' ' GLN . 36.0 m-80 -67.69 175.81 2.76 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 118.824 2.898 . . . . 0.0 118.824 -176.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.718 ' HD3' ' H ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -55.27 -77.77 0.02 OUTLIER 'General case' 0 C--O 1.238 0.488 0 C-N-CA 126.999 2.12 . . . . 0.0 115.35 -177.485 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -50.65 -46.6 58.49 Favored 'General case' 0 C--O 1.22 -0.456 0 N-CA-C 107.048 -1.464 . . . . 0.0 107.048 177.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.54 ' HB3' ' O ' ' A' ' 6' ' ' ASN 0.266 1.4 tm0? -39.42 -61.06 0.84 Allowed 'General case' 0 N--CA 1.432 -1.343 0 C-N-CA 127.261 2.224 . . . . 0.0 113.024 176.802 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.407 HE22 ' H ' ' A' ' 5' ' ' PHE . 51.7 mm-40 -59.79 -37.15 78.32 Favored 'General case' 0 C--O 1.233 0.199 0 O-C-N 120.227 -1.545 . . . . 0.0 111.409 177.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -59.26 -46.62 88.03 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 121.97 0.89 . . . . 0.0 109.194 177.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.448 ' O ' HD13 ' A' ' 16' ' ' ILE . . . -63.62 -37.03 85.78 Favored 'General case' 0 C--O 1.211 -0.932 0 C-N-CA 124.097 0.959 . . . . 0.0 109.142 177.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -54.23 -55.5 27.51 Favored 'General case' 0 C--O 1.237 0.416 0 O-C-N 119.708 -1.87 . . . . 0.0 108.723 177.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 54.1 m-85 -58.21 -45.97 86.67 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 113.165 -1.834 . . . . 0.0 112.202 176.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -55.24 -43.42 74.55 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 123.039 1.4 . . . . 0.0 111.597 177.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.448 HD13 ' O ' ' A' ' 12' ' ' ALA . 0.7 OUTLIER -58.65 -52.91 54.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 C-N-CA 126.537 1.935 . . . . 0.0 109.94 178.063 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 49.5 mt -62.62 -36.17 81.91 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-O 122.098 0.952 . . . . 0.0 113.043 177.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 6.3 t-80 -62.6 -21.51 65.69 Favored 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 127.487 2.315 . . . . 0.0 116.14 177.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.507 HD12 HD22 ' A' ' 22' ' ' LEU . 21.6 mt -63.08 105.63 0.7 Allowed Pre-proline 0 C--N 1.328 -0.34 0 N-CA-C 118.315 2.709 . . . . 0.0 118.315 -176.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 21.9 Cg_endo -72.81 -1.95 11.19 Favored 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 123.024 2.483 . . . . 0.0 112.64 178.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.481 HD21 ' ND2' ' A' ' 52' ' ' ASN . 36.2 p-10 -132.94 27.41 4.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 122.794 1.283 . . . . 0.0 114.3 178.068 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.507 HD22 HD12 ' A' ' 19' ' ' LEU . 7.2 tt -160.02 111.82 2.01 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 122.947 1.356 . . . . 0.0 109.203 177.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -154.82 2.94 0.21 Allowed 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 117.249 2.315 . . . . 0.0 117.249 -177.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.702 ' H ' ' CD ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -87.16 -132.88 0.07 Allowed 'General case' 0 N--CA 1.418 -2.05 0 CA-C-O 125.485 2.564 . . . . 0.0 112.796 -177.59 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.412 ' HA ' ' HB2' ' A' ' 28' ' ' ASN . 0.4 OUTLIER -76.3 -22.07 55.47 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 109.49 -3.504 . . . . 0.0 114.086 -177.227 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.424 ' NE2' ' NE2' ' A' ' 55' ' ' GLN . 27.2 mt-30 -73.86 -48.99 27.19 Favored 'General case' 0 N--CA 1.447 -0.606 0 N-CA-C 105.251 -2.129 . . . . 0.0 105.251 177.392 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.465 ' CZ ' ' HB3' ' A' ' 27' ' ' ARG . 0.3 OUTLIER -56.4 -48.36 77.09 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-N 114.698 -1.137 . . . . 0.0 110.543 177.413 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.412 ' HB2' ' HA ' ' A' ' 25' ' ' GLU . 73.0 m-20 -59.97 -47.74 84.58 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 113.724 -1.58 . . . . 0.0 111.809 177.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.57 -48.09 78.13 Favored 'General case' 0 C--N 1.333 -0.13 0 O-C-N 121.089 -1.007 . . . . 0.0 110.087 178.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -61.99 -47.46 84.69 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 121.633 -0.667 . . . . 0.0 110.679 177.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.457 HD12 ' NH1' ' A' ' 27' ' ' ARG . 1.6 mt -52.42 -44.81 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.401 0 O-C-N 119.111 -2.243 . . . . 0.0 110.405 177.098 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . 0.271 5.1 tp60 -60.92 -48.2 82.89 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 123.867 0.867 . . . . 0.0 110.383 177.456 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 27.6 t -65.13 -28.29 69.32 Favored 'General case' 0 C--O 1.225 -0.208 0 O-C-N 121.337 -0.852 . . . . 0.0 111.714 177.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 9.7 mp -78.67 -24.61 45.03 Favored 'General case' 0 N--CA 1.445 -0.69 0 O-C-N 119.857 -1.777 . . . . 0.0 108.432 176.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.492 ' HA ' ' CE2' ' A' ' 5' ' ' PHE . 1.1 pttm -69.09 -54.09 16.84 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 102.375 -3.194 . . . . 0.0 102.375 176.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.431 ' CG ' ' HZ3' ' A' ' 35' ' ' LYS . 70.3 m-20 -91.31 70.13 6.06 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-O 124.086 1.898 . . . . 0.0 108.581 177.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.505 ' CG ' HE21 ' A' ' 9' ' ' GLN . 24.4 t0 -75.28 115.65 47.13 Favored Pre-proline 0 C--N 1.321 -0.647 0 CA-C-N 111.482 -2.599 . . . . 0.0 115.068 -177.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 0.2 OUTLIER -97.19 -121.02 0.0 OUTLIER 'Trans proline' 0 C--N 1.352 0.742 0 C-N-CA 125.246 3.964 . . . . 0.0 114.532 177.916 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 87.5 p -102.5 -59.72 1.66 Allowed 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 117.63 2.456 . . . . 0.0 117.63 179.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.446 ' CD ' ' H ' ' A' ' 40' ' ' GLN . 1.1 pm0 -69.95 32.51 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 119.269 3.063 . . . . 0.0 119.269 -176.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.59 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 18.9 m -52.4 -39.39 60.84 Favored 'General case' 0 N--CA 1.475 0.775 0 O-C-N 119.279 -2.138 . . . . 0.0 113.62 178.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.8 -38.6 72.79 Favored 'General case' 0 CA--C 1.538 0.488 0 O-C-N 120.297 -1.502 . . . . 0.0 109.092 176.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.4 t30 -64.94 -55.21 20.54 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 104.339 -2.467 . . . . 0.0 104.339 177.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.59 ' HG ' ' HA ' ' A' ' 41' ' ' SER . 2.1 mt -48.37 -28.36 3.14 Favored 'General case' 0 N--CA 1.467 0.424 0 N-CA-C 116.14 1.904 . . . . 0.0 116.14 177.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 13.4 tp -74.89 -54.45 7.23 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 106.87 -1.53 . . . . 0.0 106.87 -178.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.17 -35.48 69.61 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 113.506 -1.679 . . . . 0.0 110.598 177.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -64.47 -62.01 1.86 Allowed 'General case' 0 C--O 1.237 0.435 0 CA-C-O 122.685 1.231 . . . . 0.0 111.125 -178.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -51.96 -43.13 63.4 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 123.457 1.599 . . . . 0.0 111.02 177.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 35.7 tptt -58.94 -41.9 88.52 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.197 -1.365 . . . . 0.0 110.947 177.788 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.403 ' N ' ' HZ2' ' A' ' 50' ' ' LYS . 0.2 OUTLIER -63.34 -38.45 91.18 Favored 'General case' 0 N--CA 1.457 -0.077 0 O-C-N 120.399 -1.438 . . . . 0.0 108.591 -179.695 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 71.5 mt -59.6 -49.65 76.95 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 122.904 1.335 . . . . 0.0 110.418 177.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.667 ' C ' HD22 ' A' ' 52' ' ' ASN . 0.0 OUTLIER -50.68 -49.75 56.55 Favored 'General case' 0 C--N 1.334 -0.104 0 CA-C-O 124.156 1.932 . . . . 0.0 112.51 177.366 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -62.39 -49.12 76.77 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 111.643 -2.526 . . . . 0.0 111.379 177.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -57.9 -44.77 86.98 Favored 'General case' 0 N--CA 1.453 -0.29 0 O-C-N 121.25 -0.906 . . . . 0.0 113.01 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.424 ' NE2' ' NE2' ' A' ' 26' ' ' GLN . 29.8 pt20 -80.09 8.87 6.31 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 177.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -75.29 -177.69 0.73 Allowed Pre-proline 0 CA--C 1.546 0.817 0 O-C-N 119.945 -1.722 . . . . 0.0 113.201 177.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_exo -72.27 58.92 3.03 Favored 'Trans proline' 0 CA--C 1.539 0.738 0 C-N-CA 124.434 3.423 . . . . 0.0 115.157 177.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.515 0 C-N-CA 125.383 1.473 . . . . 0.0 112.28 -179.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' VAL . . . . . 0.46 ' N ' ' OD1' ' A' ' 6' ' ' ASN . 6.8 t . . . . . 0 CA--C 1.532 0.261 0 CA-C-O 117.1 -1.428 . . . . 0.0 110.633 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.36 -160.79 0.16 Allowed 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 123.619 2.918 . . . . 0.0 113.629 -177.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 3.1 p30 -69.68 -26.51 64.41 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 119.091 -2.255 . . . . 0.0 112.943 177.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -85.9 -60.49 2.0 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 113.912 -1.495 . . . . 0.0 112.564 178.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.424 ' CZ ' ' HA ' ' A' ' 35' ' ' LYS . 5.9 m-30 -70.53 62.29 0.25 Allowed 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 117.008 2.225 . . . . 0.0 117.008 -177.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.46 ' OD1' ' N ' ' A' ' 1' ' ' VAL . 77.3 m-20 -150.26 -40.96 0.13 Allowed 'General case' 0 N--CA 1.464 0.273 0 C-N-CA 125.822 1.649 . . . . 0.0 111.787 177.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -88.26 -150.44 0.18 Allowed 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 117.032 2.234 . . . . 0.0 117.032 -177.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -52.85 -29.63 29.06 Favored 'General case' 0 N--CA 1.471 0.598 0 O-C-N 120.478 -1.389 . . . . 0.0 113.469 -177.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.418 ' NE2' ' O ' ' A' ' 34' ' ' LEU 0.314 3.0 tm0? -38.06 -52.32 1.4 Allowed 'General case' 0 N--CA 1.425 -1.687 0 C-N-CA 128.537 2.735 . . . . 0.0 111.815 177.655 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 48.0 mm-40 -72.82 -31.37 64.75 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.06 -0.973 . . . . 0.0 112.073 -178.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASN . . . . . 0.407 HD22 ' C ' ' A' ' 11' ' ' ASN . 0.1 OUTLIER -64.81 -45.36 86.58 Favored 'General case' 0 CA--C 1.528 0.122 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 177.425 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.7 -42.46 98.97 Favored 'General case' 0 N--CA 1.457 -0.108 0 CA-C-O 121.153 0.502 . . . . 0.0 110.566 177.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -55.45 -50.83 68.81 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-O 123.672 1.701 . . . . 0.0 111.716 177.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 2.1 m-85 -60.5 -46.89 88.47 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 113.876 -1.511 . . . . 0.0 111.007 177.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.62 -41.84 74.06 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 122.753 1.264 . . . . 0.0 108.886 177.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -57.14 -56.65 13.66 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.106 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 177.079 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 69.6 mt -55.79 -28.9 58.48 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 122.883 1.325 . . . . 0.0 113.521 177.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -72.26 -13.2 61.45 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 125.544 1.538 . . . . 0.0 113.522 177.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 80.8 mt -55.13 119.76 25.15 Favored Pre-proline 0 CA--C 1.544 0.741 0 O-C-N 119.985 -1.697 . . . . 0.0 112.093 177.906 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -73.86 -11.17 23.65 Favored 'Trans proline' 0 C--N 1.35 0.638 0 C-N-CA 125.129 3.886 . . . . 0.0 118.795 -177.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.497 HD21 ' HB2' ' A' ' 56' ' ' ALA . 4.4 p-10 -155.45 58.93 0.63 Allowed 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 124.27 1.986 . . . . 0.0 112.737 177.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 7.6 tt -160.28 123.0 3.36 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 112.139 -2.3 . . . . 0.0 108.269 177.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -154.33 -13.29 0.13 Allowed 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 117.061 2.245 . . . . 0.0 117.061 -177.753 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.657 ' H ' ' CD ' ' A' ' 24' ' ' GLU . 0.0 OUTLIER -75.89 -132.3 0.01 OUTLIER 'General case' 0 N--CA 1.425 -1.701 0 CA-C-O 125.911 2.767 . . . . 0.0 113.283 -177.478 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.408 ' HA ' ' HB3' ' A' ' 28' ' ' ASN . 0.0 OUTLIER -66.07 -27.32 67.99 Favored 'General case' 0 C--N 1.31 -1.134 0 CA-C-N 109.69 -3.414 . . . . 0.0 115.159 -177.072 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.61 HE22 ' NE2' ' A' ' 55' ' ' GLN . 16.1 mt-30 -74.1 -52.97 10.96 Favored 'General case' 0 N--CA 1.441 -0.896 0 N-CA-C 105.653 -1.98 . . . . 0.0 105.653 177.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 3.9 tpp180 -48.93 -49.11 41.77 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 124.355 2.026 . . . . 0.0 111.665 177.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.408 ' HB3' ' HA ' ' A' ' 25' ' ' GLU . 47.9 t-20 -55.73 -58.49 7.63 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 109.59 -3.459 . . . . 0.0 111.719 178.008 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.6 -46.57 88.55 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 121.599 -0.688 . . . . 0.0 111.324 -178.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 58.5 m-85 -61.5 -46.33 90.43 Favored 'General case' 0 C--O 1.219 -0.502 0 O-C-N 121.188 -0.945 . . . . 0.0 109.859 177.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 29.4 mt -54.62 -51.66 48.67 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-N 121.425 1.92 . . . . 0.0 110.775 177.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.37 -56.6 9.06 Favored 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 125.88 1.672 . . . . 0.0 111.501 177.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 32.0 t -63.3 -30.78 71.86 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 112.205 -2.271 . . . . 0.0 111.506 178.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.418 ' O ' ' NE2' ' A' ' 9' ' ' GLN . 1.4 mm? -65.5 -45.0 85.28 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 105.875 -1.898 . . . . 0.0 105.875 177.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . 0.479 ' HZ3' ' CG ' ' A' ' 36' ' ' ASP . 0.0 OUTLIER -60.17 -42.21 94.5 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 119.958 -1.714 . . . . 0.0 110.709 177.419 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.479 ' CG ' ' HZ3' ' A' ' 35' ' ' LYS . 45.4 m-20 -70.97 -46.27 62.62 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 117.503 2.408 . . . . 0.0 117.503 177.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -79.64 142.3 57.18 Favored Pre-proline 0 CA--C 1.531 0.232 0 N-CA-C 119.575 3.176 . . . . 0.0 119.575 -178.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.46 ' HG2' ' H ' ' A' ' 39' ' ' SER . 89.1 Cg_endo -86.51 -74.35 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.098 1.865 . . . . 0.0 110.323 176.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.46 ' H ' ' HG2' ' A' ' 38' ' ' PRO . 61.0 m -102.25 -18.34 15.52 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 120.689 3.589 . . . . 0.0 120.689 -177.738 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 32.7 mt-30 -70.79 -9.71 58.0 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 125.866 3.939 . . . . 0.0 114.296 -177.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.402 ' HA ' ' HG ' ' A' ' 44' ' ' LEU . 74.9 m -43.87 -29.13 0.51 Allowed 'General case' 0 CA--C 1.515 -0.367 0 C-N-CA 125.664 1.586 . . . . 0.0 114.214 177.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.19 -44.43 97.3 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 124.195 1.95 . . . . 0.0 109.572 177.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.405 ' C ' HD22 ' A' ' 43' ' ' ASN . 0.2 OUTLIER -71.37 -52.73 17.07 Favored 'General case' 0 N--CA 1.451 -0.397 0 N-CA-C 105.15 -2.167 . . . . 0.0 105.15 -179.98 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.402 ' HG ' ' HA ' ' A' ' 41' ' ' SER . 1.1 mt -51.45 -29.51 16.4 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-O 123.834 1.778 . . . . 0.0 114.69 177.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 63.0 tp -74.46 -50.67 17.4 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 -177.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -56.8 -37.98 71.9 Favored 'General case' 0 N--CA 1.449 -0.495 0 CA-C-N 113.821 -1.536 . . . . 0.0 107.497 177.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -63.63 -52.52 60.46 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 119.498 -0.881 . . . . 0.0 110.992 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -54.42 -40.73 68.56 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 122.428 1.108 . . . . 0.0 111.417 177.312 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.508 ' HZ2' ' HB2' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -63.96 -41.49 97.55 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 121.115 -0.991 . . . . 0.0 110.509 177.288 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt -61.89 -39.07 90.68 Favored 'General case' 0 CA--C 1.519 -0.241 0 O-C-N 121.105 -0.997 . . . . 0.0 108.7 177.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 53.4 mt -62.3 -45.58 92.61 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 122.141 0.972 . . . . 0.0 110.454 177.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -59.21 -49.61 77.17 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 119.498 -2.001 . . . . 0.0 110.668 177.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -52.91 -42.75 65.66 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 124.999 1.319 . . . . 0.0 111.31 177.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.01 -30.47 70.32 Favored 'General case' 0 CA--C 1.53 0.181 0 O-C-N 121.527 -0.733 . . . . 0.0 111.74 177.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.61 ' NE2' HE22 ' A' ' 26' ' ' GLN . 40.0 mt-30 -82.53 -34.31 27.92 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 123.025 1.393 . . . . 0.0 111.994 177.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.497 ' HB2' HD21 ' A' ' 21' ' ' ASN . . . -67.89 138.37 92.8 Favored Pre-proline 0 CA--C 1.542 0.645 0 CA-C-N 114.784 -1.098 . . . . 0.0 113.378 177.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -45.29 166.98 0.05 OUTLIER 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 125.251 3.967 . . . . 0.0 118.261 179.127 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 42.8 mmtm . . . . . 0 CA--C 1.534 0.331 0 CA-C-N 114.164 -1.38 . . . . 0.0 110.279 -177.823 . . . . . . . . 0 0 . 1 stop_ save_